*HEADER    LIGASE                                  11-MAY-01   1IN1              
*TITLE     NMR STRUCTURE OF HUMAN DNA LIGASE IIIALPHA BRCT DOMAIN                
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: DNA LIGASE III;                                            
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: BRCT DOMAIN;                                               
*COMPND   5 SYNONYM: POLYDEOXYRIBONUCLEOTIDE SYNTHASE [ATP];                     
*COMPND   6 EC: 6.5.1.1;                                                         
*COMPND   7 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI;                               
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   7 EXPRESSION_SYSTEM_PLASMID: BL21(DE3)                                 
*KEYWDS    PARALLEL BETA SHEET                                                   
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    M.COSMAN, V.V.KRISHNAN, K.H.THORNTON, M.P.THELAN                      
*REVDAT   1   25-MAY-01 1IN1    0                                                


 854 VAL  HA   HN    9.0  2.1 # from cthmqc
 855 ARG  HA   HN    9.6  2.1 
 856 LEU  HA   HN    6.8  2.1 
 857 TYR  HA   HN    6.0  2.1 
 857 TYR  HA   HN    7.9  2.1 # from cthmqc
 858 LEU  HA   HN    8.7  2.1 
# ** ALFA 1
 866 SER  HA   HN    4.1  2.1 
 868 LEU  HA   HN    4.2  2.1 
 872 PHE  HA   HN    4.1  2.1 
# ** BETA  2
 878 ASP-  HA   HN   10.1  2.1 
 879 LEU  HA   HN    7.5  2.1 # from cthmqc
 880 VAL  HA   HN    7.1  2.1 
 881 GLN  HA   HN    8.0  2.1 
# ** BETA  3
 891 VAL  HA   HN    8.9  2.1 
 892 LEU  HA   HN    9.8  2.1 # from cthmqc
# ** BETA  4
 902 GLN  HA   HN    7.8  2.1 # from cthmqc
 903 GLN  HA   HN    8.4  2.1 # from cthmqc
 904 VAL  HA   HN    9.7  2.1 
 905 SER  HA   HN    8.6  2.1 
# ** ALFA 3
 907 GLU-  HA   HN    4.8  2.1 
 908 TRP  HA   HN    6.1  2.1 
 909 ILE  HA   HN    4.4  2.1 
 910 TRP  HA   HN    3.9  2.1 
 911 ALA  HA   HN    4.8  2.1 
 912 CYS  HA   HN    5.1  2.1 
 913 ILE  HA   HN    3.4  2.1 
 914 ARG  HA   HN    4.1  2.1 
# ** BETA  3
 891 VAL  HA   HN l3xb.lol000644 005670 000000 00000004406 07276606122 012442 0ustar00krishsys000000 000000 # beta2 - beta1
858 LEU  
         HN    880 VAL  O       1.80 
          N    880 VAL  O       2.70 
880 VAL  
         HN    856 LEU  O       1.80 
          N    856 LEU  O       2.70 
856 LEU  
         HN    878 ASP- O       1.80 
          N    878 ASP- O       2.70 
878 ASP- 
         HN    854 VAL  O       1.80 
          N    854 VAL  O       2.70 
# beta 3 to beta 1
892 LEU  
         HN    857 TYR  O       1.80 
          N    857 TYR  O       2.70 
857 TYR  
         HN    890 HIS  O       1.80 
          N    890 HIS  O       2.70 
890 HIS  
         HN    855 ARG  O       1.80 
          N    855 ARG  O       2.70 
855 ARG  
         HN    888 ALA  O       1.80 
          N    888 ALA  O       2.70 
# beta 4 to beta 3
904 VAL  
         HN    891 VAL  O       1.80 
          N    891 VAL  O       2.70 
891 VAL  
         HN    902 GLN  O       1.80 
          N    902 GLN  O       2.70 
902 GLN  
         HN    889 THR  O       1.80 
          N    889 THR  O       2.70 
# helix 1
867 ARG  
         HN    863 PRO  O       1.80 
          N    863 PRO  O       2.70 
868 LEU  
         HN    864 ASP- O       1.80 
          N    864 ASP- O       2.70 
869 ARG  
         HN    865 PHE  O       1.80 
          N    865 PHE  O       2.70 
870 ARG  
         HN    866 SER  O       1.80 
          N    866 SER  O       2.70 
871 TYR  
         HN    867 ARG  O       1.80 
          N    867 ARG  O       2.70 
872 PHE  
         HN    868 LEU  O       1.80 
          N    868 LEU  O       2.70 
873 VAL  
         HN    869 ARG  O       1.80 
          N    869 ARG  O       2.70 
874 ALA  
         HN    870 ARG  O       1.80 
          N    870 ARG  O       2.70 
# helix 2
908 TRP  
         HN    904 VAL  O       1.80 
          N    904 VAL  O       2.70 
909 ILE  
         HN    905 SER  O       1.80 
          N    905 SER  O       2.70 
910 TRP  
         HN    906 PRO  O       1.80 
          N    906 PRO  O       2.70 
911 ALA  
         HN    907 GLU- O       1.80 
          N    907 GLU- O       2.70 
912 CYS  
         HN    908 TRP  O       1.80 
          N    908 TRP  O       2.70 
913 ILE  
         HN    909 ILE  O       1.80 
          N    909 ILE  O       2.70 
914 ARG  
         HN    910 TRP  O       1.80 
          N    910 TRP  O       2.70 
ILE  
         HN    905 SER  O       1.80 
          N    905 SER  O       2.70 
910 TRP  
         HN    906 PRO  O       1.80 
          N    906 PRO  O       2.70 
911 ALA  
         HN    907 GLU- O       1.80 
          N    907 GLU- O       2.l3xb.upl000644 005670 000000 00000110777 07276606133 012467 0ustar00krishsys000000 000000 #  252 intra residue
#  228 sequential
#  144 medium range
#  355 long range
#    0 intermolecular
# intra residue
837 ALA  HN    837 ALA  QB      4.00 
838 ASP- HN    838 ASP- QB      3.50 
839 GLU- HA    839 GLU- QG      3.30 
839 GLU- HN    839 GLU- QB      3.50 
839 GLU- HN    839 GLU- QG      3.50 
840 THR  HA    840 THR  QG2     3.20 
840 THR  HN    840 THR  QG2     4.00 
841 LEU  HA    841 LEU  QQD     3.80 
841 LEU  HG    841 LEU  HA      3.30 
841 LEU  HN    841 LEU  QB      2.90 
841 LEU  QQD   841 LEU  QB      3.20 
842 CYS  HN    842 CYS  QB      3.50 
843 GLN  HN    843 GLN  QB      3.50 
843 GLN  HN    843 GLN  QG      5.00 
843 GLN  QE2   843 GLN  QG      3.30 
843 GLN  QG    843 GLN  HA      2.70 
844 THR  HA    844 THR  QG2     3.20 
844 THR  HN    844 THR  HB      5.00 
844 THR  HN    844 THR  QG2     5.50 
845 LYS+ HA    845 LYS+ QD      3.30 
845 LYS+ HA    845 LYS+ QG      3.30 
845 LYS+ HN    845 LYS+ QB      3.50 
845 LYS+ HN    845 LYS+ QG      5.00 
845 LYS+ QE    845 LYS+ QG      2.70 
846 VAL  HN    846 VAL  HB      3.50 
846 VAL  QQG   846 VAL  HA      3.20 
847 LEU  HA    847 LEU  QQD     3.20 
847 LEU  QQD   847 LEU  QB      3.80 
848 LEU  HA    848 LEU  HG      3.30 
848 LEU  HA    848 LEU  QQD     3.20 
848 LEU  HN    848 LEU  HG      3.50 
848 LEU  HN    848 LEU  QB      3.50 
848 LEU  HN    848 LEU  QQD     5.50 
848 LEU  QQD   848 LEU  QB      3.20 
849 ASP- HN    849 ASP- QB      2.90 
850 ILE  HA    850 ILE  QD1     3.80 
850 ILE  HA    850 ILE  QG1     5.00 
850 ILE  HA    850 ILE  QG2     3.80 
850 ILE  HN    850 ILE  HB      5.00 
850 ILE  HN    850 ILE  QG1     5.00 
850 ILE  QD1   850 ILE  HB      3.80 
850 ILE  QG2   850 ILE  HN      5.50 
851 PHE  CG    851 PHE  HA      3.30 
851 PHE  CG    851 PHE  HN      3.50 
851 PHE  HN    851 PHE  QB      5.00 
852 THR  HA    852 THR  QG2     3.20 
852 THR  HN    852 THR  HB      2.90 
852 THR  HN    852 THR  QG2     5.50 
854 VAL  HA    854 VAL  QQG     3.80 
854 VAL  HN    854 VAL  HB      2.90 
854 VAL  HN    854 VAL  QQG     3.40 
855 ARG  HA    855 ARG  QG      5.00 
855 ARG  HE    855 ARG  QB      5.00 
855 ARG  HN    855 ARG  QB      5.00 
855 ARG  HN    855 ARG  QG      3.50 
855 ARG  QB    855 ARG  QD      5.00 
855 ARG  QD    855 ARG  HA      5.00 
856 LEU  HA    856 LEU  QQD     3.80 
856 LEU  HN    856 LEU  QB      3.50 
856 LEU  QQD   856 LEU  HN      5.50 
856 LEU  QQD   856 LEU  QB      3.80 
857 TYR  CG    857 TYR  HA      3.30 
857 TYR  CG    857 TYR  QB      3.30 
857 TYR  HN    857 TYR  CG      5.00 
857 TYR  HN    857 TYR  QB      3.50 
858 LEU  HA    858 LEU  HG      5.00 
858 LEU  HA    858 LEU  QQD     3.80 
858 LEU  HN    858 LEU  HG      5.00 
858 LEU  HN    858 LEU  QB      2.90 
858 LEU  HN    858 LEU  QQD     5.50 
858 LEU  QB    858 LEU  QQD     3.80 
861 SER  HN    861 SER  QB      3.50 
862 THR  HA    862 THR  QG2     3.80 
862 THR  HN    862 THR  HB      2.90 
862 THR  HN    862 THR  QG2     4.00 
864 ASP- HN    864 ASP- QB      3.50 
865 PHE  CG    865 PHE  HA      2.70 
865 PHE  CG    865 PHE  QB      2.70 
865 PHE  HN    865 PHE  CG      3.50 
865 PHE  HN    865 PHE  QB      2.90 
866 SER  HN    866 SER  QB      2.90 
867 ARG  HA    867 ARG  QG      5.00 
867 ARG  HE    867 ARG  QG      5.00 
867 ARG  HN    867 ARG  QB      2.90 
867 ARG  HN    867 ARG  QG      3.50 
867 ARG  QB    867 ARG  QD      3.30 
868 LEU  HA    868 LEU  HG      5.00 
868 LEU  HA    868 LEU  QQD     3.80 
868 LEU  HN    868 LEU  HG      2.90 
868 LEU  HN    868 LEU  QB      2.90 
868 LEU  HN    868 LEU  QQD     4.00 
868 LEU  QQD   868 LEU  QB      3.80 
869 ARG  HA    869 ARG  QD      5.00 
869 ARG  HA    869 ARG  QG      5.00 
869 ARG  HN    869 ARG  QB      2.90 
869 ARG  HN    869 ARG  QG      5.00 
869 ARG  QD    869 ARG  QB      3.30 
871 TYR  CG    871 TYR  HN      3.50 
871 TYR  CG    871 TYR  QB      3.30 
871 TYR  HA    871 TYR  CG      3.30 
871 TYR  HN    871 TYR  QB      3.50 
872 PHE  HN    872 PHE  QB      2.90 
873 VAL  HA    873 VAL  QQG     3.80 
873 VAL  HN    873 VAL  HB      2.90 
873 VAL  HN    873 VAL  QQG     3.40 
874 ALA  QB    874 ALA  HN      4.00 
875 PHE  CG    875 PHE  QB      3.30 
875 PHE  HA    875 PHE  CG      3.30 
875 PHE  HN    875 PHE  CG      3.50 
875 PHE  HN    875 PHE  QB      3.50 
876 ASP- HN    876 ASP- QB      5.00 
878 ASP- HN    878 ASP- QB      3.50 
879 LEU  HA    879 LEU  QQD     3.20 
879 LEU  QQD   879 LEU  QB      3.20 
880 VAL  HA    880 VAL  QQG     3.20 
880 VAL  HN    880 VAL  HB      3.50 
880 VAL  HN    880 VAL  QQG     3.40 
881 GLN  HA    881 GLN  QG      2.70 
881 GLN  HN    881 GLN  QB      2.90 
881 GLN  HN    881 GLN  QG      2.90 
881 GLN  QE2   881 GLN  QB      5.00 
881 GLN  QE2   881 GLN  QG      3.30 
882 GLU- HA    882 GLU- QG      2.70 
882 GLU- HN    882 GLU- QB      2.90 
883 PHE  HA    883 PHE  CG      5.00 
883 PHE  HN    883 PHE  CG      3.50 
883 PHE  HN    883 PHE  QB      3.50 
883 PHE  QB    883 PHE  CG      3.30 
884 ASP- HN    884 ASP- QB      3.50 
885 MET  HA    885 MET  QE      5.50 
885 MET  HA    885 MET  QG      3.30 
885 MET  HN    885 MET  QB      5.00 
885 MET  HN    885 MET  QG      2.90 
885 MET  QB    885 MET  QE      3.80 
885 MET  QE    885 MET  QG      3.80 
886 THR  HA    886 THR  QG2     3.20 
886 THR  HN    886 THR  HB      3.50 
886 THR  HN    886 THR  QG2     3.40 
887 SER  HN    887 SER  QB      3.50 
888 ALA  HN    888 ALA  QB      3.40 
889 THR  HA    889 THR  QG2     3.20 
890 HIS  HA    890 HIS  HD2     5.00 
890 HIS  HD2   890 HIS  QB      3.30 
890 HIS  HN    890 HIS  QB      3.50 
891 VAL  HA    891 VAL  QQG     3.80 
891 VAL  HN    891 VAL  QQG     3.40 
892 LEU  HA    892 LEU  HG      3.30 
892 LEU  HA    892 LEU  QQD     5.50 
892 LEU  HN    892 LEU  QB      3.50 
892 LEU  HN    892 LEU  QQD     5.50 
892 LEU  QQD   892 LEU  QB      3.20 
894 SER  HN    894 SER  QB      3.50 
895 ARG  HA    895 ARG  QD      5.00 
895 ARG  HA    895 ARG  QG      3.30 
895 ARG  HE    895 ARG  QB      5.00 
895 ARG  HE    895 ARG  QG      3.30 
895 ARG  HN    895 ARG  QB      2.90 
895 ARG  HN    895 ARG  QG      3.50 
895 ARG  QB    895 ARG  QD      3.30 
896 ASP- HN    896 ASP- QB      2.90 
897 LYS+ HA    897 LYS+ QE      5.00 
897 LYS+ HA    897 LYS+ QG      3.30 
897 LYS+ HN    897 LYS+ QB      2.90 
897 LYS+ HN    897 LYS+ QG      2.90 
897 LYS+ QD    897 LYS+ QB      2.70 
897 LYS+ QG    897 LYS+ QE      2.70 
898 ASN  HN    898 ASN  QB      5.00 
898 ASN  QD2   898 ASN  QB      3.30 
900 ALA  HN    900 ALA  QB      3.40 
901 ALA  HN    901 ALA  QB      3.40 
902 GLN  HA    902 GLN  QG      3.30 
902 GLN  HN    902 GLN  QB      2.90 
902 GLN  HN    902 GLN  QG      3.50 
902 GLN  QE2   902 GLN  QB      5.00 
902 GLN  QE2   902 GLN  QG      2.70 
903 GLN  HA    903 GLN  QG      3.30 
903 GLN  HN    903 GLN  QB      2.90 
903 GLN  HN    903 GLN  QG      5.00 
903 GLN  QE2   903 GLN  QB      5.00 
903 GLN  QE2   903 GLN  QG      3.30 
904 VAL  HA    904 VAL  QQG     3.80 
904 VAL  HN    904 VAL  QQG     3.40 
905 SER  HN    905 SER  QB      3.50 
907 GLU- HN    907 GLU- QB      2.90 
907 GLU- HN    907 GLU- QG      5.00 
907 GLU- QG    907 GLU- HA      3.30 
908 TRP  CG    908 TRP  QB      5.00 
908 TRP  HA    908 TRP  CG      3.30 
908 TRP  HE1   908 TRP  CG      2.70 
908 TRP  HE1   908 TRP  HZ2     2.70 
908 TRP  HE1   908 TRP  QB      5.00 
908 TRP  HE3   908 TRP  HA      5.00 
908 TRP  HE3   908 TRP  HH2     5.00 
908 TRP  HE3   908 TRP  QB      3.30 
908 TRP  HH2   908 TRP  HZ2     2.70 
908 TRP  HN    908 TRP  QB      3.50 
908 TRP  HZ3   908 TRP  HE3     2.70 
908 TRP  HZ3   908 TRP  HH2     2.70 
908 TRP  HZ3   908 TRP  HZ2     3.30 
909 ILE  HA    909 ILE  QG1     5.00 
909 ILE  HA    909 ILE  QG2     3.80 
909 ILE  HN    909 ILE  HB      2.90 
909 ILE  HN    909 ILE  QD1     4.00 
909 ILE  HN    909 ILE  QG1     3.50 
909 ILE  HN    909 ILE  QG2     4.00 
909 ILE  QD1   909 ILE  HA      3.80 
909 ILE  QD1   909 ILE  HB      3.80 
910 TRP  HE1   910 TRP  CG      2.70 
910 TRP  HE1   910 TRP  HZ2     2.70 
910 TRP  HE3   910 TRP  HA      3.30 
910 TRP  HE3   910 TRP  HZ3     2.70 
910 TRP  HH2   910 TRP  HZ2     2.70 
910 TRP  HN    910 TRP  QB      3.50 
910 TRP  HZ2   910 TRP  HZ3     5.00 
910 TRP  HZ3   910 TRP  HH2     2.70 
911 ALA  HN    911 ALA  QB      3.40 
912 CYS  HN    912 CYS  QB      3.50 
913 ILE  HA    913 ILE  QD1     5.50 
913 ILE  HA    913 ILE  QG2     3.80 
913 ILE  HN    913 ILE  HB      2.90 
913 ILE  HN    913 ILE  QD1     5.50 
913 ILE  HN    913 ILE  QG2     4.00 
913 ILE  QD1   913 ILE  HB      3.20 
914 ARG  HA    914 ARG  QD      5.00 
914 ARG  HA    914 ARG  QG      3.30 
914 ARG  HN    914 ARG  QB      2.90 
914 ARG  HN    914 ARG  QG      5.00 
914 ARG  QB    914 ARG  QD      3.30 
915 LYS+ HA    915 LYS+ QD      2.70 
915 LYS+ HA    915 LYS+ QE      5.00 
915 LYS+ HN    915 LYS+ QB      3.50 
915 LYS+ HN    915 LYS+ QG      3.50 
915 LYS+ QD    915 LYS+ QB      2.70 
915 LYS+ QG    915 LYS+ HA      5.00 
915 LYS+ QG    915 LYS+ QE      3.30 
916 ARG  HA    916 ARG  QG      3.30 
916 ARG  HN    916 ARG  QB      3.50 
916 ARG  HN    916 ARG  QG      3.50 
917 ARG  HA    917 ARG  QG      5.00 
917 ARG  HN    917 ARG  QB      3.50 
917 ARG  HN    917 ARG  QG      3.50 
917 ARG  QB    917 ARG  QD      3.30 
917 ARG  QD    917 ARG  HA      3.30 
918 LEU  HA    918 LEU  QQD     3.20 
918 LEU  HG    918 LEU  HA      5.00 
918 LEU  HN    918 LEU  QB      2.90 
918 LEU  HN    918 LEU  QQD     4.00 
918 LEU  QB    918 LEU  QQD     3.20 
919 VAL  HA    919 VAL  QQG     3.20 
919 VAL  HN    919 VAL  QQG     3.40 
920 ALA  HN    920 ALA  QB      3.40 
922 CYS  HN    922 CYS  QB      5.00 
# sequential
837 ALA  HN    836 SER  HA      5.00 
837 ALA  HN    838 ASP- HN      5.00 
838 ASP- HN    837 ALA  HA      5.00 
838 ASP- HN    837 ALA  QB      4.00 
838 ASP- HN    839 GLU- HN      5.00 
839 GLU- HN    838 ASP- HA      3.50 
839 GLU- HN    838 ASP- QB      5.00 
839 GLU- HN    840 THR  HN      3.50 
840 THR  HN    839 GLU- HA      5.00 
842 CYS  HN    841 LEU  HA      2.90 
842 CYS  HN    841 LEU  QB      5.00 
842 CYS  HN    841 LEU  QQD     5.50 
842 CYS  HN    843 GLN  HN      5.00 
844 THR  HN    843 GLN  HN      5.00 
845 LYS+ HN    844 THR  HA      3.50 
845 LYS+ HN    844 THR  QG2     5.50 
845 LYS+ HN    846 VAL  HN      5.00 
846 VAL  HN    845 LYS+ HA      3.50 
846 VAL  QQG   847 LEU  HG      5.50 
847 LEU  HN    846 VAL  QQG     5.50 
847 LEU  QQD   846 VAL  QQG     3.70 
847 LEU  QQD   848 LEU  HN      5.50 
848 LEU  HN    847 LEU  HA      3.50 
849 ASP- HN    848 LEU  HA      2.90 
849 ASP- HN    848 LEU  QB      3.50 
849 ASP- HN    848 LEU  QQD     4.00 
850 ILE  HN    849 ASP- HA      3.50 
850 ILE  QG2   851 PHE  CG      5.50 
850 ILE  QG2   851 PHE  CZ      5.50 
850 ILE  QG2   851 PHE  HN      5.50 
850 ILE  QG2   851 PHE  QB      5.50 
851 PHE  CZ    850 ILE  QD1     5.50 
851 PHE  HN    850 ILE  HA      5.00 
851 PHE  HN    850 ILE  HB      3.50 
851 PHE  HN    850 ILE  HN      2.90 
851 PHE  HZ    850 ILE  QG2     5.50 
851 PHE  HN    852 THR  HN      2.90 
852 THR  HN    851 PHE  HA      3.50 
853 GLY  HN    852 THR  HA      2.90 
853 GLY  HN    852 THR  QG2     4.00 
853 GLY  HN    854 VAL  HN      3.50 
854 VAL  HN    853 GLY  QA      3.50 
855 ARG  HN    854 VAL  HA      2.90 
855 ARG  HN    854 VAL  QQG     4.00 
856 LEU  HN    855 ARG  HA      2.90 
856 LEU  HN    855 ARG  QB      5.00 
856 LEU  QQD   857 TYR  HA      5.50 
857 TYR  HN    856 LEU  HA      2.90 
857 TYR  HN    856 LEU  QB      3.50 
857 TYR  HN    856 LEU  QQD     4.00 
858 LEU  HN    857 TYR  CG      3.50 
858 LEU  HN    857 TYR  HA      2.90 
858 LEU  HA    859 PRO  QD      3.30 
858 LEU  QQD   859 PRO  QD      3.80 
859 PRO  QD    858 LEU  QB      5.00 
859 PRO  HA    860 PRO  QD      2.70 
859 PRO  QB    860 PRO  QD      3.30 
861 SER  HN    860 PRO  HA      5.00 
861 SER  HN    860 PRO  QB      3.50 
861 SER  HN    860 PRO  QD      5.00 
861 SER  HN    860 PRO  QG      5.00 
861 SER  HN    862 THR  HN      3.50 
862 THR  HN    861 SER  HA      2.90 
862 THR  HN    861 SER  QB      3.50 
862 THR  HA    863 PRO  QD      3.30 
862 THR  HB    863 PRO  QD      5.00 
862 THR  QG2   863 PRO  QD      3.80 
864 ASP- HN    863 PRO  HA      2.90 
864 ASP- HN    863 PRO  QB      3.50 
864 ASP- HN    865 PHE  HN      3.50 
865 PHE  HN    864 ASP- HA      3.50 
865 PHE  HN    866 SER  HN      3.50 
866 SER  HN    865 PHE  CG      3.50 
866 SER  HN    865 PHE  QB      2.90 
866 SER  HN    867 ARG  HN      3.50 
867 ARG  HN    866 SER  QB      5.00 
868 LEU  HN    867 ARG  HA      5.00 
868 LEU  HN    867 ARG  QB      5.00 
868 LEU  HN    869 ARG  HN      3.50 
869 ARG  HN    868 LEU  HA      3.50 
869 ARG  HN    868 LEU  HG      5.00 
869 ARG  HN    868 LEU  QB      3.50 
869 ARG  HN    870 ARG  HN      3.50 
870 ARG  HN    869 ARG  HA      5.00 
870 ARG  HN    869 ARG  QB      3.50 
872 PHE  HN    871 TYR  HA      5.00 
873 VAL  HN    872 PHE  HA      5.00 
873 VAL  HN    872 PHE  QB      3.50 
873 VAL  QQG   872 PHE  CG      5.50 
873 VAL  HN    874 ALA  HN      3.50 
874 ALA  HA    873 VAL  QQG     3.20 
874 ALA  HN    873 VAL  HB      3.50 
874 ALA  HN    873 VAL  QQG     5.50 
874 ALA  HN    875 PHE  HN      3.50 
875 PHE  HN    874 ALA  HA      5.00 
875 PHE  HN    874 ALA  QB      3.40 
876 ASP- HN    875 PHE  HA      5.00 
876 ASP- HN    875 PHE  HN      3.50 
876 ASP- HN    875 PHE  QB      5.00 
876 ASP- HN    877 GLY  HN      3.50 
877 GLY  HN    876 ASP- HA      3.50 
878 ASP- HN    877 GLY  HN      3.50 
878 ASP- HN    877 GLY  QA      2.90 
880 VAL  HN    879 LEU  HA      2.90 
880 VAL  HN    879 LEU  QB      3.50 
880 VAL  QQG   879 LEU  HA      5.50 
881 GLN  HN    880 VAL  HA      2.90 
881 GLN  HN    880 VAL  HB      3.50 
881 GLN  HN    880 VAL  QQG     4.00 
882 GLU- HN    881 GLN  HA      2.90 
882 GLU- HN    881 GLN  QB      3.50 
882 GLU- HN    881 GLN  QG      5.00 
882 GLU- HN    883 PHE  HN      3.50 
883 PHE  HN    882 GLU- HA      3.50 
883 PHE  HN    882 GLU- QB      2.90 
884 ASP- HN    883 PHE  CG      5.00 
884 ASP- HN    883 PHE  HA      3.50 
884 ASP- QB    883 PHE  CG      5.00 
884 ASP- HN    885 MET  HN      3.50 
885 MET  HN    884 ASP- HA      3.50 
885 MET  HN    884 ASP- QB      5.00 
885 MET  HN    886 THR  HN      3.50 
885 MET  QB    886 THR  QG2     5.50 
886 THR  HN    885 MET  HA      5.00 
886 THR  HN    885 MET  QB      5.00 
886 THR  HN    885 MET  QE      5.50 
886 THR  HN    885 MET  QG      3.50 
886 THR  QG2   885 MET  QG      5.50 
887 SER  HN    886 THR  HB      3.50 
887 SER  HN    886 THR  HN      2.90 
887 SER  HN    886 THR  QG2     4.00 
887 SER  HN    888 ALA  HN      2.90 
888 ALA  HN    887 SER  HA      3.50 
888 ALA  HN    887 SER  QB      3.50 
889 THR  HN    888 ALA  HA      2.90 
889 THR  HN    890 HIS  HN      2.90 
890 HIS  HE1   889 THR  QG2     5.50 
890 HIS  HN    889 THR  QG2     3.40 
890 HIS  HA    891 VAL  QQG     5.50 
891 VAL  HN    890 HIS  HA      2.90 
891 VAL  HN    890 HIS  QB      3.50 
892 LEU  HN    891 VAL  HA      2.90 
893 GLY  HN    892 LEU  HA      2.90 
893 GLY  HN    892 LEU  HG      3.50 
893 GLY  HN    892 LEU  QB      5.00 
893 GLY  HN    892 LEU  QQD     4.00 
893 GLY  HN    894 SER  HN      3.50 
894 SER  HN    893 GLY  QA      2.90 
894 SER  HN    895 ARG  HN      5.00 
895 ARG  HN    894 SER  QB      5.00 
896 ASP- HN    895 ARG  HN      3.50 
896 ASP- HN    895 ARG  QB      3.50 
896 ASP- HN    895 ARG  QG      3.50 
896 ASP- HN    897 LYS+ HN      3.50 
897 LYS+ HN    896 ASP- HA      2.90 
897 LYS+ HN    896 ASP- QB      3.50 
897 LYS+ HN    898 ASN  HN      2.90 
898 ASN  HN    897 LYS+ HA      3.50 
898 ASN  HN    897 LYS+ QB      3.50 
898 ASN  HN    897 LYS+ QG      5.00 
898 ASN  HA    899 PRO  QD      2.70 
898 ASN  HN    899 PRO  QD      3.50 
899 PRO  QG    898 ASN  HA      5.00 
900 ALA  HN    899 PRO  HA      5.00 
900 ALA  HN    899 PRO  QB      5.00 
900 ALA  HN    899 PRO  QD      3.50 
900 ALA  HN    899 PRO  QG      3.50 
900 ALA  HN    901 ALA  HN      2.90 
901 ALA  HN    900 ALA  HA      3.50 
901 ALA  HN    900 ALA  QB      4.00 
902 GLN  HN    901 ALA  HA      2.90 
902 GLN  HN    901 ALA  QB      3.40 
902 GLN  QE2   903 GLN  HN      3.50 
903 GLN  HN    902 GLN  HA      2.90 
903 GLN  HN    902 GLN  QB      3.50 
904 VAL  HN    903 GLN  HA      2.90 
904 VAL  HN    903 GLN  QB      5.00 
904 VAL  HN    903 GLN  QG      5.00 
905 SER  HN    904 VAL  HA      2.90 
905 SER  HN    904 VAL  HB      2.90 
905 SER  HN    904 VAL  QQG     5.50 
906 PRO  QD    905 SER  HA      5.00 
907 GLU- HN    906 PRO  QD      3.50 
908 TRP  HN    907 GLU- HA      5.00 
908 TRP  HN    907 GLU- HN      3.50 
908 TRP  HN    907 GLU- QB      3.50 
908 TRP  HN    909 ILE  HN      3.50 
908 TRP  HZ3   909 ILE  QG1     5.00 
909 ILE  HN    908 TRP  HA      5.00 
909 ILE  HN    908 TRP  QB      3.50 
909 ILE  QD1   908 TRP  HE3     5.50 
909 ILE  QD1   908 TRP  HZ3     5.50 
909 ILE  HA    910 TRP  HN      5.00 
909 ILE  QG2   910 TRP  HE3     5.50 
910 TRP  HN    909 ILE  HB      2.90 
910 TRP  HN    909 ILE  HN      2.90 
910 TRP  HN    909 ILE  QG2     4.00 
910 TRP  HZ3   909 ILE  QG2     5.50 
910 TRP  HN    911 ALA  HN      3.50 
911 ALA  HN    910 TRP  QB      5.00 
911 ALA  HN    912 CYS  HN      3.50 
912 CYS  HN    911 ALA  HA      3.50 
912 CYS  HN    911 ALA  QB      3.40 
912 CYS  HN    913 ILE  HN      3.50 
913 ILE  HN    912 CYS  HA      5.00 
913 ILE  HN    912 CYS  QB      5.00 
914 ARG  HN    913 ILE  HA      5.00 
914 ARG  HN    913 ILE  HN      3.50 
914 ARG  HN    913 ILE  QG2     5.50 
914 ARG  HN    915 LYS+ HN      3.50 
915 LYS+ HN    914 ARG  HA      5.00 
915 LYS+ HN    914 ARG  QB      3.50 
916 ARG  HN    917 ARG  HN      2.90 
917 ARG  HN    916 ARG  HA      2.90 
917 ARG  HN    916 ARG  QB      3.50 
918 LEU  HN    917 ARG  HA      2.90 
918 LEU  HN    917 ARG  QB      3.50 
918 LEU  HN    919 VAL  HN      5.00 
919 VAL  HN    918 LEU  HA      2.90 
919 VAL  HN    918 LEU  QB      3.50 
920 ALA  HN    919 VAL  HB      2.90 
920 ALA  HN    919 VAL  QQG     4.00 
920 ALA  QB    919 VAL  QQG     6.00 
920 ALA  HA    921 PRO  QD      2.70 
920 ALA  HA    921 PRO  QG      5.00 
920 ALA  QB    921 PRO  QD      3.80 
922 CYS  HN    921 PRO  HA      2.90 
922 CYS  HN    921 PRO  QB      3.50 
# medium range
836 SER  HA    839 GLU- QG      5.00 
837 ALA  QB    841 LEU  QQD     6.00 
838 ASP- HA    841 LEU  QB      5.00 
838 ASP- HA    841 LEU  QQD     5.50 
839 GLU- QB    836 SER  HA      2.70 
839 GLU- HA    842 CYS  QB      5.00 
840 THR  QG2   837 ALA  HA      3.80 
840 THR  HA    843 GLN  QB      5.00 
840 THR  HA    843 GLN  QG      5.00 
840 THR  QG2   843 GLN  QG      5.50 
841 LEU  HA    844 THR  QG2     5.50 
841 LEU  QQD   844 THR  QG2     6.00 
841 LEU  QB    845 LYS+ QE      2.70 
843 GLN  HA    841 LEU  QQD     5.50 
843 GLN  HA    846 VAL  QQG     3.80 
843 GLN  QG    846 VAL  QQG     3.80 
844 THR  QG2   847 LEU  QQD     4.30 
845 LYS+ HA    841 LEU  QQD     5.50 
848 LEU  QB    850 ILE  QD1     5.50 
850 ILE  QD1   848 LEU  QQD     3.70 
852 THR  HN    849 ASP- HA      5.00 
852 THR  HN    849 ASP- QB      5.00 
854 VAL  QQG   851 PHE  CG      5.50 
854 VAL  QQG   851 PHE  HA      5.50 
854 VAL  QQG   851 PHE  QB      5.50 
854 VAL  HN    852 THR  HA      5.00 
854 VAL  QQG   852 THR  HA      5.50 
854 VAL  QQG   856 LEU  QQD     6.00 
856 LEU  QQD   858 LEU  QB      5.50 
857 TYR  CZ    859 PRO  QB      5.00 
858 LEU  QQD   856 LEU  QQD     4.30 
858 LEU  QQD   862 THR  HB      5.50 
859 PRO  HA    857 TYR  CZ      5.00 
861 SER  HN    859 PRO  QB      5.00 
862 THR  QG2   858 LEU  QQD     3.70 
862 THR  HN    859 PRO  QB      5.00 
862 THR  HN    859 PRO  QD      5.00 
862 THR  QG2   859 PRO  QB      5.50 
862 THR  HN    860 PRO  HA      5.00 
862 THR  HN    865 PHE  CG      5.00 
864 ASP- QB    868 LEU  HG      5.00 
864 ASP- QB    868 LEU  QQD     3.80 
865 PHE  CG    862 THR  QG2     5.50 
865 PHE  HA    862 THR  QG2     5.50 
865 PHE  HN    862 THR  HB      5.00 
865 PHE  HN    863 PRO  HA      5.00 
865 PHE  HA    868 LEU  QB      3.30 
865 PHE  CZ    869 ARG  QD      3.30 
866 SER  HA    869 ARG  QB      5.00 
867 ARG  HN    864 ASP- HA      5.00 
869 ARG  QD    865 PHE  HZ      5.00 
869 ARG  HA    872 PHE  QB      5.00 
870 ARG  HN    867 ARG  HA      5.00 
870 ARG  HA    873 VAL  HB      5.00 
870 ARG  HA    873 VAL  QQG     3.80 
871 TYR  CG    867 ARG  HA      5.00 
871 TYR  CG    867 ARG  QB      3.30 
871 TYR  HA    874 ALA  QB      3.80 
871 TYR  CG    875 PHE  CG      3.30 
871 TYR  CZ    875 PHE  CG      3.30 
871 TYR  CZ    875 PHE  CZ      3.30 
873 VAL  QQG   869 ARG  QD      5.50 
873 VAL  QQG   869 ARG  QG      5.50 
874 ALA  HN    871 TYR  HA      3.50 
875 PHE  CG    871 TYR  HA      5.00 
875 PHE  CG    871 TYR  QB      5.00 
875 PHE  CZ    871 TYR  QB      5.00 
875 PHE  HZ    871 TYR  QB      3.30 
876 ASP- HN    873 VAL  QQG     5.50 
876 ASP- HN    874 ALA  HA      5.00 
877 GLY  HN    873 VAL  QQG     5.50 
880 VAL  QQG   884 ASP- QB      3.80 
881 GLN  QG    883 PHE  CZ      5.00 
881 GLN  HN    884 ASP- QB      5.00 
882 GLU- HA    885 MET  QE      3.80 
882 GLU- HA    885 MET  QG      5.00 
883 PHE  HN    881 GLN  QB      5.00 
884 ASP- HN    880 VAL  HB      5.00 
884 ASP- QB    880 VAL  HB      3.30 
884 ASP- HN    881 GLN  QB      5.00 
884 ASP- QB    881 GLN  QB      5.00 
885 MET  QB    882 GLU- HA      5.00 
885 MET  QE    882 GLU- QG      3.20 
885 MET  QB    888 ALA  QB      5.50 
886 THR  HN    884 ASP- HA      5.00 
887 SER  HN    884 ASP- HA      5.00 
888 ALA  QB    885 MET  HA      3.80 
888 ALA  QB    885 MET  QG      5.50 
888 ALA  HN    886 THR  HB      5.00 
889 THR  QG2   891 VAL  QQG     6.00 
890 HIS  HN    888 ALA  HA      3.50 
891 VAL  QQG   895 ARG  HA      3.80 
894 SER  QB    891 VAL  QQG     5.50 
894 SER  QB    897 LYS+ QD      5.00 
895 ARG  QB    891 VAL  QQG     3.80 
895 ARG  QG    899 PRO  HA      3.30 
896 ASP- HN    894 SER  QB      5.00 
897 LYS+ QD    901 ALA  QB      3.80 
898 ASN  QD2   900 ALA  HN      5.00 
898 ASN  QD2   901 ALA  QB      5.50 
899 PRO  HA    895 ARG  QB      5.00 
899 PRO  HA    895 ARG  QD      5.00 
899 PRO  QG    896 ASP- HA      3.30 
900 ALA  HN    898 ASN  HA      5.00 
901 ALA  HN    898 ASN  QB      5.00 
901 ALA  QB    898 ASN  QB      3.80 
902 GLN  QB    904 VAL  QQG     5.50 
902 GLN  QE2   904 VAL  QQG     5.50 
902 GLN  QG    904 VAL  QQG     5.50 
904 VAL  QQG   908 TRP  QB      5.50 
905 SER  HN    908 TRP  QB      5.00 
907 GLU- HN    905 SER  QB      5.00 
907 GLU- HA    910 TRP  CG      3.30 
907 GLU- HA    910 TRP  HN      3.50 
907 GLU- HA    910 TRP  QB      5.00 
908 TRP  CG    904 VAL  QQG     5.50 
908 TRP  HE3   904 VAL  HB      5.00 
908 TRP  HE3   904 VAL  QQG     3.80 
908 TRP  HZ2   904 VAL  QQG     5.50 
908 TRP  HZ3   904 VAL  QQG     3.80 
908 TRP  HA    911 ALA  HN      3.50 
908 TRP  HA    911 ALA  QB      3.80 
909 ILE  HN    906 PRO  HA      5.00 
909 ILE  QD1   906 PRO  HA      3.80 
909 ILE  HA    912 CYS  QB      5.00 
910 TRP  HE1   906 PRO  QB      5.00 
910 TRP  HE1   906 PRO  QG      5.00 
910 TRP  HE1   907 GLU- HA      5.00 
910 TRP  HA    913 ILE  HB      5.00 
910 TRP  HA    913 ILE  HN      3.50 
910 TRP  HA    913 ILE  QD1     5.50 
910 TRP  HZ3   913 ILE  QD1     3.80 
910 TRP  HZ3   913 ILE  QG2     5.50 
911 ALA  HA    914 ARG  QB      3.30 
912 CYS  HN    909 ILE  HA      5.00 
912 CYS  HA    915 LYS+ QB      5.00 
912 CYS  HA    915 LYS+ QG      5.00 
913 ILE  QD1   909 ILE  QG2     4.30 
913 ILE  QG2   909 ILE  QG2     6.00 
915 LYS+ HN    912 CYS  HA      5.00 
915 LYS+ QB    917 ARG  QG      3.30 
915 LYS+ QB    919 VAL  QQG     3.80 
915 LYS+ QG    919 VAL  QQG     3.80 
919 VAL  QQG   921 PRO  HA      5.50 
# long range
837 ALA  QB    910 TRP  HZ2     5.50 
840 THR  QG2   910 TRP  HA      5.50 
840 THR  QG2   910 TRP  HE3     3.80 
840 THR  QG2   910 TRP  QB      5.50 
840 THR  HB    913 ILE  QG2     5.50 
840 THR  QG2   913 ILE  QG2     3.70 
840 THR  QG2   914 ARG  QB      3.80 
840 THR  QG2   914 ARG  QD      5.50 
840 THR  QG2   914 ARG  QG      3.80 
841 LEU  QQD   871 TYR  CG      5.50 
841 LEU  QQD   909 ILE  QG2     6.00 
841 LEU  QQD   910 TRP  HE3     5.50 
841 LEU  QQD   910 TRP  HZ3     5.50 
841 LEU  QQD   913 ILE  QD1     6.00 
845 LYS+ HA    913 ILE  QD1     5.50 
845 LYS+ HN    913 ILE  QD1     5.50 
846 VAL  QQG   841 LEU  QB      3.80 
846 VAL  HA    871 TYR  CZ      5.00 
846 VAL  QQG   871 TYR  CZ      5.50 
846 VAL  QQG   875 PHE  CZ      5.50 
846 VAL  QQG   875 PHE  HZ      5.50 
847 LEU  QQD   871 TYR  HA      5.50 
847 LEU  HA    874 ALA  QB      5.50 
847 LEU  QQD   874 ALA  HA      5.50 
847 LEU  QQD   874 ALA  QB      3.70 
847 LEU  QQD   875 PHE  CZ      3.80 
848 LEU  QQD   916 ARG  HA      5.50 
848 LEU  QQD   916 ARG  QB      5.50 
849 ASP- HA    876 ASP- QB      3.30 
850 ILE  QD1   871 TYR  CZ      5.50 
850 ILE  QD1   875 PHE  CZ      5.50 
850 ILE  QG2   875 PHE  CZ      5.50 
850 ILE  QG2   875 PHE  QB      5.50 
850 ILE  QG2   912 CYS  QB      5.50 
850 ILE  QD1   916 ARG  HA      3.20 
850 ILE  QD1   916 ARG  QB      3.80 
850 ILE  QD1   916 ARG  QD      3.80 
850 ILE  QD1   916 ARG  QG      3.80 
850 ILE  QD1   917 ARG  HA      5.50 
850 ILE  QG2   917 ARG  HA      3.80 
850 ILE  QG2   918 LEU  HA      5.50 
850 ILE  QG2   918 LEU  QB      5.50 
851 PHE  CZ    872 PHE  HZ      3.30 
851 PHE  CZ    875 PHE  CG      3.30 
851 PHE  CZ    875 PHE  CZ      3.30 
851 PHE  HN    876 ASP- QB      5.00 
851 PHE  CG    877 GLY  QA      3.30 
851 PHE  CG    908 TRP  HH2     3.30 
851 PHE  CG    908 TRP  HZ3     5.00 
851 PHE  CZ    908 TRP  HH2     5.00 
851 PHE  CZ    908 TRP  HZ3     5.00 
851 PHE  CZ    909 ILE  HB      3.30 
851 PHE  CZ    909 ILE  QG1     2.70 
851 PHE  CZ    909 ILE  QG2     3.80 
851 PHE  CZ    912 CYS  QB      3.30 
851 PHE  CZ    918 LEU  QQD     3.80 
851 PHE  HA    918 LEU  QQD     3.80 
852 THR  HN    876 ASP- QB      3.50 
852 THR  QG2   877 GLY  QA      5.50 
852 THR  QG2   918 LEU  QQD     4.30 
854 VAL  QQG   872 PHE  HZ      3.80 
854 VAL  QQG   889 THR  QG2     6.00 
854 VAL  QQG   890 HIS  QB      5.50 
854 VAL  QQG   908 TRP  HH2     3.80 
854 VAL  QQG   908 TRP  HZ2     5.50 
854 VAL  QQG   918 LEU  QB      5.50 
854 VAL  QQG   918 LEU  QQD     4.30 
855 ARG  HA    880 VAL  QQG     5.50 
855 ARG  HE    880 VAL  QQG     5.50 
855 ARG  QD    880 VAL  QQG     3.80 
855 ARG  HE    889 THR  QG2     5.50 
855 ARG  HN    889 THR  HN      3.50 
856 LEU  HN    872 PHE  CZ      5.00 
856 LEU  HN    872 PHE  HZ      5.00 
856 LEU  HN    879 LEU  QQD     4.00 
856 LEU  HA    890 HIS  QB      5.00 
856 LEU  QQD   890 HIS  QB      3.80 
856 LEU  QQD   892 LEU  QB      3.80 
856 LEU  QQD   892 LEU  QQD     4.30 
856 LEU  QQD   908 TRP  HE3     5.50 
856 LEU  QQD   909 ILE  QG1     5.50 
857 TYR  HA    880 VAL  HB      5.00 
857 TYR  HA    880 VAL  QQG     3.80 
857 TYR  CG    882 GLU- HA      3.30 
857 TYR  CG    882 GLU- QB      3.30 
857 TYR  CZ    882 GLU- HA      3.30 
857 TYR  CZ    882 GLU- QB      3.30 
857 TYR  HN    891 VAL  HA      3.50 
857 TYR  HN    891 VAL  QQG     4.00 
858 LEU  QQD   865 PHE  HA      5.50 
858 LEU  QQD   865 PHE  HZ      5.50 
858 LEU  QQD   865 PHE  QB      5.50 
858 LEU  QQD   869 ARG  HA      5.50 
858 LEU  QQD   879 LEU  QQD     4.30 
858 LEU  HA    892 LEU  QB      5.00 
858 LEU  QQD   892 LEU  QB      3.80 
858 LEU  QQD   892 LEU  QQD     3.70 
862 THR  HB    868 LEU  QQD     5.50 
862 THR  QG2   906 PRO  QB      5.50 
862 THR  QG2   906 PRO  QG      5.50 
865 PHE  CG    858 LEU  HG      2.70 
865 PHE  CG    858 LEU  QQD     3.80 
865 PHE  CZ    858 LEU  HG      2.70 
865 PHE  CZ    858 LEU  QQD     3.80 
865 PHE  CG    860 PRO  HA      3.30 
865 PHE  CG    860 PRO  QB      5.00 
865 PHE  CZ    860 PRO  HA      3.30 
865 PHE  CZ    860 PRO  QB      3.30 
868 LEU  QB    858 LEU  QQD     5.50 
868 LEU  QQD   862 THR  QG2     4.30 
868 LEU  QQD   906 PRO  HA      5.50 
868 LEU  QQD   906 PRO  QB      3.80 
868 LEU  HA    909 ILE  QD1     5.50 
868 LEU  QQD   909 ILE  QG2     3.70 
868 LEU  QQD   910 TRP  HZ2     3.80 
869 ARG  HN    858 LEU  QQD     4.00 
871 TYR  CZ    841 LEU  QQD     3.80 
871 TYR  CG    909 ILE  QG2     3.80 
871 TYR  CZ    909 ILE  QG2     3.80 
871 TYR  CG    910 TRP  HH2     5.00 
871 TYR  CG    910 TRP  HZ3     5.00 
871 TYR  CZ    910 TRP  HH2     5.00 
871 TYR  CZ    910 TRP  HZ3     5.00 
871 TYR  CG    913 ILE  QD1     3.20 
871 TYR  CG    913 ILE  QG2     3.80 
872 PHE  CZ    851 PHE  CG      3.30 
872 PHE  CZ    851 PHE  CZ      5.00 
872 PHE  HA    851 PHE  CG      5.00 
872 PHE  HA    851 PHE  CZ      5.00 
872 PHE  CZ    854 VAL  HB      3.30 
872 PHE  CZ    854 VAL  QQG     3.80 
872 PHE  CZ    856 LEU  QB      5.00 
872 PHE  CZ    856 LEU  QQD     5.50 
872 PHE  HZ    856 LEU  QQD     5.50 
872 PHE  CZ    877 GLY  QA      5.00 
872 PHE  HZ    877 GLY  QA      5.00 
872 PHE  CZ    879 LEU  HA      5.00 
872 PHE  CZ    879 LEU  QQD     3.80 
872 PHE  CZ    908 TRP  HZ3     5.00 
872 PHE  CZ    909 ILE  QD1     5.50 
873 VAL  QQG   879 LEU  QB      5.50 
875 PHE  CG    847 LEU  QQD     5.50 
875 PHE  HZ    847 LEU  QQD     3.80 
875 PHE  CG    848 LEU  QB      3.30 
875 PHE  CG    850 ILE  QD1     3.80 
875 PHE  CG    850 ILE  QG1     3.30 
875 PHE  HZ    850 ILE  QG1     5.00 
875 PHE  CZ    851 PHE  CG      3.30 
875 PHE  CG    909 ILE  QG2     5.50 
875 PHE  CZ    909 ILE  QG2     3.80 
875 PHE  HZ    909 ILE  QG2     5.50 
875 PHE  CG    913 ILE  HA      5.00 
875 PHE  CG    913 ILE  QG2     3.80 
877 GLY  HN    851 PHE  CG      5.00 
877 GLY  HN    851 PHE  QB      5.00 
878 ASP- HN    855 ARG  HA      5.00 
878 ASP- QB    855 ARG  HA      3.30 
878 ASP- QB    855 ARG  QG      5.00 
878 ASP- HN    872 PHE  CZ      3.50 
878 ASP- HN    872 PHE  HZ      3.50 
878 ASP- HN    873 VAL  QQG     5.50 
879 LEU  HA    856 LEU  QB      5.00 
879 LEU  QQD   856 LEU  QQD     4.30 
879 LEU  QQD   869 ARG  HA      5.50 
879 LEU  QQD   869 ARG  QD      5.50 
879 LEU  QQD   869 ARG  QG      3.80 
879 LEU  QQD   872 PHE  CG      5.50 
879 LEU  QQD   873 VAL  QQG     3.70 
880 VAL  QQG   855 ARG  QB      3.80 
880 VAL  QQG   855 ARG  QG      3.80 
880 VAL  HB    857 TYR  QB      3.30 
880 VAL  HN    857 TYR  HA      3.50 
880 VAL  QQG   885 MET  HA      3.80 
880 VAL  QQG   885 MET  QB      3.80 
880 VAL  QQG   887 SER  QB      5.50 
880 VAL  QQG   888 ALA  HA      3.80 
880 VAL  QQG   888 ALA  QB      3.70 
881 GLN  HA    857 TYR  CG      5.00 
881 GLN  HA    857 TYR  CZ      5.00 
882 GLU- HN    857 TYR  CZ      3.50 
882 GLU- QG    857 TYR  CZ      5.00 
885 MET  QE    857 TYR  CG      5.50 
885 MET  QE    857 TYR  CZ      3.80 
885 MET  HN    880 VAL  QQG     5.50 
885 MET  QE    891 VAL  QQG     4.30 
885 MET  QE    897 LYS+ QE      5.50 
885 MET  QB    898 ASN  QB      5.00 
885 MET  QE    898 ASN  QB      5.50 
886 THR  HA    898 ASN  QB      5.00 
886 THR  HN    898 ASN  QB      5.00 
888 ALA  HA    855 ARG  QB      3.30 
888 ALA  QB    857 TYR  QB      5.50 
888 ALA  HN    880 VAL  QQG     4.00 
888 ALA  HN    898 ASN  QD2     5.00 
888 ALA  QB    898 ASN  QB      5.50 
888 ALA  QB    901 ALA  QB      3.70 
889 THR  QG2   854 VAL  HA      5.50 
889 THR  HN    855 ARG  QB      3.50 
889 THR  QG2   855 ARG  QB      3.80 
889 THR  QG2   855 ARG  QD      5.50 
889 THR  QG2   855 ARG  QG      3.80 
889 THR  QG2   901 ALA  HA      5.50 
890 HIS  HD2   854 VAL  QQG     5.50 
890 HIS  HE1   854 VAL  HA      5.00 
890 HIS  HE1   854 VAL  QQG     3.80 
890 HIS  HN    856 LEU  HA      5.00 
890 HIS  HN    856 LEU  QB      5.00 
890 HIS  HN    856 LEU  QQD     5.50 
890 HIS  HA    901 ALA  QB      3.80 
890 HIS  HA    902 GLN  QB      3.30 
890 HIS  HA    902 GLN  QG      5.00 
890 HIS  HD2   902 GLN  QB      3.30 
890 HIS  HA    904 VAL  QQG     5.50 
890 HIS  HD2   904 VAL  QQG     3.20 
890 HIS  HD2   908 TRP  HH2     5.00 
890 HIS  HD2   908 TRP  HZ2     5.00 
890 HIS  HD2   908 TRP  HZ3     5.00 
890 HIS  HE1   908 TRP  HH2     5.00 
890 HIS  HD2   921 PRO  QG      5.00 
891 VAL  HA    856 LEU  QQD     3.80 
891 VAL  HN    856 LEU  QQD     4.00 
891 VAL  HA    857 TYR  QB      5.00 
891 VAL  QQG   857 TYR  CG      3.80 
891 VAL  QQG   857 TYR  CZ      5.50 
891 VAL  QQG   897 LYS+ QD      3.20 
891 VAL  QQG   898 ASN  QB      3.80 
891 VAL  HB    901 ALA  QB      5.50 
891 VAL  HN    901 ALA  QB      4.00 
891 VAL  QQG   901 ALA  HA      5.50 
891 VAL  QQG   901 ALA  QB      3.70 
891 VAL  HN    902 GLN  QB      5.00 
891 VAL  HB    903 GLN  HA      5.00 
891 VAL  HN    903 GLN  HA      3.50 
891 VAL  QQG   903 GLN  HA      3.80 
891 VAL  QQG   903 GLN  QG      5.50 
891 VAL  HN    904 VAL  QQG     5.50 
892 LEU  HN    857 TYR  HN      5.00 
892 LEU  HN    857 TYR  QB      5.00 
892 LEU  HN    858 LEU  HA      5.00 
892 LEU  QQD   858 LEU  HA      3.80 
892 LEU  QQD   859 PRO  QD      3.80 
892 LEU  QQD   862 THR  HB      3.80 
892 LEU  HA    904 VAL  QQG     3.80 
892 LEU  QB    904 VAL  QQG     5.50 
892 LEU  QQD   905 SER  HA      3.80 
892 LEU  QQD   906 PRO  HA      3.80 
892 LEU  QQD   906 PRO  QB      5.50 
892 LEU  QQD   906 PRO  QD      3.80 
892 LEU  QQD   906 PRO  QG      5.50 
892 LEU  QQD   909 ILE  HN      5.50 
892 LEU  QQD   909 ILE  QD1     3.70 
892 LEU  QQD   909 ILE  QG1     5.50 
892 LEU  QQD   909 ILE  QG2     6.00 
893 GLY  HN    903 GLN  QG      5.00 
893 GLY  HN    904 VAL  HN      5.00 
893 GLY  HN    904 VAL  QQG     5.50 
895 ARG  HN    903 GLN  QE2     5.00 
898 ASN  HA    885 MET  QG      3.30 
898 ASN  QD2   886 THR  HA      3.30 
898 ASN  QD2   888 ALA  QB      3.80 
898 ASN  HN    891 VAL  QQG     5.50 
898 ASN  QD2   891 VAL  QQG     5.50 
901 ALA  HA    889 THR  HA      3.30 
901 ALA  QB    889 THR  HA      5.50 
901 ALA  HN    891 VAL  QQG     5.50 
902 GLN  HN    890 HIS  HA      2.90 
902 GLN  QG    890 HIS  HD2     5.00 
902 GLN  HN    891 VAL  HN      5.00 
902 GLN  HN    891 VAL  QQG     5.50 
903 GLN  QB    891 VAL  QQG     5.50 
903 GLN  QE2   891 VAL  QQG     5.50 
903 GLN  QE2   895 ARG  QG      5.00 
903 GLN  QG    895 ARG  QG      3.30 
904 VAL  QQG   856 LEU  QQD     6.00 
904 VAL  QQG   890 HIS  QB      5.50 
904 VAL  HN    891 VAL  QQG     5.50 
904 VAL  HN    892 LEU  HA      3.50 
904 VAL  QQG   892 LEU  HG      5.50 
904 VAL  QQG   892 LEU  QQD     4.30 
904 VAL  QQG   909 ILE  QG1     5.50 
904 VAL  QQG   921 PRO  QB      3.80 
904 VAL  QQG   921 PRO  QG      5.50 
906 PRO  QG    863 PRO  QD      5.00 
908 TRP  HZ3   854 VAL  QQG     3.80 
908 TRP  HZ3   856 LEU  QQD     5.50 
908 TRP  HZ3   872 PHE  HZ      3.30 
908 TRP  HE1   918 LEU  HA      5.00 
908 TRP  HE1   918 LEU  QQD     5.50 
908 TRP  HH2   918 LEU  QQD     3.80 
908 TRP  HZ3   918 LEU  QQD     5.50 
908 TRP  CG    919 VAL  QQG     3.20 
908 TRP  HA    919 VAL  QQG     3.80 
908 TRP  HE1   919 VAL  HB      5.00 
908 TRP  HE1   919 VAL  HN      3.50 
908 TRP  HE1   919 VAL  QQG     3.20 
908 TRP  HE1   920 ALA  HA      5.00 
908 TRP  HE1   920 ALA  QB      5.50 
908 TRP  CG    921 PRO  HA      2.70 
908 TRP  HE1   921 PRO  HA      3.30 
908 TRP  HE1   921 PRO  QB      5.00 
908 TRP  HE1   921 PRO  QD      5.00 
908 TRP  HE1   921 PRO  QG      5.00 
908 TRP  HN    922 CYS  HN      5.00 
909 ILE  HA    851 PHE  HZ      5.00 
909 ILE  QD1   851 PHE  CZ      5.50 
909 ILE  QD1   856 LEU  QQD     3.70 
909 ILE  QD1   868 LEU  HG      5.50 
909 ILE  QD1   868 LEU  QB      5.50 
909 ILE  QD1   868 LEU  QQD     3.70 
909 ILE  QD1   872 PHE  CG      5.50 
909 ILE  QD1   872 PHE  HN      5.50 
909 ILE  QD1   872 PHE  QB      5.50 
909 ILE  QG2   872 PHE  HN      5.50 
909 ILE  QG2   872 PHE  QB      5.50 
910 TRP  HE1   864 ASP- QB      5.00 
910 TRP  HH2   867 ARG  QB      5.00 
910 TRP  HZ3   867 ARG  QB      5.00 
910 TRP  HE1   868 LEU  HG      5.00 
910 TRP  HE1   868 LEU  QQD     3.80 
910 TRP  HH2   868 LEU  HA      5.00 
910 TRP  HZ3   871 TYR  QB      5.00 
911 ALA  QB    919 VAL  QQG     3.70 
912 CYS  HA    850 ILE  QG2     5.50 
912 CYS  HA    919 VAL  QQG     5.50 
912 CYS  HN    919 VAL  QQG     5.50 
913 ILE  QG2   837 ALA  HA      5.50 
913 ILE  QG2   840 THR  HA      5.50 
913 ILE  HA    850 ILE  QD1     3.80 
913 ILE  HA    850 ILE  QG2     5.50 
913 ILE  QG2   850 ILE  QD1     6.00 
913 ILE  QG2   850 ILE  QG1     3.80 
913 ILE  QD1   851 PHE  CZ      5.50 
913 ILE  QD1   871 TYR  CZ      5.50 
913 ILE  QD1   871 TYR  QB      3.80 
913 ILE  QD1   875 PHE  CG      5.50 
914 ARG  HA    848 LEU  QQD     5.50 
916 ARG  QD    848 LEU  QQD     3.20 
916 ARG  HN    850 ILE  QD1     4.00 
917 ARG  HN    850 ILE  QD1     5.50 
917 ARG  HN    850 ILE  QG2     4.00 
917 ARG  HN    912 CYS  HA      3.50 
918 LEU  HN    850 ILE  QG2     5.50 
918 LEU  QQD   850 ILE  QG2     4.30 
918 LEU  QQD   851 PHE  CG      3.80 
918 LEU  QQD   908 TRP  HZ2     3.80 
919 VAL  HN    912 CYS  HA      5.00 
921 PRO  QG    902 GLN  QB      3.30 
921 PRO  HA    904 VAL  QQG     3.80 
922 CYS  HN    904 VAL  HA      5.00 
922 CYS  HN    904 VAL  HB      5.00 
922 CYS  HN    904 VAL  QQG     4.00 
922 CYS  HN    905 SER  HN      5.00 
922 CYS  HN    908 TRP  CG      3.50 
922 CYS  HN    908 TRP  HE1     5.00 
922 CYS  HN    908 TRP  QB      3.50 
# intermolecular

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    GLY 835           H        GLY 835 -13.180  -0.886  12.318
    2   1HA   GLY 835          1HA       GLY 835 -12.293  -3.425  11.204
    3   2HA   GLY 835          2HA       GLY 835 -14.024  -3.099  10.957
    4    H    SER 836           H        SER 836 -10.984  -2.745   9.611
    5    HA   SER 836           HA       SER 836 -11.774  -0.292   8.120
    6   1HB   SER 836          1HB       SER 836  -9.394  -0.063   7.599
    7   2HB   SER 836          2HB       SER 836  -9.618  -0.199   9.359
    8    HG   SER 836           HG       SER 836  -8.521  -1.974   9.323
    9    H    ALA 837           H        ALA 837  -9.520  -2.952   7.296
   10    HA   ALA 837           HA       ALA 837 -10.059  -3.055   4.594
   11   1HB   ALA 837          1HB       ALA 837  -8.426  -4.413   6.226
   12   2HB   ALA 837          2HB       ALA 837  -9.682  -5.659   6.027
   13   3HB   ALA 837          3HB       ALA 837  -8.839  -5.009   4.600
   14    H    ASP 838           H        ASP 838 -11.567  -5.218   7.068
   15    HA   ASP 838           HA       ASP 838 -13.418  -6.448   5.379
   16   1HB   ASP 838          1HB       ASP 838 -13.118  -5.953   8.285
   17   2HB   ASP 838          2HB       ASP 838 -14.780  -6.273   7.745
   18    H    GLU 839           H        GLU 839 -13.291  -3.163   6.513
   19    HA   GLU 839           HA       GLU 839 -16.127  -2.738   5.742
   20   1HB   GLU 839          1HB       GLU 839 -14.199  -1.435   7.596
   21   2HB   GLU 839          2HB       GLU 839 -15.289  -0.343   6.709
   22   1HG   GLU 839          1HG       GLU 839 -16.820  -2.600   7.589
   23   2HG   GLU 839          2HG       GLU 839 -15.879  -2.008   8.975
   24    H    THR 840           H        THR 840 -13.038  -2.687   4.430
   25    HA   THR 840           HA       THR 840 -13.864  -0.606   2.459
   26    HB   THR 840           HB       THR 840 -11.036  -1.308   3.337
   27    HG1  THR 840           1HG      THR 840 -11.754  -0.155   4.979
   28   1HG2  THR 840          1HG2      THR 840 -12.097   1.023   1.689
   29   2HG2  THR 840          2HG2      THR 840 -10.394   0.609   2.000
   30   3HG2  THR 840          3HG2      THR 840 -11.397  -0.452   0.981
   31    H    LEU 841           H        LEU 841 -11.175  -2.983   2.581
   32    HA   LEU 841           HA       LEU 841 -11.481  -3.723  -0.145
   33   1HB   LEU 841          1HB       LEU 841  -9.372  -4.033   0.981
   34   2HB   LEU 841          2HB       LEU 841 -10.122  -5.073   2.216
   35    HG   LEU 841           HG       LEU 841  -8.864  -6.043   0.004
   36   1HD1  LEU 841          1HD1      LEU 841 -11.190  -7.061   1.646
   37   2HD1  LEU 841          2HD1      LEU 841 -10.514  -8.058   0.336
   38   3HD1  LEU 841          3HD1      LEU 841  -9.481  -7.554   1.695
   39   1HD2  LEU 841          1HD2      LEU 841 -10.128  -5.676  -1.835
   40   2HD2  LEU 841          2HD2      LEU 841 -11.310  -6.810  -1.138
   41   3HD2  LEU 841          3HD2      LEU 841 -11.484  -5.061  -0.860
   42    H    CYS 842           H        CYS 842 -13.606  -4.224   2.329
   43    HA   CYS 842           HA       CYS 842 -14.291  -6.973   2.093
   44   1HB   CYS 842          1HB       CYS 842 -15.268  -5.987   3.940
   45   2HB   CYS 842          2HB       CYS 842 -15.608  -4.463   3.083
   46    HG   CYS 842           HG       CYS 842 -17.921  -5.078   3.189
   47    H    GLN 843           H        GLN 843 -14.514  -4.391  -0.138
   48    HA   GLN 843           HA       GLN 843 -16.815  -5.583  -1.557
   49   1HB   GLN 843          1HB       GLN 843 -15.212  -3.202  -2.492
   50   2HB   GLN 843          2HB       GLN 843 -16.935  -3.571  -2.744
   51   1HG   GLN 843          1HG       GLN 843 -16.221  -3.382   0.099
   52   2HG   GLN 843          2HG       GLN 843 -15.886  -1.880  -0.789
   53   1HE2  GLN 843          1HE2      GLN 843 -17.916  -2.246   1.253
   54   2HE2  GLN 843          2HE2      GLN 843 -19.469  -1.974   0.493
   55    H    THR 844           H        THR 844 -15.153  -7.535  -1.678
   56    HA   THR 844           HA       THR 844 -13.986  -8.891  -3.107
   57    HB   THR 844           HB       THR 844 -15.529  -7.227  -4.761
   58    HG1  THR 844           1HG      THR 844 -13.889  -9.465  -5.376
   59   1HG2  THR 844          1HG2      THR 844 -12.598  -7.284  -5.563
   60   2HG2  THR 844          2HG2      THR 844 -13.905  -7.068  -6.752
   61   3HG2  THR 844          3HG2      THR 844 -13.682  -5.877  -5.448
   62    H    LYS 845           H        LYS 845 -13.121  -5.497  -4.001
   63    HA   LYS 845           HA       LYS 845 -10.472  -5.787  -2.871
   64   1HB   LYS 845          1HB       LYS 845 -10.873  -6.704  -5.539
   65   2HB   LYS 845          2HB       LYS 845  -9.997  -5.158  -5.640
   66   1HG   LYS 845          1HG       LYS 845  -8.568  -7.287  -5.362
   67   2HG   LYS 845          2HG       LYS 845  -8.235  -5.946  -4.240
   68   1HD   LYS 845          1HD       LYS 845 -10.300  -7.437  -3.022
   69   2HD   LYS 845          2HD       LYS 845  -9.161  -8.647  -3.661
   70   1HE   LYS 845          1HE       LYS 845  -8.122  -6.229  -2.183
   71   2HE   LYS 845          2HE       LYS 845  -8.762  -7.614  -1.272
   72   1HZ   LYS 845          1HZ       LYS 845  -6.276  -7.425  -2.082
   73   2HZ   LYS 845          2HZ       LYS 845  -7.047  -8.867  -1.859
   74   3HZ   LYS 845          3HZ       LYS 845  -6.909  -8.230  -3.375
   75    H    VAL 846           H        VAL 846 -13.111  -4.080  -4.190
   76    HA   VAL 846           HA       VAL 846 -13.454  -1.839  -4.684
   77    HB   VAL 846           HB       VAL 846 -13.584  -0.765  -2.686
   78   1HG1  VAL 846          1HG1      VAL 846 -14.069  -2.406  -1.213
   79   2HG1  VAL 846          2HG1      VAL 846 -13.318  -3.556  -2.344
   80   3HG1  VAL 846          3HG1      VAL 846 -12.349  -2.828  -1.041
   81   1HG2  VAL 846          1HG2      VAL 846 -11.731  -0.170  -1.352
   82   2HG2  VAL 846          2HG2      VAL 846 -10.806  -1.614  -1.829
   83   3HG2  VAL 846          3HG2      VAL 846 -11.034  -0.282  -2.987
   84    H    LEU 847           H        LEU 847 -10.105  -2.099  -3.349
   85    HA   LEU 847           HA       LEU 847  -8.133  -1.195  -4.074
   86   1HB   LEU 847          1HB       LEU 847  -9.361  -0.909  -6.824
   87   2HB   LEU 847          2HB       LEU 847  -7.679  -1.290  -6.384
   88    HG   LEU 847           HG       LEU 847  -8.785  -3.329  -7.155
   89   1HD1  LEU 847          1HD1      LEU 847  -8.922  -3.982  -4.299
   90   2HD1  LEU 847          2HD1      LEU 847  -7.774  -4.545  -5.537
   91   3HD1  LEU 847          3HD1      LEU 847  -7.489  -3.003  -4.695
   92   1HD2  LEU 847          1HD2      LEU 847 -10.712  -3.342  -4.871
   93   2HD2  LEU 847          2HD2      LEU 847 -11.084  -2.240  -6.219
   94   3HD2  LEU 847          3HD2      LEU 847 -10.894  -3.984  -6.521
   95    H    LEU 848           H        LEU 848 -10.189   0.530  -6.442
   96    HA   LEU 848           HA       LEU 848 -10.728   2.750  -6.636
   97   1HB   LEU 848          1HB       LEU 848 -10.198   2.484  -3.705
   98   2HB   LEU 848          2HB       LEU 848 -10.202   4.128  -4.388
   99    HG   LEU 848           HG       LEU 848 -12.417   2.109  -4.910
  100   1HD1  LEU 848          1HD1      LEU 848 -11.797   3.587  -2.493
  101   2HD1  LEU 848          2HD1      LEU 848 -13.314   4.192  -3.201
  102   3HD1  LEU 848          3HD1      LEU 848 -13.143   2.465  -2.805
  103   1HD2  LEU 848          1HD2      LEU 848 -12.992   4.992  -4.948
  104   2HD2  LEU 848          2HD2      LEU 848 -11.744   4.526  -6.128
  105   3HD2  LEU 848          3HD2      LEU 848 -13.344   3.748  -6.171
  106    H    ASP 849           H        ASP 849  -9.668   4.953  -6.705
  107    HA   ASP 849           HA       ASP 849  -6.900   4.599  -7.541
  108   1HB   ASP 849          1HB       ASP 849  -7.148   7.084  -8.047
  109   2HB   ASP 849          2HB       ASP 849  -8.258   5.998  -8.910
  110    H    ILE 850           H        ILE 850  -6.730   3.905  -5.006
  111    HA   ILE 850           HA       ILE 850  -6.323   6.181  -3.238
  112    HB   ILE 850           HB       ILE 850  -5.145   3.571  -2.505
  113   1HG1  ILE 850          1HG1      ILE 850  -7.122   3.015  -4.056
  114   2HG1  ILE 850          2HG1      ILE 850  -7.185   2.334  -2.413
  115   1HG2  ILE 850          1HG2      ILE 850  -5.962   4.157  -0.428
  116   2HG2  ILE 850          2HG2      ILE 850  -5.922   5.776  -1.166
  117   3HG2  ILE 850          3HG2      ILE 850  -7.451   4.867  -1.097
  118   1HD1  ILE 850          1HD1      ILE 850  -8.431   4.653  -1.907
  119   2HD1  ILE 850          2HD1      ILE 850  -8.818   4.535  -3.640
  120   3HD1  ILE 850          3HD1      ILE 850  -9.313   3.237  -2.527
  121    H    PHE 851           H        PHE 851  -3.916   3.662  -3.176
  122    HA   PHE 851           HA       PHE 851  -1.734   5.406  -3.115
  123   1HB   PHE 851          1HB       PHE 851  -1.516   2.660  -4.324
  124   2HB   PHE 851          2HB       PHE 851  -0.406   3.493  -3.224
  125    HD1  PHE 851           1HD      PHE 851  -2.887   0.994  -3.476
  126    HD2  PHE 851           2HD      PHE 851  -1.409   4.036  -0.828
  127    HE1  PHE 851           1HE      PHE 851  -3.918  -0.181  -1.550
  128    HE2  PHE 851           2HE      PHE 851  -2.440   2.861   1.097
  129    HZ   PHE 851           HZ       PHE 851  -3.694   0.752   0.736
  130    H    THR 852           H        THR 852  -3.582   6.104  -5.304
  131    HA   THR 852           HA       THR 852  -2.898   5.459  -7.854
  132    HB   THR 852           HB       THR 852  -4.284   7.501  -6.667
  133    HG1  THR 852           1HG      THR 852  -4.946   6.927  -8.608
  134   1HG2  THR 852          1HG2      THR 852  -1.831   8.673  -8.046
  135   2HG2  THR 852          2HG2      THR 852  -3.295   9.600  -7.640
  136   3HG2  THR 852          3HG2      THR 852  -2.305   8.888  -6.343
  137    H    GLY 853           H        GLY 853  -0.877   4.897  -8.503
  138   1HA   GLY 853          1HA       GLY 853   1.292   5.215  -9.197
  139   2HA   GLY 853          2HA       GLY 853   1.069   6.959  -8.929
  140    H    VAL 854           H        VAL 854   0.268   5.030  -6.201
  141    HA   VAL 854           HA       VAL 854   2.676   6.004  -4.812
  142    HB   VAL 854           HB       VAL 854   0.002   4.865  -3.994
  143   1HG1  VAL 854          1HG1      VAL 854   0.710   4.382  -1.834
  144   2HG1  VAL 854          2HG1      VAL 854   2.145   3.875  -2.758
  145   3HG1  VAL 854          3HG1      VAL 854   2.124   5.458  -1.944
  146   1HG2  VAL 854          1HG2      VAL 854  -0.300   7.115  -3.890
  147   2HG2  VAL 854          2HG2      VAL 854   0.678   7.031  -2.405
  148   3HG2  VAL 854          3HG2      VAL 854   1.449   7.439  -3.956
  149    H    ARG 855           H        ARG 855   4.426   4.734  -5.205
  150    HA   ARG 855           HA       ARG 855   4.079   1.805  -5.275
  151   1HB   ARG 855          1HB       ARG 855   6.187   1.739  -6.291
  152   2HB   ARG 855          2HB       ARG 855   5.520   3.276  -6.893
  153   1HG   ARG 855          1HG       ARG 855   6.654   4.349  -4.819
  154   2HG   ARG 855          2HG       ARG 855   7.575   2.830  -4.708
  155   1HD   ARG 855          1HD       ARG 855   8.717   4.649  -6.042
  156   2HD   ARG 855          2HD       ARG 855   8.475   3.127  -6.927
  157    HE   ARG 855           HE       ARG 855   6.246   4.521  -7.607
  158   1HH1  ARG 855          2HH2      ARG 855   9.678   5.365  -7.531
  159   2HH1  ARG 855          1HH2      ARG 855   9.568   6.506  -8.852
  160   1HH2  ARG 855          2HH1      ARG 855   6.100   6.028  -9.353
  161   2HH2  ARG 855          1HH1      ARG 855   7.527   6.884  -9.891
  162    H    LEU 856           H        LEU 856   3.589   1.369  -3.082
  163    HA   LEU 856           HA       LEU 856   5.704   2.087  -1.126
  164   1HB   LEU 856          1HB       LEU 856   4.063   2.162   0.440
  165   2HB   LEU 856          2HB       LEU 856   2.970   2.287  -0.960
  166    HG   LEU 856           HG       LEU 856   2.583  -0.101  -0.960
  167   1HD1  LEU 856          1HD1      LEU 856   3.797  -1.185   1.267
  168   2HD1  LEU 856          2HD1      LEU 856   4.412  -1.334  -0.396
  169   3HD1  LEU 856          3HD1      LEU 856   5.050  -0.066   0.678
  170   1HD2  LEU 856          1HD2      LEU 856   2.513   0.332   1.989
  171   2HD2  LEU 856          2HD2      LEU 856   1.706   1.573   1.001
  172   3HD2  LEU 856          3HD2      LEU 856   1.207  -0.130   0.872
  173    H    TYR 857           H        TYR 857   6.932   0.543  -0.122
  174    HA   TYR 857           HA       TYR 857   7.006  -2.078  -1.363
  175   1HB   TYR 857          1HB       TYR 857   9.132  -1.611  -0.788
  176   2HB   TYR 857          2HB       TYR 857   8.640  -0.436   0.443
  177    HD1  TYR 857           1HD      TYR 857   9.751  -0.948   2.416
  178    HD2  TYR 857           2HD      TYR 857   7.998  -4.124   0.115
  179    HE1  TYR 857           1HE      TYR 857  10.344  -2.566   4.199
  180    HE2  TYR 857           2HE      TYR 857   8.591  -5.742   1.898
  181    HH   TYR 857           HH       TYR 857  10.031  -4.727   4.983
  182    H    LEU 858           H        LEU 858   5.293  -3.384  -0.901
  183    HA   LEU 858           HA       LEU 858   4.164  -3.458   1.790
  184   1HB   LEU 858          1HB       LEU 858   2.812  -3.685  -0.319
  185   2HB   LEU 858          2HB       LEU 858   3.613  -5.248  -0.606
  186    HG   LEU 858           HG       LEU 858   2.378  -6.301   0.986
  187   1HD1  LEU 858          1HD1      LEU 858   3.567  -5.308   2.839
  188   2HD1  LEU 858          2HD1      LEU 858   2.726  -3.755   2.617
  189   3HD1  LEU 858          3HD1      LEU 858   1.828  -5.177   3.197
  190   1HD2  LEU 858          1HD2      LEU 858   0.201  -5.609   0.875
  191   2HD2  LEU 858          2HD2      LEU 858   0.590  -3.965   1.435
  192   3HD2  LEU 858          3HD2      LEU 858   0.855  -4.412  -0.268
  193    HA   PRO 859           HA       PRO 859   7.230  -6.519   2.954
  194   1HB   PRO 859          1HB       PRO 859   6.686  -6.482   5.623
  195   2HB   PRO 859          2HB       PRO 859   7.521  -5.119   4.810
  196   1HG   PRO 859          1HG       PRO 859   4.561  -5.361   5.419
  197   2HG   PRO 859          2HG       PRO 859   5.648  -3.996   5.832
  198   1HD   PRO 859          1HD       PRO 859   4.102  -3.953   3.588
  199   2HD   PRO 859          2HD       PRO 859   5.776  -3.321   3.548
  200    HA   PRO 860           HA       PRO 860   4.566 -10.045   2.925
  201   1HB   PRO 860          1HB       PRO 860   6.346 -11.979   3.644
  202   2HB   PRO 860          2HB       PRO 860   6.487 -11.094   2.089
  203   1HG   PRO 860          1HG       PRO 860   7.919 -10.479   4.690
  204   2HG   PRO 860          2HG       PRO 860   8.654 -10.695   3.068
  205   1HD   PRO 860          1HD       PRO 860   8.058  -8.219   4.041
  206   2HD   PRO 860          2HD       PRO 860   7.771  -8.611   2.318
  207    H    SER 861           H        SER 861   6.308  -8.886   5.735
  208    HA   SER 861           HA       SER 861   4.992 -10.740   7.575
  209   1HB   SER 861          1HB       SER 861   7.233  -8.915   7.607
  210   2HB   SER 861          2HB       SER 861   6.139  -8.547   8.963
  211    HG   SER 861           HG       SER 861   6.189 -10.808   9.452
  212    H    THR 862           H        THR 862   4.172  -7.875   5.924
  213    HA   THR 862           HA       THR 862   2.627  -6.575   7.962
  214    HB   THR 862           HB       THR 862   3.247  -6.248   5.142
  215    HG1  THR 862           1HG      THR 862   3.534  -4.849   7.071
  216   1HG2  THR 862          1HG2      THR 862   0.861  -6.952   4.884
  217   2HG2  THR 862          2HG2      THR 862   0.384  -5.651   6.002
  218   3HG2  THR 862          3HG2      THR 862   1.123  -5.250   4.433
  219    HA   PRO 863           HA       PRO 863  -0.888  -9.225   8.066
  220   1HB   PRO 863          1HB       PRO 863  -2.690  -7.545   9.230
  221   2HB   PRO 863          2HB       PRO 863  -1.246  -8.139  10.112
  222   1HG   PRO 863          1HG       PRO 863  -1.543  -5.511   8.631
  223   2HG   PRO 863          2HG       PRO 863  -0.987  -5.751  10.319
  224   1HD   PRO 863          1HD       PRO 863   0.784  -5.492   8.264
  225   2HD   PRO 863          2HD       PRO 863   1.084  -6.671   9.577
  226    H    ASP 864           H        ASP 864  -2.679  -9.677   6.788
  227    HA   ASP 864           HA       ASP 864  -4.204  -9.444   5.092
  228   1HB   ASP 864          1HB       ASP 864  -4.020  -6.804   6.273
  229   2HB   ASP 864          2HB       ASP 864  -4.257  -6.676   4.517
  230    H    PHE 865           H        PHE 865  -1.065  -9.212   4.877
  231    HA   PHE 865           HA       PHE 865  -0.279  -7.773   2.658
  232   1HB   PHE 865          1HB       PHE 865   1.088  -9.290   4.173
  233   2HB   PHE 865          2HB       PHE 865   0.519 -10.649   3.189
  234    HD1  PHE 865           1HD      PHE 865   2.087  -7.260   2.724
  235    HD2  PHE 865           2HD      PHE 865   1.871 -11.358   1.452
  236    HE1  PHE 865           1HE      PHE 865   3.917  -6.853   1.100
  237    HE2  PHE 865           2HE      PHE 865   3.701 -10.950  -0.172
  238    HZ   PHE 865           HZ       PHE 865   4.724  -8.697  -0.347
  239    H    SER 866           H        SER 866  -1.791 -11.044   2.690
  240    HA   SER 866           HA       SER 866  -1.805 -11.899   0.183
  241   1HB   SER 866          1HB       SER 866  -3.561 -12.147   2.339
  242   2HB   SER 866          2HB       SER 866  -4.602 -11.615   0.997
  243    HG   SER 866           HG       SER 866  -3.152 -13.957   1.321
  244    H    ARG 867           H        ARG 867  -4.556  -9.727   0.967
  245    HA   ARG 867           HA       ARG 867  -4.809  -8.915  -1.782
  246   1HB   ARG 867          1HB       ARG 867  -6.005  -7.733   0.756
  247   2HB   ARG 867          2HB       ARG 867  -6.559  -7.427  -0.907
  248   1HG   ARG 867          1HG       ARG 867  -7.916  -9.219  -0.675
  249   2HG   ARG 867          2HG       ARG 867  -6.451 -10.229  -0.699
  250   1HD   ARG 867          1HD       ARG 867  -6.627 -10.694   1.503
  251   2HD   ARG 867          2HD       ARG 867  -6.876  -8.984   1.914
  252    HE   ARG 867           HE       ARG 867  -9.179  -9.320   1.908
  253   1HH1  ARG 867          2HH2      ARG 867  -7.486 -12.101   0.528
  254   2HH1  ARG 867          1HH2      ARG 867  -8.903 -13.125   0.503
  255   1HH2  ARG 867          2HH1      ARG 867 -11.052 -10.674   1.874
  256   2HH2  ARG 867          1HH1      ARG 867 -10.937 -12.312   1.271
  257    H    LEU 868           H        LEU 868  -3.425  -7.460   1.180
  258    HA   LEU 868           HA       LEU 868  -2.977  -4.878   0.565
  259   1HB   LEU 868          1HB       LEU 868  -1.324  -6.988   1.868
  260   2HB   LEU 868          2HB       LEU 868  -0.482  -5.485   1.422
  261    HG   LEU 868           HG       LEU 868  -2.633  -5.947   3.441
  262   1HD1  LEU 868          1HD1      LEU 868  -0.033  -4.604   3.139
  263   2HD1  LEU 868          2HD1      LEU 868  -1.238  -3.591   3.970
  264   3HD1  LEU 868          3HD1      LEU 868  -0.838  -5.204   4.609
  265   1HD2  LEU 868          1HD2      LEU 868  -3.360  -3.544   3.218
  266   2HD2  LEU 868          2HD2      LEU 868  -2.479  -3.470   1.673
  267   3HD2  LEU 868          3HD2      LEU 868  -3.865  -4.572   1.855
  268    H    ARG 869           H        ARG 869  -1.080  -7.615  -0.798
  269    HA   ARG 869           HA       ARG 869   0.565  -5.945  -2.447
  270   1HB   ARG 869          1HB       ARG 869   0.940  -8.380  -1.658
  271   2HB   ARG 869          2HB       ARG 869  -0.132  -8.840  -3.003
  272   1HG   ARG 869          1HG       ARG 869   1.729  -8.783  -4.297
  273   2HG   ARG 869          2HG       ARG 869   1.606  -7.011  -4.179
  274   1HD   ARG 869          1HD       ARG 869   3.781  -7.358  -3.424
  275   2HD   ARG 869          2HD       ARG 869   2.879  -7.375  -1.893
  276    HE   ARG 869           HE       ARG 869   2.843  -9.988  -2.488
  277   1HH1  ARG 869          2HH2      ARG 869   5.450  -7.609  -2.701
  278   2HH1  ARG 869          1HH2      ARG 869   6.721  -8.773  -2.402
  279   1HH2  ARG 869          2HH1      ARG 869   4.523 -11.526  -2.093
  280   2HH2  ARG 869          1HH1      ARG 869   6.193 -11.006  -2.055
  281    H    ARG 870           H        ARG 870  -1.395  -8.502  -3.923
  282    HA   ARG 870           HA       ARG 870  -1.846  -7.456  -6.354
  283   1HB   ARG 870          1HB       ARG 870  -2.960  -9.498  -4.884
  284   2HB   ARG 870          2HB       ARG 870  -4.364  -8.440  -5.160
  285   1HG   ARG 870          1HG       ARG 870  -4.486  -9.500  -7.174
  286   2HG   ARG 870          2HG       ARG 870  -3.158  -8.407  -7.634
  287   1HD   ARG 870          1HD       ARG 870  -2.128 -10.694  -6.171
  288   2HD   ARG 870          2HD       ARG 870  -3.107 -11.237  -7.551
  289    HE   ARG 870           HE       ARG 870  -1.304  -9.118  -8.309
  290   1HH1  ARG 870          2HH2      ARG 870  -1.512 -12.571  -7.576
  291   2HH1  ARG 870          1HH2      ARG 870  -0.138 -13.003  -8.568
  292   1HH2  ARG 870          2HH1      ARG 870   0.511  -9.690  -9.619
  293   2HH2  ARG 870          1HH1      ARG 870   1.015 -11.361  -9.733
  294    H    TYR 871           H        TYR 871  -4.201  -6.853  -3.678
  295    HA   TYR 871           HA       TYR 871  -5.836  -5.015  -4.823
  296   1HB   TYR 871          1HB       TYR 871  -5.776  -5.864  -2.419
  297   2HB   TYR 871          2HB       TYR 871  -4.605  -4.575  -2.091
  298    HD1  TYR 871           1HD      TYR 871  -7.764  -4.662  -4.126
  299    HD2  TYR 871           2HD      TYR 871  -5.630  -2.925  -0.828
  300    HE1  TYR 871           1HE      TYR 871  -9.625  -3.064  -3.764
  301    HE2  TYR 871           2HE      TYR 871  -7.491  -1.327  -0.465
  302    HH   TYR 871           HH       TYR 871 -10.331  -1.513  -1.231
  303    H    PHE 872           H        PHE 872  -3.151  -3.761  -2.788
  304    HA   PHE 872           HA       PHE 872  -3.070  -1.187  -3.636
  305   1HB   PHE 872          1HB       PHE 872  -1.561  -2.291  -1.969
  306   2HB   PHE 872          2HB       PHE 872  -0.612  -2.939  -3.317
  307    HD1  PHE 872           1HD      PHE 872  -0.044  -0.962  -5.150
  308    HD2  PHE 872           2HD      PHE 872  -0.646  -0.448  -0.928
  309    HE1  PHE 872           1HE      PHE 872   1.294   1.125  -5.214
  310    HE2  PHE 872           2HE      PHE 872   0.692   1.639  -0.992
  311    HZ   PHE 872           HZ       PHE 872   1.662   2.426  -3.134
  312    H    VAL 873           H        VAL 873  -0.319  -2.924  -4.968
  313    HA   VAL 873           HA       VAL 873   0.148  -1.590  -7.218
  314    HB   VAL 873           HB       VAL 873   1.541  -3.402  -7.078
  315   1HG1  VAL 873          1HG1      VAL 873   0.754  -5.694  -6.488
  316   2HG1  VAL 873          2HG1      VAL 873   0.269  -4.486  -5.275
  317   3HG1  VAL 873          3HG1      VAL 873  -0.920  -5.090  -6.453
  318   1HG2  VAL 873          1HG2      VAL 873  -0.558  -4.753  -8.807
  319   2HG2  VAL 873          2HG2      VAL 873   0.368  -3.345  -9.379
  320   3HG2  VAL 873          3HG2      VAL 873   1.215  -4.848  -8.942
  321    H    ALA 874           H        ALA 874  -2.576  -3.870  -6.816
  322    HA   ALA 874           HA       ALA 874  -3.490  -3.873  -9.483
  323   1HB   ALA 874          1HB       ALA 874  -4.372  -5.448  -7.900
  324   2HB   ALA 874          2HB       ALA 874  -4.930  -4.146  -6.821
  325   3HB   ALA 874          3HB       ALA 874  -5.724  -4.400  -8.394
  326    H    PHE 875           H        PHE 875  -4.026  -1.581  -6.795
  327    HA   PHE 875           HA       PHE 875  -6.090  -0.046  -7.863
  328   1HB   PHE 875          1HB       PHE 875  -3.639   0.936  -6.364
  329   2HB   PHE 875          2HB       PHE 875  -5.192   1.779  -6.503
  330    HD1  PHE 875           1HD      PHE 875  -4.820   1.754  -3.905
  331    HD2  PHE 875           2HD      PHE 875  -5.709  -1.727  -6.259
  332    HE1  PHE 875           1HE      PHE 875  -5.631   0.587  -1.872
  333    HE2  PHE 875           2HE      PHE 875  -6.520  -2.894  -4.226
  334    HZ   PHE 875           HZ       PHE 875  -6.481  -1.737  -2.033
  335    H    ASP 876           H        ASP 876  -2.551   0.219  -8.454
  336    HA   ASP 876           HA       ASP 876  -2.384   0.714 -11.053
  337   1HB   ASP 876          1HB       ASP 876  -3.909   2.936  -9.806
  338   2HB   ASP 876          2HB       ASP 876  -2.615   3.427 -10.921
  339    H    GLY 877           H        GLY 877  -1.198   0.751  -8.074
  340   1HA   GLY 877          1HA       GLY 877   1.049   2.612  -8.604
  341   2HA   GLY 877          2HA       GLY 877   0.652   1.846  -7.049
  342    H    ASP 878           H        ASP 878   2.648   0.883  -6.662
  343    HA   ASP 878           HA       ASP 878   3.149  -1.567  -8.170
  344   1HB   ASP 878          1HB       ASP 878   4.745   0.897  -8.541
  345   2HB   ASP 878          2HB       ASP 878   5.699  -0.555  -8.169
  346    H    LEU 879           H        LEU 879   4.761  -2.930  -7.089
  347    HA   LEU 879           HA       LEU 879   5.288  -2.088  -4.283
  348   1HB   LEU 879          1HB       LEU 879   4.416  -4.869  -5.143
  349   2HB   LEU 879          2HB       LEU 879   4.623  -4.258  -3.484
  350    HG   LEU 879           HG       LEU 879   2.492  -3.531  -5.517
  351   1HD1  LEU 879          1HD1      LEU 879   2.673  -4.839  -2.830
  352   2HD1  LEU 879          2HD1      LEU 879   1.255  -3.807  -3.133
  353   3HD1  LEU 879          3HD1      LEU 879   1.592  -5.192  -4.199
  354   1HD2  LEU 879          1HD2      LEU 879   2.059  -1.983  -3.220
  355   2HD2  LEU 879          2HD2      LEU 879   3.801  -1.807  -3.542
  356   3HD2  LEU 879          3HD2      LEU 879   2.616  -1.388  -4.803
  357    H    VAL 880           H        VAL 880   7.399  -2.190  -3.819
  358    HA   VAL 880           HA       VAL 880   9.110  -3.899  -5.550
  359    HB   VAL 880           HB       VAL 880  10.503  -2.026  -3.801
  360   1HG1  VAL 880          1HG1      VAL 880  10.251  -2.049  -6.831
  361   2HG1  VAL 880          2HG1      VAL 880  11.617  -1.468  -5.848
  362   3HG1  VAL 880          3HG1      VAL 880  11.266  -3.211  -5.943
  363   1HG2  VAL 880          1HG2      VAL 880   8.818  -0.445  -3.855
  364   2HG2  VAL 880          2HG2      VAL 880   9.587  -0.089  -5.421
  365   3HG2  VAL 880          3HG2      VAL 880   8.116  -1.090  -5.359
  366    H    GLN 881           H        GLN 881  10.503  -5.403  -4.651
  367    HA   GLN 881           HA       GLN 881   9.748  -6.468  -2.092
  368   1HB   GLN 881          1HB       GLN 881  12.230  -7.079  -3.738
  369   2HB   GLN 881          2HB       GLN 881  11.442  -8.127  -2.534
  370   1HG   GLN 881          1HG       GLN 881   9.406  -8.202  -3.943
  371   2HG   GLN 881          2HG       GLN 881  10.204  -7.169  -5.148
  372   1HE2  GLN 881          1HE2      GLN 881  10.305 -10.347  -3.520
  373   2HE2  GLN 881          2HE2      GLN 881  11.211 -11.169  -4.772
  374    H    GLU 882           H        GLU 882  10.585  -6.124  -0.098
  375    HA   GLU 882           HA       GLU 882  11.801  -3.973   0.833
  376   1HB   GLU 882          1HB       GLU 882  11.269  -5.997   2.181
  377   2HB   GLU 882          2HB       GLU 882  12.753  -6.768   1.573
  378   1HG   GLU 882          1HG       GLU 882  13.807  -4.434   2.422
  379   2HG   GLU 882          2HG       GLU 882  12.418  -4.527   3.527
  380    H    PHE 883           H        PHE 883  13.985  -6.735   0.052
  381    HA   PHE 883           HA       PHE 883  16.295  -5.084  -0.121
  382   1HB   PHE 883          1HB       PHE 883  17.392  -7.051  -0.940
  383   2HB   PHE 883          2HB       PHE 883  16.232  -7.553   0.302
  384    HD1  PHE 883           1HD      PHE 883  14.207  -8.794  -0.292
  385    HD2  PHE 883           2HD      PHE 883  17.077  -7.645  -3.274
  386    HE1  PHE 883           1HE      PHE 883  13.184 -10.389  -1.891
  387    HE2  PHE 883           2HE      PHE 883  16.054  -9.239  -4.874
  388    HZ   PHE 883           HZ       PHE 883  14.107 -10.612  -4.183
  389    H    ASP 884           H        ASP 884  13.720  -4.626  -1.913
  390    HA   ASP 884           HA       ASP 884  15.309  -3.829  -4.273
  391   1HB   ASP 884          1HB       ASP 884  12.782  -5.519  -4.375
  392   2HB   ASP 884          2HB       ASP 884  13.547  -4.745  -5.780
  393    H    MET 885           H        MET 885  15.062  -1.668  -3.643
  394    HA   MET 885           HA       MET 885  12.368  -0.586  -4.157
  395   1HB   MET 885          1HB       MET 885  13.009   0.949  -2.031
  396   2HB   MET 885          2HB       MET 885  12.042  -0.539  -1.889
  397   1HG   MET 885          1HG       MET 885  14.284  -1.765  -1.617
  398   2HG   MET 885          2HG       MET 885  15.005  -0.164  -1.380
  399   1HE   MET 885          1HE       MET 885  12.325  -2.664   1.245
  400   2HE   MET 885          2HE       MET 885  11.331  -1.444   0.413
  401   3HE   MET 885          3HE       MET 885  12.348  -2.558  -0.532
  402    H    THR 886           H        THR 886  15.856  -0.132  -3.590
  403    HA   THR 886           HA       THR 886  16.718   2.231  -3.899
  404    HB   THR 886           HB       THR 886  18.265   1.644  -5.570
  405    HG1  THR 886           1HG      THR 886  17.724   0.569  -7.338
  406   1HG2  THR 886          1HG2      THR 886  18.845  -0.642  -5.095
  407   2HG2  THR 886          2HG2      THR 886  18.066  -0.002  -3.629
  408   3HG2  THR 886          3HG2      THR 886  17.154  -1.061  -4.730
  409    H    SER 887           H        SER 887  14.759   0.904  -6.622
  410    HA   SER 887           HA       SER 887  14.359   3.665  -7.603
  411   1HB   SER 887          1HB       SER 887  14.346   0.946  -8.750
  412   2HB   SER 887          2HB       SER 887  13.009   1.976  -9.316
  413    HG   SER 887           HG       SER 887  14.527   2.690 -10.598
  414    H    ALA 888           H        ALA 888  12.868   1.284  -5.634
  415    HA   ALA 888           HA       ALA 888  10.168   1.440  -6.148
  416   1HB   ALA 888          1HB       ALA 888  10.842   0.050  -4.372
  417   2HB   ALA 888          2HB       ALA 888  11.754   1.353  -3.574
  418   3HB   ALA 888          3HB       ALA 888   9.975   1.372  -3.554
  419    H    THR 889           H        THR 889   8.591   2.684  -4.492
  420    HA   THR 889           HA       THR 889   9.398   5.551  -4.512
  421    HB   THR 889           HB       THR 889   7.631   4.492  -6.301
  422    HG1  THR 889           1HG      THR 889   6.810   6.687  -6.328
  423   1HG2  THR 889          1HG2      THR 889   6.230   3.995  -4.100
  424   2HG2  THR 889          2HG2      THR 889   5.809   5.718  -4.239
  425   3HG2  THR 889          3HG2      THR 889   5.423   4.598  -5.567
  426    H    HIS 890           H        HIS 890   7.268   2.991  -3.190
  427    HA   HIS 890           HA       HIS 890   7.163   4.571  -0.665
  428   1HB   HIS 890          1HB       HIS 890   4.997   3.072  -2.143
  429   2HB   HIS 890          2HB       HIS 890   4.896   3.342  -0.393
  430    HD1  HIS 890           1HD      HIS 890   6.147   5.964  -2.949
  431    HD2  HIS 890           2HD      HIS 890   2.970   5.134  -0.316
  432    HE1  HIS 890           1HE      HIS 890   4.686   8.061  -2.876
  433    H    VAL 891           H        VAL 891   6.808   3.204   1.279
  434    HA   VAL 891           HA       VAL 891   7.515   0.365   0.964
  435    HB   VAL 891           HB       VAL 891   9.357   0.666   2.692
  436   1HG1  VAL 891          1HG1      VAL 891   9.499   1.789  -0.119
  437   2HG1  VAL 891          2HG1      VAL 891  10.946   1.707   0.914
  438   3HG1  VAL 891          3HG1      VAL 891  10.074   0.216   0.483
  439   1HG2  VAL 891          1HG2      VAL 891   8.719   2.901   3.483
  440   2HG2  VAL 891          2HG2      VAL 891  10.359   2.951   2.792
  441   3HG2  VAL 891          3HG2      VAL 891   8.979   3.573   1.855
  442    H    LEU 892           H        LEU 892   6.285  -0.791   2.326
  443    HA   LEU 892           HA       LEU 892   4.660   0.580   4.304
  444   1HB   LEU 892          1HB       LEU 892   4.430  -1.729   2.777
  445   2HB   LEU 892          2HB       LEU 892   4.732  -2.355   4.416
  446    HG   LEU 892           HG       LEU 892   2.898  -0.129   4.572
  447   1HD1  LEU 892          1HD1      LEU 892   1.074  -1.735   3.353
  448   2HD1  LEU 892          2HD1      LEU 892   1.895  -0.390   2.526
  449   3HD1  LEU 892          3HD1      LEU 892   2.494  -2.054   2.329
  450   1HD2  LEU 892          1HD2      LEU 892   1.452  -2.345   5.221
  451   2HD2  LEU 892          2HD2      LEU 892   3.102  -3.002   5.338
  452   3HD2  LEU 892          3HD2      LEU 892   2.635  -1.591   6.316
  453    H    GLY 893           H        GLY 893   5.215   0.978   6.362
  454   1HA   GLY 893          1HA       GLY 893   6.456   0.963   8.300
  455   2HA   GLY 893          2HA       GLY 893   6.349  -0.806   8.159
  456    H    SER 894           H        SER 894   8.452   1.833   8.282
  457    HA   SER 894           HA       SER 894  10.771   1.768   8.331
  458   1HB   SER 894          1HB       SER 894  10.509  -0.928   6.943
  459   2HB   SER 894          2HB       SER 894  11.995  -0.235   7.635
  460    HG   SER 894           HG       SER 894   9.620  -0.974   9.002
  461    H    ARG 895           H        ARG 895  12.577   1.955   6.685
  462    HA   ARG 895           HA       ARG 895  11.608   2.254   3.911
  463   1HB   ARG 895          1HB       ARG 895  12.608   4.555   3.823
  464   2HB   ARG 895          2HB       ARG 895  11.173   4.442   4.869
  465   1HG   ARG 895          1HG       ARG 895  12.495   4.438   6.857
  466   2HG   ARG 895          2HG       ARG 895  13.994   4.124   5.949
  467   1HD   ARG 895          1HD       ARG 895  12.879   6.471   4.823
  468   2HD   ARG 895          2HD       ARG 895  12.728   6.660   6.583
  469    HE   ARG 895           HE       ARG 895  15.339   5.699   5.968
  470   1HH1  ARG 895          2HH2      ARG 895  13.300   8.570   5.649
  471   2HH1  ARG 895          1HH2      ARG 895  14.641   9.693   5.680
  472   1HH2  ARG 895          2HH1      ARG 895  17.110   7.183   6.009
  473   2HH2  ARG 895          1HH1      ARG 895  16.813   8.902   5.886
  474    H    ASP 896           H        ASP 896  14.214   2.175   6.322
  475    HA   ASP 896           HA       ASP 896  16.569   2.418   5.338
  476   1HB   ASP 896          1HB       ASP 896  16.506   0.972   7.168
  477   2HB   ASP 896          2HB       ASP 896  15.381  -0.150   6.374
  478    H    LYS 897           H        LYS 897  15.160  -0.712   4.271
  479    HA   LYS 897           HA       LYS 897  16.688  -1.318   2.159
  480   1HB   LYS 897          1HB       LYS 897  14.062  -1.612   1.130
  481   2HB   LYS 897          2HB       LYS 897  15.038  -2.830   1.986
  482   1HG   LYS 897          1HG       LYS 897  13.095  -2.686   3.311
  483   2HG   LYS 897          2HG       LYS 897  14.230  -1.604   4.152
  484   1HD   LYS 897          1HD       LYS 897  13.233   0.273   2.661
  485   2HD   LYS 897          2HD       LYS 897  11.914  -0.877   2.333
  486   1HE   LYS 897          1HE       LYS 897  12.032  -1.122   5.018
  487   2HE   LYS 897          2HE       LYS 897  12.637   0.543   4.866
  488   1HZ   LYS 897          1HZ       LYS 897  10.690   1.207   3.882
  489   2HZ   LYS 897          2HZ       LYS 897  10.205  -0.323   3.503
  490   3HZ   LYS 897          3HZ       LYS 897  10.171   0.188   5.071
  491    H    ASN 898           H        ASN 898  14.365   1.367   2.259
  492    HA   ASN 898           HA       ASN 898  15.704   2.617   0.001
  493   1HB   ASN 898          1HB       ASN 898  13.543   0.907  -0.558
  494   2HB   ASN 898          2HB       ASN 898  12.859   2.546  -0.606
  495   1HD2  ASN 898          1HD2      ASN 898  12.627   2.823  -2.806
  496   2HD2  ASN 898          2HD2      ASN 898  13.965   2.808  -3.934
  497    HA   PRO 899           HA       PRO 899  14.158   5.617   3.033
  498   1HB   PRO 899          1HB       PRO 899  16.172   7.421   2.691
  499   2HB   PRO 899          2HB       PRO 899  16.415   5.894   3.599
  500   1HG   PRO 899          1HG       PRO 899  17.052   6.419   0.682
  501   2HG   PRO 899          2HG       PRO 899  18.148   5.742   1.930
  502   1HD   PRO 899          1HD       PRO 899  16.752   4.125   0.238
  503   2HD   PRO 899          2HD       PRO 899  16.950   3.681   1.960
  504    H    ALA 900           H        ALA 900  14.636   5.555  -0.373
  505    HA   ALA 900           HA       ALA 900  13.642   8.284  -0.808
  506   1HB   ALA 900          1HB       ALA 900  15.337   7.491  -2.326
  507   2HB   ALA 900          2HB       ALA 900  14.423   5.999  -2.655
  508   3HB   ALA 900          3HB       ALA 900  13.805   7.566  -3.229
  509    H    ALA 901           H        ALA 901  12.298   5.352   0.058
  510    HA   ALA 901           HA       ALA 901   9.898   5.622  -1.631
  511   1HB   ALA 901          1HB       ALA 901   9.249   3.505  -0.693
  512   2HB   ALA 901          2HB       ALA 901  10.982   3.396  -1.087
  513   3HB   ALA 901          3HB       ALA 901  10.466   3.637   0.600
  514    H    GLN 902           H        GLN 902   8.107   4.572   0.426
  515    HA   GLN 902           HA       GLN 902   7.933   6.947   2.218
  516   1HB   GLN 902          1HB       GLN 902   5.868   5.672   0.425
  517   2HB   GLN 902          2HB       GLN 902   5.367   6.498   1.920
  518   1HG   GLN 902          1HG       GLN 902   7.013   7.689  -0.350
  519   2HG   GLN 902          2HG       GLN 902   5.325   8.077   0.048
  520   1HE2  GLN 902          1HE2      GLN 902   5.961   7.828   3.006
  521   2HE2  GLN 902          2HE2      GLN 902   6.765   9.328   3.416
  522    H    GLN 903           H        GLN 903   7.627   6.489   4.335
  523    HA   GLN 903           HA       GLN 903   7.504   3.656   5.094
  524   1HB   GLN 903          1HB       GLN 903   8.013   6.269   6.529
  525   2HB   GLN 903          2HB       GLN 903   7.700   4.768   7.434
  526   1HG   GLN 903          1HG       GLN 903   9.795   4.042   7.052
  527   2HG   GLN 903          2HG       GLN 903   9.592   4.258   5.300
  528   1HE2  GLN 903          1HE2      GLN 903  10.076   6.351   4.349
  529   2HE2  GLN 903          2HE2      GLN 903  11.195   7.438   5.144
  530    H    VAL 904           H        VAL 904   5.204   3.883   3.936
  531    HA   VAL 904           HA       VAL 904   3.148   5.007   5.677
  532    HB   VAL 904           HB       VAL 904   1.860   4.857   3.828
  533   1HG1  VAL 904          1HG1      VAL 904   3.053   4.963   1.817
  534   2HG1  VAL 904          2HG1      VAL 904   4.330   5.297   3.011
  535   3HG1  VAL 904          3HG1      VAL 904   4.179   3.672   2.300
  536   1HG2  VAL 904          1HG2      VAL 904   1.269   2.564   4.139
  537   2HG2  VAL 904          2HG2      VAL 904   1.817   2.683   2.450
  538   3HG2  VAL 904          3HG2      VAL 904   2.899   2.005   3.690
  539    H    SER 905           H        SER 905   1.199   3.495   6.167
  540    HA   SER 905           HA       SER 905   2.221   0.851   7.082
  541   1HB   SER 905          1HB       SER 905   1.534   1.209   9.235
  542   2HB   SER 905          2HB       SER 905   1.841   2.907   8.798
  543    HG   SER 905           HG       SER 905  -0.181   3.085   9.379
  544    HA   PRO 906           HA       PRO 906  -1.650  -0.896   5.866
  545   1HB   PRO 906          1HB       PRO 906  -2.960  -1.877   8.045
  546   2HB   PRO 906          2HB       PRO 906  -1.362  -2.514   7.536
  547   1HG   PRO 906          1HG       PRO 906  -1.913  -0.400   9.638
  548   2HG   PRO 906          2HG       PRO 906  -0.923  -1.886   9.821
  549   1HD   PRO 906          1HD       PRO 906   0.217   0.517   9.226
  550   2HD   PRO 906          2HD       PRO 906   0.804  -0.983   8.448
  551    H    GLU 907           H        GLU 907  -1.892   1.559   8.402
  552    HA   GLU 907           HA       GLU 907  -4.727   2.018   8.062
  553   1HB   GLU 907          1HB       GLU 907  -2.635   2.845   9.817
  554   2HB   GLU 907          2HB       GLU 907  -3.341   4.314   9.102
  555   1HG   GLU 907          1HG       GLU 907  -4.997   4.091  10.623
  556   2HG   GLU 907          2HG       GLU 907  -5.565   2.725   9.640
  557    H    TRP 908           H        TRP 908  -1.756   3.136   6.528
  558    HA   TRP 908           HA       TRP 908  -2.848   5.492   5.324
  559   1HB   TRP 908          1HB       TRP 908  -0.445   5.066   5.588
  560   2HB   TRP 908          2HB       TRP 908  -0.559   3.687   4.486
  561    HD1  TRP 908           HD       TRP 908  -0.773   7.516   4.504
  562    HE1  TRP 908           1HE      TRP 908  -0.261   8.418   2.178
  563    HE3  TRP 908           3HE      TRP 908  -0.495   3.082   1.963
  564    HZ2  TRP 908           2HZ      TRP 908   0.213   7.353  -0.471
  565    HZ3  TRP 908           3HZ      TRP 908  -0.012   3.066  -0.457
  566    HH2  TRP 908           HH       TRP 908   0.344   5.187  -1.686
  567    H    ILE 909           H        ILE 909  -2.420   2.109   4.181
  568    HA   ILE 909           HA       ILE 909  -3.363   2.421   1.572
  569    HB   ILE 909           HB       ILE 909  -3.223   0.205   3.570
  570   1HG1  ILE 909          1HG1      ILE 909  -2.501  -0.471   0.873
  571   2HG1  ILE 909          2HG1      ILE 909  -1.846   1.143   1.235
  572   1HG2  ILE 909          1HG2      ILE 909  -5.490  -0.093   2.676
  573   2HG2  ILE 909          2HG2      ILE 909  -4.881   0.090   1.014
  574   3HG2  ILE 909          3HG2      ILE 909  -4.404  -1.323   1.986
  575   1HD1  ILE 909          1HD1      ILE 909  -0.293  -0.725   1.879
  576   2HD1  ILE 909          2HD1      ILE 909  -0.764   0.302   3.254
  577   3HD1  ILE 909          3HD1      ILE 909  -1.520  -1.294   3.035
  578    H    TRP 910           H        TRP 910  -5.257   1.572   4.529
  579    HA   TRP 910           HA       TRP 910  -7.782   1.612   3.225
  580   1HB   TRP 910          1HB       TRP 910  -7.349   2.351   6.114
  581   2HB   TRP 910          2HB       TRP 910  -8.696   1.468   5.382
  582    HD1  TRP 910           HD       TRP 910  -6.015   0.837   7.599
  583    HE1  TRP 910           1HE      TRP 910  -5.214  -1.581   7.599
  584    HE3  TRP 910           3HE      TRP 910  -8.140  -0.718   3.210
  585    HZ2  TRP 910           2HZ      TRP 910  -5.459  -3.914   5.906
  586    HZ3  TRP 910           3HZ      TRP 910  -7.835  -3.041   2.438
  587    HH2  TRP 910           HH       TRP 910  -6.500  -4.648   3.770
  588    H    ALA 911           H        ALA 911  -6.283   4.074   5.404
  589    HA   ALA 911           HA       ALA 911  -8.195   6.073   5.068
  590   1HB   ALA 911          1HB       ALA 911  -6.437   7.620   5.767
  591   2HB   ALA 911          2HB       ALA 911  -6.303   6.104   6.690
  592   3HB   ALA 911          3HB       ALA 911  -5.185   6.428   5.343
  593    H    CYS 912           H        CYS 912  -5.493   5.120   2.959
  594    HA   CYS 912           HA       CYS 912  -5.759   7.392   1.194
  595   1HB   CYS 912          1HB       CYS 912  -4.423   4.674   0.865
  596   2HB   CYS 912          2HB       CYS 912  -4.256   6.037  -0.270
  597    HG   CYS 912           HG       CYS 912  -3.962   6.913   2.778
  598    H    ILE 913           H        ILE 913  -6.208   3.902   0.418
  599    HA   ILE 913           HA       ILE 913  -7.706   4.187  -1.869
  600    HB   ILE 913           HB       ILE 913  -6.941   2.023  -1.095
  601   1HG1  ILE 913          1HG1      ILE 913  -9.976   1.961  -0.937
  602   2HG1  ILE 913          2HG1      ILE 913  -9.105   2.251  -2.462
  603   1HG2  ILE 913          1HG2      ILE 913  -8.916   1.444   0.929
  604   2HG2  ILE 913          2HG2      ILE 913  -7.142   1.418   1.065
  605   3HG2  ILE 913          3HG2      ILE 913  -8.037   2.923   1.383
  606   1HD1  ILE 913          1HD1      ILE 913  -9.776  -0.212  -1.776
  607   2HD1  ILE 913          2HD1      ILE 913  -8.181   0.104  -2.498
  608   3HD1  ILE 913          3HD1      ILE 913  -8.335  -0.102  -0.737
  609    H    ARG 914           H        ARG 914  -8.762   4.579   1.498
  610    HA   ARG 914           HA       ARG 914 -11.578   4.683   0.856
  611   1HB   ARG 914          1HB       ARG 914 -10.618   4.065   3.094
  612   2HB   ARG 914          2HB       ARG 914 -10.105   5.758   3.291
  613   1HG   ARG 914          1HG       ARG 914 -12.927   5.453   2.466
  614   2HG   ARG 914          2HG       ARG 914 -12.562   4.746   4.059
  615   1HD   ARG 914          1HD       ARG 914 -11.501   6.878   4.751
  616   2HD   ARG 914          2HD       ARG 914 -11.892   7.581   3.167
  617    HE   ARG 914           HE       ARG 914 -14.069   7.904   3.873
  618   1HH1  ARG 914          2HH2      ARG 914 -12.433   5.587   5.984
  619   2HH1  ARG 914          1HH2      ARG 914 -13.743   5.509   7.141
  620   1HH2  ARG 914          2HH1      ARG 914 -15.799   7.800   5.401
  621   2HH2  ARG 914          1HH1      ARG 914 -15.662   6.771   6.808
  622    H    LYS 915           H        LYS 915  -8.899   6.997   1.064
  623    HA   LYS 915           HA       LYS 915 -10.729   9.281   0.811
  624   1HB   LYS 915          1HB       LYS 915  -7.705   9.009   0.970
  625   2HB   LYS 915          2HB       LYS 915  -8.551  10.564   0.787
  626   1HG   LYS 915          1HG       LYS 915  -9.341   8.649   2.991
  627   2HG   LYS 915          2HG       LYS 915  -7.937   9.724   3.197
  628   1HD   LYS 915          1HD       LYS 915  -9.305  11.690   2.824
  629   2HD   LYS 915          2HD       LYS 915 -10.705  10.688   2.372
  630   1HE   LYS 915          1HE       LYS 915 -11.320  10.721   4.538
  631   2HE   LYS 915          2HE       LYS 915  -9.898   9.713   4.884
  632   1HZ   LYS 915          1HZ       LYS 915  -8.714  11.960   4.902
  633   2HZ   LYS 915          2HZ       LYS 915 -10.218  12.589   5.155
  634   3HZ   LYS 915          3HZ       LYS 915  -9.590  11.498   6.221
  635    H    ARG 916           H        ARG 916  -9.661   6.949  -1.254
  636    HA   ARG 916           HA       ARG 916  -9.365   6.815  -3.522
  637   1HB   ARG 916          1HB       ARG 916 -11.498   8.678  -2.981
  638   2HB   ARG 916          2HB       ARG 916 -10.614   9.205  -4.434
  639   1HG   ARG 916          1HG       ARG 916 -11.206   6.281  -4.187
  640   2HG   ARG 916          2HG       ARG 916 -12.580   7.359  -4.530
  641   1HD   ARG 916          1HD       ARG 916 -10.212   8.034  -6.121
  642   2HD   ARG 916          2HD       ARG 916 -10.749   6.363  -6.396
  643    HE   ARG 916           HE       ARG 916 -12.809   8.480  -6.484
  644   1HH1  ARG 916          2HH2      ARG 916 -10.651   6.255  -8.185
  645   2HH1  ARG 916          1HH2      ARG 916 -11.528   6.343  -9.696
  646   1HH2  ARG 916          2HH1      ARG 916 -13.966   8.597  -8.480
  647   2HH2  ARG 916          1HH1      ARG 916 -13.418   7.679  -9.864
  648    H    ARG 917           H        ARG 917  -7.625   8.732  -1.712
  649    HA   ARG 917           HA       ARG 917  -5.906   9.563  -3.914
  650   1HB   ARG 917          1HB       ARG 917  -6.032  11.874  -3.646
  651   2HB   ARG 917          2HB       ARG 917  -7.735  11.401  -3.437
  652   1HG   ARG 917          1HG       ARG 917  -7.350  12.814  -1.591
  653   2HG   ARG 917          2HG       ARG 917  -7.116  11.189  -0.904
  654   1HD   ARG 917          1HD       ARG 917  -5.022  11.754  -0.315
  655   2HD   ARG 917          2HD       ARG 917  -4.621  12.003  -2.028
  656    HE   ARG 917           HE       ARG 917  -5.356  14.070  -0.051
  657   1HH1  ARG 917          2HH2      ARG 917  -4.659  13.174  -3.400
  658   2HH1  ARG 917          1HH2      ARG 917  -4.327  14.814  -3.913
  659   1HH2  ARG 917          2HH1      ARG 917  -4.917  16.235  -0.730
  660   2HH2  ARG 917          1HH1      ARG 917  -4.474  16.559  -2.391
  661    H    LEU 918           H        LEU 918  -3.874   9.151  -3.282
  662    HA   LEU 918           HA       LEU 918  -3.081   8.060  -0.916
  663   1HB   LEU 918          1HB       LEU 918  -1.623   9.926  -2.808
  664   2HB   LEU 918          2HB       LEU 918  -0.810   9.168  -1.418
  665    HG   LEU 918           HG       LEU 918  -0.412   7.581  -3.081
  666   1HD1  LEU 918          1HD1      LEU 918  -1.630   5.691  -2.452
  667   2HD1  LEU 918          2HD1      LEU 918  -1.957   6.782  -1.084
  668   3HD1  LEU 918          3HD1      LEU 918  -3.169   6.582  -2.373
  669   1HD2  LEU 918          1HD2      LEU 918  -3.246   7.918  -4.134
  670   2HD2  LEU 918          2HD2      LEU 918  -1.871   8.875  -4.735
  671   3HD2  LEU 918          3HD2      LEU 918  -1.875   7.106  -4.926
  672    H    VAL 919           H        VAL 919  -3.001   8.659   1.166
  673    HA   VAL 919           HA       VAL 919  -3.326  11.546   1.775
  674    HB   VAL 919           HB       VAL 919  -4.469  10.906   3.664
  675   1HG1  VAL 919          1HG1      VAL 919  -4.824   9.073   1.418
  676   2HG1  VAL 919          2HG1      VAL 919  -5.228   8.288   2.963
  677   3HG1  VAL 919          3HG1      VAL 919  -6.047   9.796   2.489
  678   1HG2  VAL 919          1HG2      VAL 919  -2.313   8.909   3.787
  679   2HG2  VAL 919          2HG2      VAL 919  -3.192   9.715   5.109
  680   3HG2  VAL 919          3HG2      VAL 919  -3.879   8.266   4.337
  681    H    ALA 920           H        ALA 920  -2.384  11.373   4.466
  682    HA   ALA 920           HA       ALA 920   0.436  11.746   3.985
  683   1HB   ALA 920          1HB       ALA 920  -0.857  13.094   5.607
  684   2HB   ALA 920          2HB       ALA 920  -1.152  11.632   6.580
  685   3HB   ALA 920          3HB       ALA 920   0.504  12.257   6.393
  686    HA   PRO 921           HA       PRO 921   1.326   7.397   4.585
  687   1HB   PRO 921          1HB       PRO 921   3.932   7.511   3.799
  688   2HB   PRO 921          2HB       PRO 921   2.584   7.675   2.628
  689   1HG   PRO 921          1HG       PRO 921   4.130   9.908   3.974
  690   2HG   PRO 921          2HG       PRO 921   3.825   9.700   2.218
  691   1HD   PRO 921          1HD       PRO 921   2.243  11.301   3.756
  692   2HD   PRO 921          2HD       PRO 921   1.524  10.268   2.484
  693    H    CYS 922           H        CYS 922   1.843   6.469   6.493
  694    HA   CYS 922           HA       CYS 922   4.116   7.304   8.056
  695   1HB   CYS 922          1HB       CYS 922   2.153   9.025   8.481
  696   2HB   CYS 922          2HB       CYS 922   1.497   7.709   9.487
  697    HG   CYS 922           HG       CYS 922   4.339   9.356   9.620
  Start of MODEL    2
    1    H    GLY 835           H        GLY 835 -13.443  -2.888  12.636
    2   1HA   GLY 835          1HA       GLY 835 -11.253  -3.734  11.666
    3   2HA   GLY 835          2HA       GLY 835 -12.240  -5.013  10.923
    4    H    SER 836           H        SER 836 -10.572  -2.694   9.802
    5    HA   SER 836           HA       SER 836 -12.673  -1.156   8.404
    6   1HB   SER 836          1HB       SER 836  -9.814  -0.806   9.070
    7   2HB   SER 836          2HB       SER 836 -10.256  -0.284   7.426
    8    HG   SER 836           HG       SER 836 -10.630   1.413   8.807
    9    H    ALA 837           H        ALA 837  -9.645  -2.917   7.517
   10    HA   ALA 837           HA       ALA 837  -9.927  -3.078   4.810
   11   1HB   ALA 837          1HB       ALA 837  -8.168  -4.128   6.410
   12   2HB   ALA 837          2HB       ALA 837  -9.236  -5.553   6.407
   13   3HB   ALA 837          3HB       ALA 837  -8.526  -4.969   4.883
   14    H    ASP 838           H        ASP 838 -11.237  -5.604   7.040
   15    HA   ASP 838           HA       ASP 838 -12.676  -7.084   5.214
   16   1HB   ASP 838          1HB       ASP 838 -13.721  -6.318   7.958
   17   2HB   ASP 838          2HB       ASP 838 -14.012  -7.823   7.060
   18    H    GLU 839           H        GLU 839 -13.583  -3.974   6.730
   19    HA   GLU 839           HA       GLU 839 -16.219  -3.965   5.515
   20   1HB   GLU 839          1HB       GLU 839 -14.644  -2.329   7.374
   21   2HB   GLU 839          2HB       GLU 839 -15.605  -1.352   6.238
   22   1HG   GLU 839          1HG       GLU 839 -17.162  -3.614   7.169
   23   2HG   GLU 839          2HG       GLU 839 -16.519  -2.710   8.557
   24    H    THR 840           H        THR 840 -12.971  -2.900   4.660
   25    HA   THR 840           HA       THR 840 -13.880  -1.139   2.529
   26    HB   THR 840           HB       THR 840 -11.105  -2.308   2.803
   27    HG1  THR 840           1HG      THR 840 -10.799  -0.459   4.238
   28   1HG2  THR 840          1HG2      THR 840 -12.234   0.396   1.957
   29   2HG2  THR 840          2HG2      THR 840 -10.505  -0.026   2.004
   30   3HG2  THR 840          3HG2      THR 840 -11.595  -0.862   0.871
   31    H    LEU 841           H        LEU 841 -12.313  -4.378   2.737
   32    HA   LEU 841           HA       LEU 841 -12.386  -4.847  -0.083
   33   1HB   LEU 841          1HB       LEU 841 -11.979  -6.510   2.396
   34   2HB   LEU 841          2HB       LEU 841 -12.210  -7.316   0.825
   35    HG   LEU 841           HG       LEU 841  -9.784  -6.491   1.725
   36   1HD1  LEU 841          1HD1      LEU 841  -9.919  -5.994  -1.134
   37   2HD1  LEU 841          2HD1      LEU 841  -9.218  -7.381  -0.268
   38   3HD1  LEU 841          3HD1      LEU 841 -10.944  -7.383  -0.701
   39   1HD2  LEU 841          1HD2      LEU 841  -9.745  -4.218   1.726
   40   2HD2  LEU 841          2HD2      LEU 841  -9.634  -4.370  -0.044
   41   3HD2  LEU 841          3HD2      LEU 841 -11.215  -4.104   0.729
   42    H    CYS 842           H        CYS 842 -14.890  -4.471   2.086
   43    HA   CYS 842           HA       CYS 842 -16.667  -6.572   1.576
   44   1HB   CYS 842          1HB       CYS 842 -16.791  -4.395   3.098
   45   2HB   CYS 842          2HB       CYS 842 -17.675  -3.742   1.697
   46    HG   CYS 842           HG       CYS 842 -19.231  -4.729   3.681
   47    H    GLN 843           H        GLN 843 -15.222  -4.510  -0.665
   48    HA   GLN 843           HA       GLN 843 -17.472  -4.908  -2.582
   49   1HB   GLN 843          1HB       GLN 843 -15.278  -2.863  -2.928
   50   2HB   GLN 843          2HB       GLN 843 -16.923  -2.876  -3.608
   51   1HG   GLN 843          1HG       GLN 843 -17.018  -2.940  -0.703
   52   2HG   GLN 843          2HG       GLN 843 -16.047  -1.560  -1.262
   53   1HE2  GLN 843          1HE2      GLN 843 -18.196  -0.725  -0.035
   54   2HE2  GLN 843          2HE2      GLN 843 -19.479  -0.254  -1.128
   55    H    THR 844           H        THR 844 -16.363  -7.146  -2.622
   56    HA   THR 844           HA       THR 844 -15.196  -8.649  -3.897
   57    HB   THR 844           HB       THR 844 -15.618  -6.414  -5.594
   58    HG1  THR 844           1HG      THR 844 -15.710  -8.013  -7.062
   59   1HG2  THR 844          1HG2      THR 844 -13.403  -5.717  -5.752
   60   2HG2  THR 844          2HG2      THR 844 -12.759  -7.345  -5.435
   61   3HG2  THR 844          3HG2      THR 844 -13.444  -6.954  -7.031
   62    H    LYS 845           H        LYS 845 -13.160  -5.698  -4.274
   63    HA   LYS 845           HA       LYS 845 -11.202  -6.743  -2.374
   64   1HB   LYS 845          1HB       LYS 845 -11.001  -7.442  -5.123
   65   2HB   LYS 845          2HB       LYS 845  -9.767  -6.196  -4.817
   66   1HG   LYS 845          1HG       LYS 845  -8.668  -8.207  -4.244
   67   2HG   LYS 845          2HG       LYS 845  -9.223  -7.578  -2.673
   68   1HD   LYS 845          1HD       LYS 845 -11.284  -9.196  -3.973
   69   2HD   LYS 845          2HD       LYS 845  -9.776 -10.114  -3.751
   70   1HE   LYS 845          1HE       LYS 845  -9.835  -8.997  -1.343
   71   2HE   LYS 845          2HE       LYS 845 -11.571  -8.850  -1.691
   72   1HZ   LYS 845          1HZ       LYS 845 -10.212 -11.390  -2.096
   73   2HZ   LYS 845          2HZ       LYS 845 -10.681 -10.942  -0.579
   74   3HZ   LYS 845          3HZ       LYS 845 -11.803 -11.093  -1.779
   75    H    VAL 846           H        VAL 846 -12.893  -4.297  -3.845
   76    HA   VAL 846           HA       VAL 846 -12.586  -2.020  -4.076
   77    HB   VAL 846           HB       VAL 846 -11.358  -1.156  -1.861
   78   1HG1  VAL 846          1HG1      VAL 846 -13.491  -1.033  -0.898
   79   2HG1  VAL 846          2HG1      VAL 846 -13.878  -1.265  -2.619
   80   3HG1  VAL 846          3HG1      VAL 846 -13.963  -2.642  -1.495
   81   1HG2  VAL 846          1HG2      VAL 846 -10.978  -3.924  -1.667
   82   2HG2  VAL 846          2HG2      VAL 846 -10.821  -2.746  -0.342
   83   3HG2  VAL 846          3HG2      VAL 846 -12.361  -3.603  -0.593
   84    H    LEU 847           H        LEU 847 -11.300  -0.992  -5.479
   85    HA   LEU 847           HA       LEU 847  -8.419  -0.826  -4.929
   86   1HB   LEU 847          1HB       LEU 847  -9.345  -1.769  -7.654
   87   2HB   LEU 847          2HB       LEU 847  -7.702  -1.780  -6.969
   88    HG   LEU 847           HG       LEU 847  -8.858  -4.044  -7.011
   89   1HD1  LEU 847          1HD1      LEU 847  -8.535  -3.960  -4.206
   90   2HD1  LEU 847          2HD1      LEU 847  -7.298  -4.379  -5.415
   91   3HD1  LEU 847          3HD1      LEU 847  -7.451  -2.700  -4.844
   92   1HD2  LEU 847          1HD2      LEU 847 -10.384  -3.546  -4.581
   93   2HD2  LEU 847          2HD2      LEU 847 -10.971  -2.524  -5.914
   94   3HD2  LEU 847          3HD2      LEU 847 -10.911  -4.292  -6.108
   95    H    LEU 848           H        LEU 848  -9.367   1.369  -4.494
   96    HA   LEU 848           HA       LEU 848 -10.239   2.863  -6.859
   97   1HB   LEU 848          1HB       LEU 848 -10.194   3.220  -3.925
   98   2HB   LEU 848          2HB       LEU 848  -9.848   4.701  -4.849
   99    HG   LEU 848           HG       LEU 848 -12.115   2.966  -5.778
  100   1HD1  LEU 848          1HD1      LEU 848 -13.278   4.815  -4.017
  101   2HD1  LEU 848          2HD1      LEU 848 -13.159   3.055  -3.775
  102   3HD1  LEU 848          3HD1      LEU 848 -11.913   4.133  -3.100
  103   1HD2  LEU 848          1HD2      LEU 848 -12.931   5.579  -5.790
  104   2HD2  LEU 848          2HD2      LEU 848 -11.168   5.781  -5.940
  105   3HD2  LEU 848          3HD2      LEU 848 -12.058   4.805  -7.134
  106    H    ASP 849           H        ASP 849  -9.147   5.175  -7.011
  107    HA   ASP 849           HA       ASP 849  -6.380   4.657  -7.726
  108   1HB   ASP 849          1HB       ASP 849  -6.441   6.890  -8.642
  109   2HB   ASP 849          2HB       ASP 849  -7.969   6.081  -9.051
  110    H    ILE 850           H        ILE 850  -6.591   4.168  -5.029
  111    HA   ILE 850           HA       ILE 850  -6.011   6.487  -3.427
  112    HB   ILE 850           HB       ILE 850  -4.970   3.940  -2.422
  113   1HG1  ILE 850          1HG1      ILE 850  -6.802   3.302  -4.178
  114   2HG1  ILE 850          2HG1      ILE 850  -6.913   2.610  -2.541
  115   1HG2  ILE 850          1HG2      ILE 850  -6.058   6.254  -1.419
  116   2HG2  ILE 850          2HG2      ILE 850  -7.448   5.146  -1.321
  117   3HG2  ILE 850          3HG2      ILE 850  -5.921   4.732  -0.506
  118   1HD1  ILE 850          1HD1      ILE 850  -9.093   3.394  -2.869
  119   2HD1  ILE 850          2HD1      ILE 850  -8.338   4.774  -2.036
  120   3HD1  ILE 850          3HD1      ILE 850  -8.552   4.809  -3.802
  121    H    PHE 851           H        PHE 851  -3.773   3.756  -3.374
  122    HA   PHE 851           HA       PHE 851  -1.481   5.392  -3.208
  123   1HB   PHE 851          1HB       PHE 851  -1.441   2.602  -4.348
  124   2HB   PHE 851          2HB       PHE 851  -0.262   3.392  -3.288
  125    HD1  PHE 851           1HD      PHE 851  -1.636   4.343  -1.016
  126    HD2  PHE 851           2HD      PHE 851  -2.474   0.814  -3.317
  127    HE1  PHE 851           1HE      PHE 851  -2.719   3.310   0.962
  128    HE2  PHE 851           2HE      PHE 851  -3.557  -0.219  -1.339
  129    HZ   PHE 851           HZ       PHE 851  -3.679   1.030   0.801
  130    H    THR 852           H        THR 852  -3.334   5.971  -5.531
  131    HA   THR 852           HA       THR 852  -2.471   5.254  -8.010
  132    HB   THR 852           HB       THR 852  -4.043   7.249  -7.009
  133    HG1  THR 852           1HG      THR 852  -4.491   6.538  -8.981
  134   1HG2  THR 852          1HG2      THR 852  -2.088   8.710  -6.602
  135   2HG2  THR 852          2HG2      THR 852  -1.621   8.565  -8.313
  136   3HG2  THR 852          3HG2      THR 852  -3.136   9.388  -7.871
  137    H    GLY 853           H        GLY 853  -0.419   4.832  -8.622
  138   1HA   GLY 853          1HA       GLY 853   1.738   5.311  -9.281
  139   2HA   GLY 853          2HA       GLY 853   1.457   7.015  -8.857
  140    H    VAL 854           H        VAL 854   0.506   5.328  -6.185
  141    HA   VAL 854           HA       VAL 854   2.886   6.061  -4.711
  142    HB   VAL 854           HB       VAL 854   0.268   4.692  -4.039
  143   1HG1  VAL 854          1HG1      VAL 854   2.446   5.408  -2.045
  144   2HG1  VAL 854          2HG1      VAL 854   0.957   4.476  -1.760
  145   3HG1  VAL 854          3HG1      VAL 854   2.278   3.771  -2.724
  146   1HG2  VAL 854          1HG2      VAL 854   0.290   6.799  -2.481
  147   2HG2  VAL 854          2HG2      VAL 854   1.577   7.379  -3.566
  148   3HG2  VAL 854          3HG2      VAL 854  -0.040   7.018  -4.216
  149    H    ARG 855           H        ARG 855   4.705   4.890  -5.020
  150    HA   ARG 855           HA       ARG 855   4.464   1.955  -5.324
  151   1HB   ARG 855          1HB       ARG 855   6.554   2.025  -6.344
  152   2HB   ARG 855          2HB       ARG 855   5.888   3.609  -6.808
  153   1HG   ARG 855          1HG       ARG 855   6.992   4.483  -4.622
  154   2HG   ARG 855          2HG       ARG 855   7.923   2.966  -4.655
  155   1HD   ARG 855          1HD       ARG 855   9.011   4.980  -5.802
  156   2HD   ARG 855          2HD       ARG 855   8.897   3.494  -6.769
  157    HE   ARG 855           HE       ARG 855   7.080   4.478  -8.018
  158   1HH1  ARG 855          2HH2      ARG 855   8.728   6.630  -5.747
  159   2HH1  ARG 855          1HH2      ARG 855   8.169   8.097  -6.519
  160   1HH2  ARG 855          2HH1      ARG 855   6.341   6.416  -9.037
  161   2HH2  ARG 855          1HH1      ARG 855   6.808   7.975  -8.395
  162    H    LEU 856           H        LEU 856   3.856   1.580  -3.088
  163    HA   LEU 856           HA       LEU 856   5.998   2.147  -1.117
  164   1HB   LEU 856          1HB       LEU 856   4.353   2.244   0.444
  165   2HB   LEU 856          2HB       LEU 856   3.274   2.446  -0.957
  166    HG   LEU 856           HG       LEU 856   2.794   0.076  -1.019
  167   1HD1  LEU 856          1HD1      LEU 856   3.964  -1.095   1.197
  168   2HD1  LEU 856          2HD1      LEU 856   4.554  -1.255  -0.475
  169   3HD1  LEU 856          3HD1      LEU 856   5.261  -0.030   0.604
  170   1HD2  LEU 856          1HD2      LEU 856   2.780   0.634   1.946
  171   2HD2  LEU 856          2HD2      LEU 856   1.824   1.668   0.858
  172   3HD2  LEU 856          3HD2      LEU 856   1.510  -0.082   0.926
  173    H    TYR 857           H        TYR 857   7.157   0.535  -0.137
  174    HA   TYR 857           HA       TYR 857   7.109  -2.069  -1.433
  175   1HB   TYR 857          1HB       TYR 857   9.267  -1.708  -0.913
  176   2HB   TYR 857          2HB       TYR 857   8.863  -0.511   0.329
  177    HD1  TYR 857           1HD      TYR 857   9.837  -1.035   2.356
  178    HD2  TYR 857           2HD      TYR 857   8.218  -4.199  -0.056
  179    HE1  TYR 857           1HE      TYR 857  10.407  -2.677   4.126
  180    HE2  TYR 857           2HE      TYR 857   8.788  -5.840   1.713
  181    HH   TYR 857           HH       TYR 857  10.290  -4.855   4.804
  182    H    LEU 858           H        LEU 858   5.333  -3.283  -0.934
  183    HA   LEU 858           HA       LEU 858   4.283  -3.345   1.784
  184   1HB   LEU 858          1HB       LEU 858   2.836  -3.500  -0.238
  185   2HB   LEU 858          2HB       LEU 858   3.613  -5.049  -0.647
  186    HG   LEU 858           HG       LEU 858   2.469  -6.186   0.962
  187   1HD1  LEU 858          1HD1      LEU 858   1.928  -5.091   3.216
  188   2HD1  LEU 858          2HD1      LEU 858   3.656  -5.277   2.835
  189   3HD1  LEU 858          3HD1      LEU 858   2.871  -3.690   2.652
  190   1HD2  LEU 858          1HD2      LEU 858   0.658  -3.884   1.518
  191   2HD2  LEU 858          2HD2      LEU 858   0.876  -4.304  -0.198
  192   3HD2  LEU 858          3HD2      LEU 858   0.275  -5.526   0.947
  193    HA   PRO 859           HA       PRO 859   7.247  -6.529   2.868
  194   1HB   PRO 859          1HB       PRO 859   6.742  -6.507   5.545
  195   2HB   PRO 859          2HB       PRO 859   7.611  -5.163   4.736
  196   1HG   PRO 859          1HG       PRO 859   4.653  -5.313   5.385
  197   2HG   PRO 859          2HG       PRO 859   5.793  -3.990   5.798
  198   1HD   PRO 859          1HD       PRO 859   4.217  -3.867   3.577
  199   2HD   PRO 859          2HD       PRO 859   5.911  -3.291   3.521
  200    HA   PRO 860           HA       PRO 860   4.462  -9.960   2.833
  201   1HB   PRO 860          1HB       PRO 860   6.186 -11.964   3.492
  202   2HB   PRO 860          2HB       PRO 860   6.331 -11.062   1.948
  203   1HG   PRO 860          1HG       PRO 860   7.827 -10.535   4.532
  204   2HG   PRO 860          2HG       PRO 860   8.526 -10.752   2.895
  205   1HD   PRO 860          1HD       PRO 860   8.033  -8.272   3.912
  206   2HD   PRO 860          2HD       PRO 860   7.703  -8.628   2.190
  207    H    SER 861           H        SER 861   6.339  -8.961   5.632
  208    HA   SER 861           HA       SER 861   5.025 -10.786   7.476
  209   1HB   SER 861          1HB       SER 861   7.260  -8.981   7.481
  210   2HB   SER 861          2HB       SER 861   6.172  -8.541   8.820
  211    HG   SER 861           HG       SER 861   7.078 -10.175   9.770
  212    H    THR 862           H        THR 862   4.170  -7.890   5.873
  213    HA   THR 862           HA       THR 862   2.599  -6.676   7.953
  214    HB   THR 862           HB       THR 862   3.111  -6.313   5.063
  215    HG1  THR 862           1HG      THR 862   2.739  -4.089   5.944
  216   1HG2  THR 862          1HG2      THR 862   1.060  -5.572   4.383
  217   2HG2  THR 862          2HG2      THR 862   0.461  -6.647   5.668
  218   3HG2  THR 862          3HG2      THR 862   0.660  -4.907   5.985
  219    HA   PRO 863           HA       PRO 863  -0.898  -9.351   7.890
  220   1HB   PRO 863          1HB       PRO 863  -2.726  -7.738   9.106
  221   2HB   PRO 863          2HB       PRO 863  -1.289  -8.364   9.978
  222   1HG   PRO 863          1HG       PRO 863  -1.584  -5.671   8.616
  223   2HG   PRO 863          2HG       PRO 863  -1.049  -5.987  10.299
  224   1HD   PRO 863          1HD       PRO 863   0.747  -5.621   8.281
  225   2HD   PRO 863          2HD       PRO 863   1.038  -6.858   9.542
  226    H    ASP 864           H        ASP 864  -2.776  -9.706   6.660
  227    HA   ASP 864           HA       ASP 864  -4.273  -9.401   4.953
  228   1HB   ASP 864          1HB       ASP 864  -3.958  -6.747   6.140
  229   2HB   ASP 864          2HB       ASP 864  -4.327  -6.661   4.404
  230    H    PHE 865           H        PHE 865  -1.120  -9.219   4.753
  231    HA   PHE 865           HA       PHE 865  -0.317  -7.759   2.551
  232   1HB   PHE 865          1HB       PHE 865   1.024  -9.316   4.063
  233   2HB   PHE 865          2HB       PHE 865   0.465 -10.646   3.034
  234    HD1  PHE 865           1HD      PHE 865   2.052  -7.252   2.692
  235    HD2  PHE 865           2HD      PHE 865   1.832 -11.306   1.289
  236    HE1  PHE 865           1HE      PHE 865   3.905  -6.804   1.105
  237    HE2  PHE 865           2HE      PHE 865   3.684 -10.858  -0.298
  238    HZ   PHE 865           HZ       PHE 865   4.721  -8.606  -0.390
  239    H    SER 866           H        SER 866  -1.938 -10.970   2.575
  240    HA   SER 866           HA       SER 866  -1.942 -11.864   0.084
  241   1HB   SER 866          1HB       SER 866  -3.473 -12.753   1.743
  242   2HB   SER 866          2HB       SER 866  -4.446 -11.262   1.704
  243    HG   SER 866           HG       SER 866  -5.080 -11.735  -0.350
  244    H    ARG 867           H        ARG 867  -4.672  -9.632   0.705
  245    HA   ARG 867           HA       ARG 867  -4.749  -8.814  -2.047
  246   1HB   ARG 867          1HB       ARG 867  -6.034  -7.421   0.325
  247   2HB   ARG 867          2HB       ARG 867  -6.585  -7.442  -1.368
  248   1HG   ARG 867          1HG       ARG 867  -7.716  -9.366  -1.034
  249   2HG   ARG 867          2HG       ARG 867  -6.266 -10.155  -0.368
  250   1HD   ARG 867          1HD       ARG 867  -6.719  -9.320   1.836
  251   2HD   ARG 867          2HD       ARG 867  -7.977  -8.220   1.233
  252    HE   ARG 867           HE       ARG 867  -8.852 -10.738   0.491
  253   1HH1  ARG 867          2HH2      ARG 867  -7.885  -9.165   3.506
  254   2HH1  ARG 867          1HH2      ARG 867  -8.949 -10.126   4.508
  255   1HH2  ARG 867          2HH1      ARG 867 -10.257 -12.007   1.815
  256   2HH2  ARG 867          1HH1      ARG 867 -10.301 -11.747   3.544
  257    H    LEU 868           H        LEU 868  -3.475  -7.389   0.975
  258    HA   LEU 868           HA       LEU 868  -2.944  -4.817   0.403
  259   1HB   LEU 868          1HB       LEU 868  -1.410  -6.974   1.757
  260   2HB   LEU 868          2HB       LEU 868  -0.479  -5.522   1.319
  261    HG   LEU 868           HG       LEU 868  -2.616  -5.867   3.341
  262   1HD1  LEU 868          1HD1      LEU 868  -0.840  -4.989   4.437
  263   2HD1  LEU 868          2HD1      LEU 868  -0.061  -4.489   2.916
  264   3HD1  LEU 868          3HD1      LEU 868  -1.274  -3.436   3.683
  265   1HD2  LEU 868          1HD2      LEU 868  -3.874  -4.617   1.623
  266   2HD2  LEU 868          2HD2      LEU 868  -3.504  -3.573   3.016
  267   3HD2  LEU 868          3HD2      LEU 868  -2.556  -3.425   1.517
  268    H    ARG 869           H        ARG 869  -0.923  -7.539  -0.832
  269    HA   ARG 869           HA       ARG 869   0.766  -5.906  -2.430
  270   1HB   ARG 869          1HB       ARG 869   1.108  -8.329  -1.689
  271   2HB   ARG 869          2HB       ARG 869  -0.010  -8.785  -2.997
  272   1HG   ARG 869          1HG       ARG 869   1.830  -8.803  -4.327
  273   2HG   ARG 869          2HG       ARG 869   1.723  -7.027  -4.264
  274   1HD   ARG 869          1HD       ARG 869   3.922  -7.396  -3.566
  275   2HD   ARG 869          2HD       ARG 869   3.058  -7.298  -2.016
  276    HE   ARG 869           HE       ARG 869   3.433  -9.572  -1.663
  277   1HH1  ARG 869          2HH2      ARG 869   4.316  -8.620  -4.952
  278   2HH1  ARG 869          1HH2      ARG 869   5.132 -10.125  -5.315
  279   1HH2  ARG 869          2HH1      ARG 869   4.510 -11.560  -2.143
  280   2HH2  ARG 869          1HH1      ARG 869   5.242 -11.801  -3.714
  281    H    ARG 870           H        ARG 870  -1.380  -8.347  -3.908
  282    HA   ARG 870           HA       ARG 870  -1.649  -7.223  -6.380
  283   1HB   ARG 870          1HB       ARG 870  -3.201  -9.062  -4.706
  284   2HB   ARG 870          2HB       ARG 870  -4.221  -8.165  -5.856
  285   1HG   ARG 870          1HG       ARG 870  -3.431 -10.177  -6.962
  286   2HG   ARG 870          2HG       ARG 870  -2.583  -8.784  -7.677
  287   1HD   ARG 870          1HD       ARG 870  -0.679  -9.923  -7.230
  288   2HD   ARG 870          2HD       ARG 870  -0.954  -9.457  -5.538
  289    HE   ARG 870           HE       ARG 870  -1.503 -11.648  -5.043
  290   1HH1  ARG 870          2HH2      ARG 870  -1.609 -11.117  -8.537
  291   2HH1  ARG 870          1HH2      ARG 870  -1.838 -12.808  -8.925
  292   1HH2  ARG 870          2HH1      ARG 870  -1.806 -13.881  -5.555
  293   2HH2  ARG 870          1HH1      ARG 870  -1.950 -14.384  -7.225
  294    H    TYR 871           H        TYR 871  -3.944  -6.620  -3.653
  295    HA   TYR 871           HA       TYR 871  -5.612  -4.779  -4.777
  296   1HB   TYR 871          1HB       TYR 871  -5.569  -5.637  -2.397
  297   2HB   TYR 871          2HB       TYR 871  -4.326  -4.422  -2.054
  298    HD1  TYR 871           1HD      TYR 871  -7.481  -4.247  -4.085
  299    HD2  TYR 871           2HD      TYR 871  -5.273  -2.790  -0.700
  300    HE1  TYR 871           1HE      TYR 871  -9.248  -2.560  -3.658
  301    HE2  TYR 871           2HE      TYR 871  -7.040  -1.103  -0.274
  302    HH   TYR 871           HH       TYR 871  -9.791  -1.019  -0.958
  303    H    PHE 872           H        PHE 872  -2.633  -3.784  -2.989
  304    HA   PHE 872           HA       PHE 872  -2.622  -1.114  -3.738
  305   1HB   PHE 872          1HB       PHE 872  -1.086  -2.398  -2.141
  306   2HB   PHE 872          2HB       PHE 872  -0.130  -2.824  -3.571
  307    HD1  PHE 872           1HD      PHE 872   0.585  -0.788  -5.095
  308    HD2  PHE 872           2HD      PHE 872  -0.561  -0.465  -0.969
  309    HE1  PHE 872           1HE      PHE 872   1.798   1.369  -4.928
  310    HE2  PHE 872           2HE      PHE 872   0.651   1.693  -0.801
  311    HZ   PHE 872           HZ       PHE 872   1.830   2.609  -2.781
  312    H    VAL 873           H        VAL 873   0.034  -2.952  -5.147
  313    HA   VAL 873           HA       VAL 873   0.489  -1.607  -7.403
  314    HB   VAL 873           HB       VAL 873   1.836  -3.460  -7.276
  315   1HG1  VAL 873          1HG1      VAL 873  -0.704  -4.914  -6.476
  316   2HG1  VAL 873          2HG1      VAL 873   0.787  -5.798  -6.879
  317   3HG1  VAL 873          3HG1      VAL 873   0.773  -4.651  -5.518
  318   1HG2  VAL 873          1HG2      VAL 873   1.570  -4.650  -9.243
  319   2HG2  VAL 873          2HG2      VAL 873  -0.167  -4.925  -8.966
  320   3HG2  VAL 873          3HG2      VAL 873   0.403  -3.339  -9.539
  321    H    ALA 874           H        ALA 874  -2.333  -3.710  -6.873
  322    HA   ALA 874           HA       ALA 874  -3.310  -3.774  -9.520
  323   1HB   ALA 874          1HB       ALA 874  -4.303  -5.234  -7.944
  324   2HB   ALA 874          2HB       ALA 874  -4.617  -3.915  -6.791
  325   3HB   ALA 874          3HB       ALA 874  -5.567  -4.030  -8.292
  326    H    PHE 875           H        PHE 875  -4.069  -1.497  -6.825
  327    HA   PHE 875           HA       PHE 875  -5.901   0.149  -8.007
  328   1HB   PHE 875          1HB       PHE 875  -3.460   1.065  -6.451
  329   2HB   PHE 875          2HB       PHE 875  -4.976   1.961  -6.648
  330    HD1  PHE 875           1HD      PHE 875  -5.870  -1.402  -6.411
  331    HD2  PHE 875           2HD      PHE 875  -4.441   1.849  -3.995
  332    HE1  PHE 875           1HE      PHE 875  -6.788  -2.503  -4.387
  333    HE2  PHE 875           2HE      PHE 875  -5.359   0.748  -1.971
  334    HZ   PHE 875           HZ       PHE 875  -6.532  -1.428  -2.167
  335    H    ASP 876           H        ASP 876  -2.359   0.158  -8.570
  336    HA   ASP 876           HA       ASP 876  -2.050   0.621 -11.121
  337   1HB   ASP 876          1HB       ASP 876  -3.553   2.957 -10.024
  338   2HB   ASP 876          2HB       ASP 876  -2.270   3.302 -11.203
  339    H    GLY 877           H        GLY 877  -1.037   0.841  -8.065
  340   1HA   GLY 877          1HA       GLY 877   1.203   2.707  -8.496
  341   2HA   GLY 877          2HA       GLY 877   0.799   1.844  -6.994
  342    H    ASP 878           H        ASP 878   2.797   0.907  -6.594
  343    HA   ASP 878           HA       ASP 878   3.422  -1.443  -8.191
  344   1HB   ASP 878          1HB       ASP 878   4.929   1.092  -8.477
  345   2HB   ASP 878          2HB       ASP 878   5.929  -0.344  -8.168
  346    H    LEU 879           H        LEU 879   4.990  -2.818  -7.125
  347    HA   LEU 879           HA       LEU 879   5.555  -2.011  -4.315
  348   1HB   LEU 879          1HB       LEU 879   4.712  -4.796  -5.184
  349   2HB   LEU 879          2HB       LEU 879   4.881  -4.168  -3.527
  350    HG   LEU 879           HG       LEU 879   2.779  -3.476  -5.604
  351   1HD1  LEU 879          1HD1      LEU 879   2.503  -5.404  -3.965
  352   2HD1  LEU 879          2HD1      LEU 879   2.545  -4.198  -2.657
  353   3HD1  LEU 879          3HD1      LEU 879   1.244  -4.149  -3.871
  354   1HD2  LEU 879          1HD2      LEU 879   2.880  -1.334  -4.876
  355   2HD2  LEU 879          2HD2      LEU 879   2.251  -1.946  -3.328
  356   3HD2  LEU 879          3HD2      LEU 879   4.005  -1.756  -3.563
  357    H    VAL 880           H        VAL 880   7.663  -2.153  -3.838
  358    HA   VAL 880           HA       VAL 880   9.365  -3.815  -5.627
  359    HB   VAL 880           HB       VAL 880  10.764  -1.966  -3.853
  360   1HG1  VAL 880          1HG1      VAL 880  12.025  -1.619  -5.761
  361   2HG1  VAL 880          2HG1      VAL 880  11.281  -3.178  -6.191
  362   3HG1  VAL 880          3HG1      VAL 880  10.606  -1.663  -6.835
  363   1HG2  VAL 880          1HG2      VAL 880   9.860   0.003  -5.413
  364   2HG2  VAL 880          2HG2      VAL 880   8.393  -1.005  -5.436
  365   3HG2  VAL 880          3HG2      VAL 880   9.041  -0.411  -3.888
  366    H    GLN 881           H        GLN 881  10.690  -5.385  -4.780
  367    HA   GLN 881           HA       GLN 881   9.979  -6.491  -2.244
  368   1HB   GLN 881          1HB       GLN 881  12.477  -7.027  -3.893
  369   2HB   GLN 881          2HB       GLN 881  11.704  -8.114  -2.715
  370   1HG   GLN 881          1HG       GLN 881  10.152  -8.809  -4.212
  371   2HG   GLN 881          2HG       GLN 881   9.856  -7.158  -4.797
  372   1HE2  GLN 881          1HE2      GLN 881  10.168  -7.060  -6.948
  373   2HE2  GLN 881          2HE2      GLN 881  11.488  -7.810  -7.819
  374    H    GLU 882           H        GLU 882  10.793  -6.180  -0.236
  375    HA   GLU 882           HA       GLU 882  11.982  -4.036   0.749
  376   1HB   GLU 882          1HB       GLU 882  11.444  -6.108   2.037
  377   2HB   GLU 882          2HB       GLU 882  12.965  -6.828   1.455
  378   1HG   GLU 882          1HG       GLU 882  13.963  -4.517   2.377
  379   2HG   GLU 882          2HG       GLU 882  12.523  -4.599   3.415
  380    H    PHE 883           H        PHE 883  14.183  -6.771  -0.075
  381    HA   PHE 883           HA       PHE 883  16.485  -5.094  -0.192
  382   1HB   PHE 883          1HB       PHE 883  17.615  -7.043  -0.996
  383   2HB   PHE 883          2HB       PHE 883  16.430  -7.572   0.210
  384    HD1  PHE 883           1HD      PHE 883  17.223  -7.455  -3.407
  385    HD2  PHE 883           2HD      PHE 883  14.573  -8.978  -0.388
  386    HE1  PHE 883           1HE      PHE 883  16.253  -9.034  -5.055
  387    HE2  PHE 883           2HE      PHE 883  13.604 -10.557  -2.036
  388    HZ   PHE 883           HZ       PHE 883  14.444 -10.586  -4.370
  389    H    ASP 884           H        ASP 884  13.921  -4.669  -2.018
  390    HA   ASP 884           HA       ASP 884  15.534  -3.862  -4.364
  391   1HB   ASP 884          1HB       ASP 884  12.988  -5.521  -4.463
  392   2HB   ASP 884          2HB       ASP 884  13.745  -4.741  -5.869
  393    H    MET 885           H        MET 885  15.315  -1.709  -3.625
  394    HA   MET 885           HA       MET 885  12.651  -0.570  -4.191
  395   1HB   MET 885          1HB       MET 885  13.291   0.917  -2.026
  396   2HB   MET 885          2HB       MET 885  12.281  -0.546  -1.932
  397   1HG   MET 885          1HG       MET 885  14.482  -1.840  -1.640
  398   2HG   MET 885          2HG       MET 885  15.243  -0.265  -1.360
  399   1HE   MET 885          1HE       MET 885  12.429  -2.719   1.177
  400   2HE   MET 885          2HE       MET 885  11.500  -1.465   0.320
  401   3HE   MET 885          3HE       MET 885  12.510  -2.608  -0.598
  402    H    THR 886           H        THR 886  16.135  -0.189  -3.563
  403    HA   THR 886           HA       THR 886  17.039   2.169  -3.815
  404    HB   THR 886           HB       THR 886  18.593   1.596  -5.501
  405    HG1  THR 886           1HG      THR 886  16.768  -0.312  -6.520
  406   1HG2  THR 886          1HG2      THR 886  19.195  -0.667  -4.975
  407   2HG2  THR 886          2HG2      THR 886  18.385  -0.021  -3.528
  408   3HG2  THR 886          3HG2      THR 886  17.505  -1.107  -4.631
  409    H    SER 887           H        SER 887  15.096   0.911  -6.580
  410    HA   SER 887           HA       SER 887  14.771   3.688  -7.543
  411   1HB   SER 887          1HB       SER 887  14.679   0.971  -8.709
  412   2HB   SER 887          2HB       SER 887  13.412   2.073  -9.300
  413    HG   SER 887           HG       SER 887  15.401   3.588  -9.359
  414    H    ALA 888           H        ALA 888  13.213   1.354  -5.585
  415    HA   ALA 888           HA       ALA 888  10.518   1.568  -6.140
  416   1HB   ALA 888          1HB       ALA 888  11.109   0.147  -4.371
  417   2HB   ALA 888          2HB       ALA 888  12.085   1.398  -3.563
  418   3HB   ALA 888          3HB       ALA 888  10.308   1.501  -3.537
  419    H    THR 889           H        THR 889   8.978   2.833  -4.431
  420    HA   THR 889           HA       THR 889   9.858   5.673  -4.387
  421    HB   THR 889           HB       THR 889   8.131   4.704  -6.283
  422    HG1  THR 889           1HG      THR 889   8.075   6.762  -6.717
  423   1HG2  THR 889          1HG2      THR 889   6.552   4.175  -4.317
  424   2HG2  THR 889          2HG2      THR 889   6.374   5.937  -4.133
  425   3HG2  THR 889          3HG2      THR 889   5.873   5.144  -5.647
  426    H    HIS 890           H        HIS 890   7.573   3.154  -3.257
  427    HA   HIS 890           HA       HIS 890   7.381   4.668  -0.696
  428   1HB   HIS 890          1HB       HIS 890   5.269   3.368  -2.394
  429   2HB   HIS 890          2HB       HIS 890   5.071   3.395  -0.632
  430    HD1  HIS 890           1HD      HIS 890   5.202   5.791  -3.631
  431    HD2  HIS 890           2HD      HIS 890   4.512   5.742   0.521
  432    HE1  HIS 890           1HE      HIS 890   4.243   8.081  -3.017
  433    H    VAL 891           H        VAL 891   6.954   3.290   1.198
  434    HA   VAL 891           HA       VAL 891   7.533   0.426   0.856
  435    HB   VAL 891           HB       VAL 891   9.346   0.642   2.650
  436   1HG1  VAL 891          1HG1      VAL 891  10.762   0.386   0.910
  437   2HG1  VAL 891          2HG1      VAL 891   9.414   0.830  -0.164
  438   3HG1  VAL 891          3HG1      VAL 891  10.542   2.080   0.413
  439   1HG2  VAL 891          1HG2      VAL 891  10.480   2.860   2.722
  440   2HG2  VAL 891          2HG2      VAL 891   9.175   3.541   1.721
  441   3HG2  VAL 891          3HG2      VAL 891   8.819   2.939   3.358
  442    H    LEU 892           H        LEU 892   6.600  -0.807   2.448
  443    HA   LEU 892           HA       LEU 892   4.864   0.647   4.327
  444   1HB   LEU 892          1HB       LEU 892   4.543  -1.627   2.787
  445   2HB   LEU 892          2HB       LEU 892   4.877  -2.299   4.401
  446    HG   LEU 892           HG       LEU 892   3.142  -0.178   4.926
  447   1HD1  LEU 892          1HD1      LEU 892   1.763   0.171   3.175
  448   2HD1  LEU 892          2HD1      LEU 892   2.885  -0.785   2.177
  449   3HD1  LEU 892          3HD1      LEU 892   1.503  -1.579   2.970
  450   1HD2  LEU 892          1HD2      LEU 892   2.802  -2.137   6.136
  451   2HD2  LEU 892          2HD2      LEU 892   1.440  -2.220   4.992
  452   3HD2  LEU 892          3HD2      LEU 892   2.915  -3.172   4.692
  453    H    GLY 893           H        GLY 893   5.458   1.047   6.371
  454   1HA   GLY 893          1HA       GLY 893   6.674   0.976   8.321
  455   2HA   GLY 893          2HA       GLY 893   6.548  -0.790   8.159
  456    H    SER 894           H        SER 894   8.680   1.822   8.319
  457    HA   SER 894           HA       SER 894  10.994   1.759   8.346
  458   1HB   SER 894          1HB       SER 894  10.597  -0.998   7.122
  459   2HB   SER 894          2HB       SER 894  12.182  -0.296   7.528
  460    HG   SER 894           HG       SER 894  11.565  -1.443   9.290
  461    H    ARG 895           H        ARG 895  12.788   1.968   6.721
  462    HA   ARG 895           HA       ARG 895  11.815   2.219   3.936
  463   1HB   ARG 895          1HB       ARG 895  12.937   4.491   3.846
  464   2HB   ARG 895          2HB       ARG 895  11.444   4.428   4.812
  465   1HG   ARG 895          1HG       ARG 895  12.670   4.368   6.873
  466   2HG   ARG 895          2HG       ARG 895  14.207   4.060   6.028
  467   1HD   ARG 895          1HD       ARG 895  14.541   6.260   5.653
  468   2HD   ARG 895          2HD       ARG 895  12.889   6.475   5.037
  469    HE   ARG 895           HE       ARG 895  12.193   7.176   7.148
  470   1HH1  ARG 895          2HH2      ARG 895  15.467   5.845   7.255
  471   2HH1  ARG 895          1HH2      ARG 895  15.788   6.403   8.882
  472   1HH2  ARG 895          2HH1      ARG 895  12.617   7.914   9.297
  473   2HH2  ARG 895          1HH1      ARG 895  14.163   7.583  10.045
  474    H    ASP 896           H        ASP 896  14.426   2.052   6.329
  475    HA   ASP 896           HA       ASP 896  16.786   2.225   5.348
  476   1HB   ASP 896          1HB       ASP 896  16.708   0.753   7.145
  477   2HB   ASP 896          2HB       ASP 896  15.503  -0.297   6.369
  478    H    LYS 897           H        LYS 897  15.313  -0.857   4.244
  479    HA   LYS 897           HA       LYS 897  16.809  -1.468   2.117
  480   1HB   LYS 897          1HB       LYS 897  14.189  -1.687   1.076
  481   2HB   LYS 897          2HB       LYS 897  15.116  -2.933   1.945
  482   1HG   LYS 897          1HG       LYS 897  13.165  -2.732   3.248
  483   2HG   LYS 897          2HG       LYS 897  14.318  -1.677   4.099
  484   1HD   LYS 897          1HD       LYS 897  13.392   0.224   2.604
  485   2HD   LYS 897          2HD       LYS 897  12.053  -0.892   2.240
  486   1HE   LYS 897          1HE       LYS 897  12.124  -1.146   4.933
  487   2HE   LYS 897          2HE       LYS 897  12.740   0.514   4.785
  488   1HZ   LYS 897          1HZ       LYS 897  10.317  -0.364   3.407
  489   2HZ   LYS 897          2HZ       LYS 897  10.280   0.205   4.955
  490   3HZ   LYS 897          3HZ       LYS 897  10.816   1.174   3.732
  491    H    ASN 898           H        ASN 898  14.573   1.285   2.266
  492    HA   ASN 898           HA       ASN 898  15.936   2.515   0.009
  493   1HB   ASN 898          1HB       ASN 898  13.652   0.920  -0.503
  494   2HB   ASN 898          2HB       ASN 898  13.109   2.609  -0.594
  495   1HD2  ASN 898          1HD2      ASN 898  12.942   2.964  -2.769
  496   2HD2  ASN 898          2HD2      ASN 898  14.258   2.765  -3.906
  497    HA   PRO 899           HA       PRO 899  14.560   5.535   3.102
  498   1HB   PRO 899          1HB       PRO 899  16.638   7.262   2.749
  499   2HB   PRO 899          2HB       PRO 899  16.835   5.714   3.634
  500   1HG   PRO 899          1HG       PRO 899  17.445   6.251   0.713
  501   2HG   PRO 899          2HG       PRO 899  18.534   5.516   1.934
  502   1HD   PRO 899          1HD       PRO 899  17.047   3.978   0.245
  503   2HD   PRO 899          2HD       PRO 899  17.254   3.503   1.958
  504    H    ALA 900           H        ALA 900  14.996   5.508  -0.314
  505    HA   ALA 900           HA       ALA 900  14.085   8.275  -0.689
  506   1HB   ALA 900          1HB       ALA 900  14.225   7.621  -3.120
  507   2HB   ALA 900          2HB       ALA 900  15.755   7.443  -2.227
  508   3HB   ALA 900          3HB       ALA 900  14.769   6.008  -2.598
  509    H    ALA 901           H        ALA 901  12.638   5.433   0.204
  510    HA   ALA 901           HA       ALA 901  10.231   5.821  -1.473
  511   1HB   ALA 901          1HB       ALA 901   9.506   3.685  -0.478
  512   2HB   ALA 901          2HB       ALA 901  11.127   3.535  -1.199
  513   3HB   ALA 901          3HB       ALA 901  10.948   3.677   0.566
  514    H    GLN 902           H        GLN 902   8.380   4.780   0.460
  515    HA   GLN 902           HA       GLN 902   8.369   6.978   2.473
  516   1HB   GLN 902          1HB       GLN 902   6.320   6.138   0.459
  517   2HB   GLN 902          2HB       GLN 902   5.740   6.616   2.073
  518   1HG   GLN 902          1HG       GLN 902   7.511   8.254   0.213
  519   2HG   GLN 902          2HG       GLN 902   5.812   8.580   0.620
  520   1HE2  GLN 902          1HE2      GLN 902   5.914   7.958   3.409
  521   2HE2  GLN 902          2HE2      GLN 902   6.871   9.189   4.204
  522    H    GLN 903           H        GLN 903   7.949   6.363   4.535
  523    HA   GLN 903           HA       GLN 903   7.589   3.480   5.010
  524   1HB   GLN 903          1HB       GLN 903   8.089   5.798   6.918
  525   2HB   GLN 903          2HB       GLN 903   8.119   4.070   7.341
  526   1HG   GLN 903          1HG       GLN 903  10.314   4.106   6.813
  527   2HG   GLN 903          2HG       GLN 903   9.801   4.244   5.117
  528   1HE2  GLN 903          1HE2      GLN 903  10.248   6.091   3.992
  529   2HE2  GLN 903          2HE2      GLN 903  10.946   7.534   4.695
  530    H    VAL 904           H        VAL 904   5.329   3.829   3.979
  531    HA   VAL 904           HA       VAL 904   3.375   5.098   5.746
  532    HB   VAL 904           HB       VAL 904   2.044   5.049   3.918
  533   1HG1  VAL 904          1HG1      VAL 904   3.226   5.151   1.897
  534   2HG1  VAL 904          2HG1      VAL 904   4.521   5.405   3.091
  535   3HG1  VAL 904          3HG1      VAL 904   4.302   3.805   2.342
  536   1HG2  VAL 904          1HG2      VAL 904   1.318   2.801   4.128
  537   2HG2  VAL 904          2HG2      VAL 904   1.936   2.904   2.462
  538   3HG2  VAL 904          3HG2      VAL 904   2.929   2.154   3.735
  539    H    SER 905           H        SER 905   1.284   3.665   6.112
  540    HA   SER 905           HA       SER 905   2.151   0.981   7.064
  541   1HB   SER 905          1HB       SER 905   1.439   1.377   9.195
  542   2HB   SER 905          2HB       SER 905   1.782   3.070   8.763
  543    HG   SER 905           HG       SER 905  -0.373   3.341   8.245
  544    HA   PRO 906           HA       PRO 906  -1.725  -0.586   5.657
  545   1HB   PRO 906          1HB       PRO 906  -3.099  -1.631   7.764
  546   2HB   PRO 906          2HB       PRO 906  -1.510  -2.287   7.253
  547   1HG   PRO 906          1HG       PRO 906  -2.043  -0.258   9.442
  548   2HG   PRO 906          2HG       PRO 906  -1.097  -1.776   9.573
  549   1HD   PRO 906          1HD       PRO 906   0.116   0.620   9.110
  550   2HD   PRO 906          2HD       PRO 906   0.679  -0.858   8.272
  551    H    GLU 907           H        GLU 907  -1.986   1.709   8.350
  552    HA   GLU 907           HA       GLU 907  -4.784   2.268   8.005
  553   1HB   GLU 907          1HB       GLU 907  -2.495   3.796   9.296
  554   2HB   GLU 907          2HB       GLU 907  -4.195   4.318   9.362
  555   1HG   GLU 907          1HG       GLU 907  -4.627   2.861  11.020
  556   2HG   GLU 907          2HG       GLU 907  -4.010   1.512  10.041
  557    H    TRP 908           H        TRP 908  -1.785   3.444   6.532
  558    HA   TRP 908           HA       TRP 908  -2.909   5.798   5.349
  559   1HB   TRP 908          1HB       TRP 908  -0.521   5.522   5.639
  560   2HB   TRP 908          2HB       TRP 908  -0.525   4.066   4.635
  561    HD1  TRP 908           HD       TRP 908  -0.791   7.870   4.402
  562    HE1  TRP 908           1HE      TRP 908  -0.270   8.634   2.029
  563    HE3  TRP 908           3HE      TRP 908  -0.509   3.295   2.125
  564    HZ2  TRP 908           2HZ      TRP 908   0.212   7.416  -0.552
  565    HZ3  TRP 908           3HZ      TRP 908  -0.018   3.137  -0.288
  566    HH2  TRP 908           HH       TRP 908   0.344   5.183  -1.638
  567    H    ILE 909           H        ILE 909  -2.422   2.430   4.204
  568    HA   ILE 909           HA       ILE 909  -3.301   2.794   1.556
  569    HB   ILE 909           HB       ILE 909  -3.088   0.523   3.488
  570   1HG1  ILE 909          1HG1      ILE 909  -2.289   0.054   0.738
  571   2HG1  ILE 909          2HG1      ILE 909  -1.648   1.617   1.300
  572   1HG2  ILE 909          1HG2      ILE 909  -5.103  -0.273   2.687
  573   2HG2  ILE 909          2HG2      ILE 909  -4.994   0.662   1.177
  574   3HG2  ILE 909          3HG2      ILE 909  -4.044  -0.831   1.369
  575   1HD1  ILE 909          1HD1      ILE 909  -1.165   0.076   3.498
  576   2HD1  ILE 909          2HD1      ILE 909  -1.016  -1.148   2.214
  577   3HD1  ILE 909          3HD1      ILE 909   0.011   0.306   2.181
  578    H    TRP 910           H        TRP 910  -5.181   1.779   4.468
  579    HA   TRP 910           HA       TRP 910  -7.690   1.670   3.176
  580   1HB   TRP 910          1HB       TRP 910  -7.223   2.508   6.043
  581   2HB   TRP 910          2HB       TRP 910  -8.617   1.654   5.367
  582    HD1  TRP 910           HD       TRP 910  -5.951   0.961   7.552
  583    HE1  TRP 910           1HE      TRP 910  -5.199  -1.473   7.555
  584    HE3  TRP 910           3HE      TRP 910  -8.104  -0.556   3.162
  585    HZ2  TRP 910           2HZ      TRP 910  -5.490  -3.803   5.863
  586    HZ3  TRP 910           3HZ      TRP 910  -7.844  -2.885   2.392
  587    HH2  TRP 910           HH       TRP 910  -6.544  -4.518   3.727
  588    H    ALA 911           H        ALA 911  -6.316   4.308   5.228
  589    HA   ALA 911           HA       ALA 911  -8.373   6.168   4.747
  590   1HB   ALA 911          1HB       ALA 911  -6.564   7.858   5.340
  591   2HB   ALA 911          2HB       ALA 911  -6.804   6.546   6.519
  592   3HB   ALA 911          3HB       ALA 911  -5.423   6.492   5.397
  593    H    CYS 912           H        CYS 912  -5.539   5.246   2.830
  594    HA   CYS 912           HA       CYS 912  -5.678   7.479   1.017
  595   1HB   CYS 912          1HB       CYS 912  -4.388   4.729   0.885
  596   2HB   CYS 912          2HB       CYS 912  -4.220   5.951  -0.400
  597    HG   CYS 912           HG       CYS 912  -3.914   7.170   2.526
  598    H    ILE 913           H        ILE 913  -6.150   4.016   0.170
  599    HA   ILE 913           HA       ILE 913  -7.581   4.355  -2.144
  600    HB   ILE 913           HB       ILE 913  -6.888   2.166  -1.420
  601   1HG1  ILE 913          1HG1      ILE 913  -9.932   2.333  -1.354
  602   2HG1  ILE 913          2HG1      ILE 913  -8.935   2.287  -2.828
  603   1HG2  ILE 913          1HG2      ILE 913  -8.843   1.570   0.608
  604   2HG2  ILE 913          2HG2      ILE 913  -7.068   1.550   0.739
  605   3HG2  ILE 913          3HG2      ILE 913  -7.969   3.047   1.080
  606   1HD1  ILE 913          1HD1      ILE 913  -9.951   0.070  -1.475
  607   2HD1  ILE 913          2HD1      ILE 913  -8.633   0.047  -2.671
  608   3HD1  ILE 913          3HD1      ILE 913  -8.257   0.143  -0.934
  609    H    ARG 914           H        ARG 914  -8.856   4.408   1.207
  610    HA   ARG 914           HA       ARG 914 -11.599   4.683   0.442
  611   1HB   ARG 914          1HB       ARG 914 -10.733   3.940   2.688
  612   2HB   ARG 914          2HB       ARG 914 -10.242   5.623   2.996
  613   1HG   ARG 914          1HG       ARG 914 -12.921   5.726   2.048
  614   2HG   ARG 914          2HG       ARG 914 -12.863   4.418   3.254
  615   1HD   ARG 914          1HD       ARG 914 -11.410   6.939   3.932
  616   2HD   ARG 914          2HD       ARG 914 -13.184   7.024   3.919
  617    HE   ARG 914           HE       ARG 914 -12.083   4.745   5.388
  618   1HH1  ARG 914          2HH2      ARG 914 -13.133   8.119   5.490
  619   2HH1  ARG 914          1HH2      ARG 914 -13.441   8.114   7.212
  620   1HH2  ARG 914          2HH1      ARG 914 -12.489   4.738   7.662
  621   2HH2  ARG 914          1HH1      ARG 914 -13.074   6.187   8.450
  622    H    LYS 915           H        LYS 915  -8.888   6.906   0.699
  623    HA   LYS 915           HA       LYS 915 -10.660   9.255   0.605
  624   1HB   LYS 915          1HB       LYS 915  -7.678   8.802   0.854
  625   2HB   LYS 915          2HB       LYS 915  -8.341  10.412   0.484
  626   1HG   LYS 915          1HG       LYS 915  -9.333   8.739   2.820
  627   2HG   LYS 915          2HG       LYS 915  -7.970   9.875   2.971
  628   1HD   LYS 915          1HD       LYS 915  -9.338  11.751   2.428
  629   2HD   LYS 915          2HD       LYS 915 -10.651  10.716   1.818
  630   1HE   LYS 915          1HE       LYS 915 -10.466   9.751   4.338
  631   2HE   LYS 915          2HE       LYS 915  -9.906  11.413   4.627
  632   1HZ   LYS 915          1HZ       LYS 915 -11.929  12.174   4.331
  633   2HZ   LYS 915          2HZ       LYS 915 -12.203  11.278   2.974
  634   3HZ   LYS 915          3HZ       LYS 915 -12.461  10.619   4.463
  635    H    ARG 916           H        ARG 916  -9.247   7.025  -1.546
  636    HA   ARG 916           HA       ARG 916  -9.127   6.973  -3.831
  637   1HB   ARG 916          1HB       ARG 916 -10.942   9.330  -3.357
  638   2HB   ARG 916          2HB       ARG 916 -10.344   9.001  -5.000
  639   1HG   ARG 916          1HG       ARG 916 -12.448   7.830  -4.733
  640   2HG   ARG 916          2HG       ARG 916 -11.147   6.615  -4.724
  641   1HD   ARG 916          1HD       ARG 916 -12.747   6.157  -2.918
  642   2HD   ARG 916          2HD       ARG 916 -11.172   6.628  -2.242
  643    HE   ARG 916           HE       ARG 916 -12.388   9.009  -2.258
  644   1HH1  ARG 916          2HH2      ARG 916 -13.616   5.819  -1.352
  645   2HH1  ARG 916          1HH2      ARG 916 -14.749   6.439  -0.172
  646   1HH2  ARG 916          2HH1      ARG 916 -13.885   9.828  -0.699
  647   2HH2  ARG 916          1HH1      ARG 916 -14.902   8.725   0.200
  648    H    ARG 917           H        ARG 917  -7.583   9.110  -1.873
  649    HA   ARG 917           HA       ARG 917  -5.733   9.875  -4.033
  650   1HB   ARG 917          1HB       ARG 917  -5.849  12.205  -2.547
  651   2HB   ARG 917          2HB       ARG 917  -6.618  11.954  -4.133
  652   1HG   ARG 917          1HG       ARG 917  -8.090  10.992  -1.702
  653   2HG   ARG 917          2HG       ARG 917  -8.028  12.747  -1.991
  654   1HD   ARG 917          1HD       ARG 917  -8.700  12.127  -4.438
  655   2HD   ARG 917          2HD       ARG 917  -9.192  10.569  -3.740
  656    HE   ARG 917           HE       ARG 917 -10.368  12.497  -2.115
  657   1HH1  ARG 917          2HH2      ARG 917 -10.396  11.639  -5.545
  658   2HH1  ARG 917          1HH2      ARG 917 -12.031  12.202  -5.813
  659   1HH2  ARG 917          2HH1      ARG 917 -12.527  13.240  -2.469
  660   2HH2  ARG 917          1HH1      ARG 917 -13.245  13.114  -4.059
  661    H    LEU 918           H        LEU 918  -3.784   9.227  -3.355
  662    HA   LEU 918           HA       LEU 918  -3.059   8.169  -0.969
  663   1HB   LEU 918          1HB       LEU 918  -1.531   9.865  -2.946
  664   2HB   LEU 918          2HB       LEU 918  -0.732   9.257  -1.476
  665    HG   LEU 918           HG       LEU 918  -0.404   7.313  -2.579
  666   1HD1  LEU 918          1HD1      LEU 918  -2.477   5.875  -2.941
  667   2HD1  LEU 918          2HD1      LEU 918  -2.281   6.522  -1.294
  668   3HD1  LEU 918          3HD1      LEU 918  -3.442   7.275  -2.414
  669   1HD2  LEU 918          1HD2      LEU 918  -0.630   8.426  -4.724
  670   2HD2  LEU 918          2HD2      LEU 918  -1.507   6.880  -4.811
  671   3HD2  LEU 918          3HD2      LEU 918  -2.406   8.402  -4.600
  672    H    VAL 919           H        VAL 919  -3.052   8.801   1.101
  673    HA   VAL 919           HA       VAL 919  -3.239  11.700   1.671
  674    HB   VAL 919           HB       VAL 919  -4.380  11.115   3.580
  675   1HG1  VAL 919          1HG1      VAL 919  -5.998  10.033   2.434
  676   2HG1  VAL 919          2HG1      VAL 919  -4.804   9.267   1.359
  677   3HG1  VAL 919          3HG1      VAL 919  -5.214   8.510   2.917
  678   1HG2  VAL 919          1HG2      VAL 919  -2.188   9.309   3.863
  679   2HG2  VAL 919          2HG2      VAL 919  -3.386   9.775   5.095
  680   3HG2  VAL 919          3HG2      VAL 919  -3.679   8.356   4.061
  681    H    ALA 920           H        ALA 920  -2.272  11.631   4.321
  682    HA   ALA 920           HA       ALA 920   0.543  11.914   3.830
  683   1HB   ALA 920          1HB       ALA 920  -0.793  11.731   6.544
  684   2HB   ALA 920          2HB       ALA 920   0.654  12.659   6.079
  685   3HB   ALA 920          3HB       ALA 920  -0.953  13.171   5.510
  686    HA   PRO 921           HA       PRO 921   1.357   7.548   4.443
  687   1HB   PRO 921          1HB       PRO 921   3.942   7.602   3.584
  688   2HB   PRO 921          2HB       PRO 921   2.564   7.777   2.448
  689   1HG   PRO 921          1HG       PRO 921   4.190   9.997   3.723
  690   2HG   PRO 921          2HG       PRO 921   3.831   9.774   1.979
  691   1HD   PRO 921          1HD       PRO 921   2.324  11.423   3.541
  692   2HD   PRO 921          2HD       PRO 921   1.550  10.389   2.302
  693    H    CYS 922           H        CYS 922   1.927   6.622   6.339
  694    HA   CYS 922           HA       CYS 922   3.277   6.200   8.197
  695   1HB   CYS 922          1HB       CYS 922   5.059   7.620   6.941
  696   2HB   CYS 922          2HB       CYS 922   4.490   8.963   7.963
  697    HG   CYS 922           HG       CYS 922   5.272   8.235  10.110
  Start of MODEL    3
    1    H    GLY 835           H        GLY 835 -11.215  -2.974  11.945
    2   1HA   GLY 835          1HA       GLY 835  -8.566  -4.043  11.311
    3   2HA   GLY 835          2HA       GLY 835  -9.928  -4.919  10.577
    4    H    SER 836           H        SER 836 -11.724  -3.062   9.854
    5    HA   SER 836           HA       SER 836 -12.060  -1.060   8.647
    6   1HB   SER 836          1HB       SER 836  -9.129  -1.064   7.889
    7   2HB   SER 836          2HB       SER 836 -10.278   0.296   7.899
    8    HG   SER 836           HG       SER 836 -10.100   0.459  10.022
    9    H    ALA 837           H        ALA 837  -9.512  -3.250   7.326
   10    HA   ALA 837           HA       ALA 837 -10.127  -3.113   4.641
   11   1HB   ALA 837          1HB       ALA 837  -8.897  -5.062   4.423
   12   2HB   ALA 837          2HB       ALA 837  -8.390  -4.547   6.050
   13   3HB   ALA 837          3HB       ALA 837  -9.627  -5.812   5.862
   14    H    ASP 838           H        ASP 838 -11.514  -5.520   6.954
   15    HA   ASP 838           HA       ASP 838 -13.373  -6.664   5.220
   16   1HB   ASP 838          1HB       ASP 838 -14.440  -7.497   7.165
   17   2HB   ASP 838          2HB       ASP 838 -12.732  -7.311   7.618
   18    H    GLU 839           H        GLU 839 -13.297  -3.463   6.571
   19    HA   GLU 839           HA       GLU 839 -16.158  -3.056   5.881
   20   1HB   GLU 839          1HB       GLU 839 -14.232  -1.841   7.799
   21   2HB   GLU 839          2HB       GLU 839 -15.372  -0.721   7.015
   22   1HG   GLU 839          1HG       GLU 839 -16.794  -3.107   7.765
   23   2HG   GLU 839          2HG       GLU 839 -15.871  -2.534   9.172
   24    H    THR 840           H        THR 840 -13.018  -2.720   4.632
   25    HA   THR 840           HA       THR 840 -13.938  -0.542   2.815
   26    HB   THR 840           HB       THR 840 -11.108  -1.292   3.649
   27    HG1  THR 840           1HG      THR 840 -12.336  -0.228   5.259
   28   1HG2  THR 840          1HG2      THR 840 -11.487  -0.362   1.296
   29   2HG2  THR 840          2HG2      THR 840 -12.085   1.122   2.077
   30   3HG2  THR 840          3HG2      THR 840 -10.405   0.593   2.338
   31    H    LEU 841           H        LEU 841 -11.273  -2.956   2.719
   32    HA   LEU 841           HA       LEU 841 -11.589  -3.437  -0.068
   33   1HB   LEU 841          1HB       LEU 841  -9.491  -3.843   1.136
   34   2HB   LEU 841          2HB       LEU 841 -10.276  -5.111   2.108
   35    HG   LEU 841           HG       LEU 841  -8.920  -5.573  -0.237
   36   1HD1  LEU 841          1HD1      LEU 841  -9.368  -7.496   0.931
   37   2HD1  LEU 841          2HD1      LEU 841 -11.012  -6.972   1.365
   38   3HD1  LEU 841          3HD1      LEU 841 -10.690  -7.638  -0.253
   39   1HD2  LEU 841          1HD2      LEU 841 -10.204  -5.204  -2.051
   40   2HD2  LEU 841          2HD2      LEU 841 -11.528  -6.162  -1.344
   41   3HD2  LEU 841          3HD2      LEU 841 -11.408  -4.419  -1.001
   42    H    CYS 842           H        CYS 842 -13.665  -4.184   2.416
   43    HA   CYS 842           HA       CYS 842 -14.396  -6.866   1.987
   44   1HB   CYS 842          1HB       CYS 842 -15.419  -5.932   3.842
   45   2HB   CYS 842          2HB       CYS 842 -15.756  -4.391   3.014
   46    HG   CYS 842           HG       CYS 842 -17.987  -5.671   3.627
   47    H    GLN 843           H        GLN 843 -14.582  -4.163  -0.122
   48    HA   GLN 843           HA       GLN 843 -16.838  -5.264  -1.661
   49   1HB   GLN 843          1HB       GLN 843 -15.117  -2.939  -2.511
   50   2HB   GLN 843          2HB       GLN 843 -16.852  -3.221  -2.790
   51   1HG   GLN 843          1HG       GLN 843 -16.316  -3.167   0.054
   52   2HG   GLN 843          2HG       GLN 843 -15.647  -1.707  -0.707
   53   1HE2  GLN 843          1HE2      GLN 843 -18.111  -2.316   1.061
   54   2HE2  GLN 843          2HE2      GLN 843 -19.433  -1.547   0.208
   55    H    THR 844           H        THR 844 -15.144  -7.253  -1.704
   56    HA   THR 844           HA       THR 844 -13.975  -8.626  -3.114
   57    HB   THR 844           HB       THR 844 -15.505  -6.959  -4.797
   58    HG1  THR 844           1HG      THR 844 -15.661  -9.073  -5.093
   59   1HG2  THR 844          1HG2      THR 844 -13.774  -7.046  -6.790
   60   2HG2  THR 844          2HG2      THR 844 -13.745  -5.678  -5.651
   61   3HG2  THR 844          3HG2      THR 844 -12.566  -7.002  -5.483
   62    H    LYS 845           H        LYS 845 -13.084  -5.343  -4.321
   63    HA   LYS 845           HA       LYS 845 -10.416  -5.626  -3.133
   64   1HB   LYS 845          1HB       LYS 845 -11.012  -5.985  -6.035
   65   2HB   LYS 845          2HB       LYS 845  -9.615  -4.960  -5.625
   66   1HG   LYS 845          1HG       LYS 845 -10.094  -7.767  -4.536
   67   2HG   LYS 845          2HG       LYS 845  -8.997  -7.372  -5.881
   68   1HD   LYS 845          1HD       LYS 845  -7.420  -7.139  -4.257
   69   2HD   LYS 845          2HD       LYS 845  -8.202  -5.570  -3.947
   70   1HE   LYS 845          1HE       LYS 845  -8.298  -6.479  -1.822
   71   2HE   LYS 845          2HE       LYS 845  -9.840  -7.072  -2.476
   72   1HZ   LYS 845          1HZ       LYS 845  -8.295  -9.008  -3.219
   73   2HZ   LYS 845          2HZ       LYS 845  -7.399  -8.512  -1.927
   74   3HZ   LYS 845          3HZ       LYS 845  -8.969  -8.969  -1.715
   75    H    VAL 846           H        VAL 846 -13.080  -3.858  -4.369
   76    HA   VAL 846           HA       VAL 846 -13.412  -1.596  -4.770
   77    HB   VAL 846           HB       VAL 846 -13.612  -0.681  -2.714
   78   1HG1  VAL 846          1HG1      VAL 846 -12.095  -2.807  -1.308
   79   2HG1  VAL 846          2HG1      VAL 846 -13.798  -2.316  -1.137
   80   3HG1  VAL 846          3HG1      VAL 846 -13.314  -3.403  -2.461
   81   1HG2  VAL 846          1HG2      VAL 846 -11.798   0.090  -1.460
   82   2HG2  VAL 846          2HG2      VAL 846 -10.787  -1.318  -1.867
   83   3HG2  VAL 846          3HG2      VAL 846 -11.071  -0.046  -3.079
   84    H    LEU 847           H        LEU 847 -10.087  -1.860  -3.375
   85    HA   LEU 847           HA       LEU 847  -8.103  -0.950  -4.061
   86   1HB   LEU 847          1HB       LEU 847  -9.333  -0.586  -6.806
   87   2HB   LEU 847          2HB       LEU 847  -7.635  -0.911  -6.382
   88    HG   LEU 847           HG       LEU 847  -8.635  -2.972  -7.209
   89   1HD1  LEU 847          1HD1      LEU 847  -8.799  -3.710  -4.374
   90   2HD1  LEU 847          2HD1      LEU 847  -7.608  -4.194  -5.605
   91   3HD1  LEU 847          3HD1      LEU 847  -7.399  -2.665  -4.716
   92   1HD2  LEU 847          1HD2      LEU 847 -10.608  -3.100  -4.960
   93   2HD2  LEU 847          2HD2      LEU 847 -10.997  -2.016  -6.316
   94   3HD2  LEU 847          3HD2      LEU 847 -10.721  -3.749  -6.613
   95    H    LEU 848           H        LEU 848 -10.159   0.863  -6.366
   96    HA   LEU 848           HA       LEU 848 -10.698   3.089  -6.477
   97   1HB   LEU 848          1HB       LEU 848 -10.197   2.694  -3.560
   98   2HB   LEU 848          2HB       LEU 848 -10.164   4.369  -4.162
   99    HG   LEU 848           HG       LEU 848 -12.408   2.423  -4.818
  100   1HD1  LEU 848          1HD1      LEU 848 -13.337   4.374  -3.009
  101   2HD1  LEU 848          2HD1      LEU 848 -13.097   2.642  -2.678
  102   3HD1  LEU 848          3HD1      LEU 848 -11.798   3.805  -2.321
  103   1HD2  LEU 848          1HD2      LEU 848 -13.254   4.139  -6.021
  104   2HD2  LEU 848          2HD2      LEU 848 -12.978   5.291  -4.692
  105   3HD2  LEU 848          3HD2      LEU 848 -11.669   4.929  -5.843
  106    H    ASP 849           H        ASP 849  -9.635   5.316  -6.381
  107    HA   ASP 849           HA       ASP 849  -6.858   4.990  -7.232
  108   1HB   ASP 849          1HB       ASP 849  -8.677   7.422  -7.060
  109   2HB   ASP 849          2HB       ASP 849  -7.068   7.392  -7.813
  110    H    ILE 850           H        ILE 850  -6.598   4.214  -4.778
  111    HA   ILE 850           HA       ILE 850  -6.252   6.455  -2.925
  112    HB   ILE 850           HB       ILE 850  -5.099   3.860  -2.171
  113   1HG1  ILE 850          1HG1      ILE 850  -6.931   3.231  -3.851
  114   2HG1  ILE 850          2HG1      ILE 850  -7.113   2.562  -2.211
  115   1HG2  ILE 850          1HG2      ILE 850  -6.172   6.069  -0.932
  116   2HG2  ILE 850          2HG2      ILE 850  -7.532   4.923  -0.849
  117   3HG2  ILE 850          3HG2      ILE 850  -5.954   4.484  -0.152
  118   1HD1  ILE 850          1HD1      ILE 850  -9.234   3.416  -2.424
  119   2HD1  ILE 850          2HD1      ILE 850  -8.432   4.914  -1.894
  120   3HD1  ILE 850          3HD1      ILE 850  -8.736   4.632  -3.625
  121    H    PHE 851           H        PHE 851  -3.906   3.832  -3.084
  122    HA   PHE 851           HA       PHE 851  -1.683   5.562  -2.890
  123   1HB   PHE 851          1HB       PHE 851  -1.517   2.835  -4.155
  124   2HB   PHE 851          2HB       PHE 851  -0.387   3.627  -3.043
  125    HD1  PHE 851           1HD      PHE 851  -2.691   1.049  -3.290
  126    HD2  PHE 851           2HD      PHE 851  -1.602   4.280  -0.677
  127    HE1  PHE 851           1HE      PHE 851  -3.740  -0.140  -1.383
  128    HE2  PHE 851           2HE      PHE 851  -2.651   3.091   1.230
  129    HZ   PHE 851           HZ       PHE 851  -3.720   0.881   0.877
  130    H    THR 852           H        THR 852  -3.529   6.305  -5.087
  131    HA   THR 852           HA       THR 852  -2.754   5.685  -7.640
  132    HB   THR 852           HB       THR 852  -4.318   7.604  -6.499
  133    HG1  THR 852           1HG      THR 852  -4.967   7.546  -8.478
  134   1HG2  THR 852          1HG2      THR 852  -3.440   9.799  -7.297
  135   2HG2  THR 852          2HG2      THR 852  -2.411   9.083  -6.033
  136   3HG2  THR 852          3HG2      THR 852  -1.910   9.003  -7.739
  137    H    GLY 853           H        GLY 853  -0.684   5.257  -8.232
  138   1HA   GLY 853          1HA       GLY 853   1.454   5.776  -8.925
  139   2HA   GLY 853          2HA       GLY 853   1.152   7.473  -8.488
  140    H    VAL 854           H        VAL 854   0.347   5.410  -5.916
  141    HA   VAL 854           HA       VAL 854   2.747   6.260  -4.450
  142    HB   VAL 854           HB       VAL 854   0.081   5.031  -3.729
  143   1HG1  VAL 854          1HG1      VAL 854   0.787   4.552  -1.539
  144   2HG1  VAL 854          2HG1      VAL 854   2.159   3.980  -2.518
  145   3HG1  VAL 854          3HG1      VAL 854   2.251   5.552  -1.689
  146   1HG2  VAL 854          1HG2      VAL 854   0.001   7.399  -3.853
  147   2HG2  VAL 854          2HG2      VAL 854   0.239   7.062  -2.122
  148   3HG2  VAL 854          3HG2      VAL 854   1.616   7.577  -3.126
  149    H    ARG 855           H        ARG 855   4.511   5.028  -4.873
  150    HA   ARG 855           HA       ARG 855   4.173   2.108  -5.155
  151   1HB   ARG 855          1HB       ARG 855   6.270   2.116  -6.181
  152   2HB   ARG 855          2HB       ARG 855   5.623   3.704  -6.657
  153   1HG   ARG 855          1HG       ARG 855   6.760   4.580  -4.485
  154   2HG   ARG 855          2HG       ARG 855   7.676   3.054  -4.525
  155   1HD   ARG 855          1HD       ARG 855   8.769   5.050  -5.696
  156   2HD   ARG 855          2HD       ARG 855   8.623   3.562  -6.657
  157    HE   ARG 855           HE       ARG 855   6.716   4.572  -7.815
  158   1HH1  ARG 855          2HH2      ARG 855   8.724   6.686  -5.815
  159   2HH1  ARG 855          1HH2      ARG 855   8.244   8.151  -6.640
  160   1HH2  ARG 855          2HH1      ARG 855   6.082   6.508  -8.905
  161   2HH2  ARG 855          1HH1      ARG 855   6.737   8.050  -8.402
  162    H    LEU 856           H        LEU 856   3.645   1.587  -2.972
  163    HA   LEU 856           HA       LEU 856   5.770   2.155  -0.979
  164   1HB   LEU 856          1HB       LEU 856   4.125   2.165   0.583
  165   2HB   LEU 856          2HB       LEU 856   3.037   2.378  -0.809
  166    HG   LEU 856           HG       LEU 856   2.609   0.006  -0.934
  167   1HD1  LEU 856          1HD1      LEU 856   5.101  -0.096   0.657
  168   2HD1  LEU 856          2HD1      LEU 856   3.839  -1.222   1.212
  169   3HD1  LEU 856          3HD1      LEU 856   4.418  -1.293  -0.470
  170   1HD2  LEU 856          1HD2      LEU 856   1.261  -0.124   0.917
  171   2HD2  LEU 856          2HD2      LEU 856   2.588   0.268   2.038
  172   3HD2  LEU 856          3HD2      LEU 856   1.775   1.567   1.132
  173    H    TYR 857           H        TYR 857   6.984   0.545  -0.075
  174    HA   TYR 857           HA       TYR 857   7.020  -2.005  -1.456
  175   1HB   TYR 857          1HB       TYR 857   9.153  -1.609  -0.864
  176   2HB   TYR 857          2HB       TYR 857   8.684  -0.482   0.420
  177    HD1  TYR 857           1HD      TYR 857   8.019  -4.147  -0.086
  178    HD2  TYR 857           2HD      TYR 857   9.755  -1.090   2.383
  179    HE1  TYR 857           1HE      TYR 857   8.593  -5.852   1.621
  180    HE2  TYR 857           2HE      TYR 857  10.330  -2.795   4.090
  181    HH   TYR 857           HH       TYR 857  10.086  -4.988   4.741
  182    H    LEU 858           H        LEU 858   5.277  -3.299  -1.058
  183    HA   LEU 858           HA       LEU 858   4.203  -3.526   1.655
  184   1HB   LEU 858          1HB       LEU 858   2.741  -3.521  -0.359
  185   2HB   LEU 858          2HB       LEU 858   3.515  -5.030  -0.900
  186    HG   LEU 858           HG       LEU 858   2.374  -6.295   0.610
  187   1HD1  LEU 858          1HD1      LEU 858   1.887  -5.439   2.960
  188   2HD1  LEU 858          2HD1      LEU 858   3.612  -5.531   2.531
  189   3HD1  LEU 858          3HD1      LEU 858   2.774  -3.960   2.520
  190   1HD2  LEU 858          1HD2      LEU 858   0.600  -4.013   1.368
  191   2HD2  LEU 858          2HD2      LEU 858   0.771  -4.344  -0.373
  192   3HD2  LEU 858          3HD2      LEU 858   0.181  -5.617   0.722
  193    HA   PRO 859           HA       PRO 859   7.155  -6.794   2.482
  194   1HB   PRO 859          1HB       PRO 859   6.648  -6.987   5.152
  195   2HB   PRO 859          2HB       PRO 859   7.520  -5.583   4.454
  196   1HG   PRO 859          1HG       PRO 859   4.561  -5.780   5.086
  197   2HG   PRO 859          2HG       PRO 859   5.701  -4.497   5.606
  198   1HD   PRO 859          1HD       PRO 859   4.128  -4.194   3.400
  199   2HD   PRO 859          2HD       PRO 859   5.823  -3.618   3.392
  200    HA   PRO 860           HA       PRO 860   4.361 -10.204   2.164
  201   1HB   PRO 860          1HB       PRO 860   6.085 -12.258   2.641
  202   2HB   PRO 860          2HB       PRO 860   6.223 -11.229   1.179
  203   1HG   PRO 860          1HG       PRO 860   7.734 -10.925   3.789
  204   2HG   PRO 860          2HG       PRO 860   8.424 -11.003   2.135
  205   1HD   PRO 860          1HD       PRO 860   7.941  -8.618   3.363
  206   2HD   PRO 860          2HD       PRO 860   7.600  -8.825   1.618
  207    H    SER 861           H        SER 861   6.211  -9.397   5.028
  208    HA   SER 861           HA       SER 861   4.918 -11.388   6.719
  209   1HB   SER 861          1HB       SER 861   7.152  -9.580   6.868
  210   2HB   SER 861          2HB       SER 861   6.073  -9.278   8.251
  211    HG   SER 861           HG       SER 861   7.299 -11.701   7.455
  212    H    THR 862           H        THR 862   4.121  -8.309   5.411
  213    HA   THR 862           HA       THR 862   2.553  -7.278   7.570
  214    HB   THR 862           HB       THR 862   3.115  -6.661   4.762
  215    HG1  THR 862           1HG      THR 862   2.819  -4.568   5.652
  216   1HG2  THR 862          1HG2      THR 862   1.055  -5.690   4.130
  217   2HG2  THR 862          2HG2      THR 862   0.576  -7.254   4.833
  218   3HG2  THR 862          3HG2      THR 862   0.410  -5.761   5.788
  219    HA   PRO 863           HA       PRO 863  -0.941  -9.954   7.355
  220   1HB   PRO 863          1HB       PRO 863  -2.728  -8.463   8.773
  221   2HB   PRO 863          2HB       PRO 863  -1.269  -9.172   9.539
  222   1HG   PRO 863          1HG       PRO 863  -1.592  -6.360   8.453
  223   2HG   PRO 863          2HG       PRO 863  -1.011  -6.837  10.081
  224   1HD   PRO 863          1HD       PRO 863   0.729  -6.281   8.058
  225   2HD   PRO 863          2HD       PRO 863   1.050  -7.634   9.185
  226    H    ASP 864           H        ASP 864  -2.740 -10.228   6.043
  227    HA   ASP 864           HA       ASP 864  -4.337  -9.734   4.466
  228   1HB   ASP 864          1HB       ASP 864  -4.060  -7.293   5.953
  229   2HB   ASP 864          2HB       ASP 864  -4.196  -6.890   4.228
  230    H    PHE 865           H        PHE 865  -1.179  -9.574   4.204
  231    HA   PHE 865           HA       PHE 865  -0.413  -7.961   2.099
  232   1HB   PHE 865          1HB       PHE 865   0.952  -9.632   3.449
  233   2HB   PHE 865          2HB       PHE 865   0.341 -10.885   2.355
  234    HD1  PHE 865           1HD      PHE 865   2.013  -7.520   2.226
  235    HD2  PHE 865           2HD      PHE 865   1.597 -11.425   0.484
  236    HE1  PHE 865           1HE      PHE 865   3.821  -6.993   0.612
  237    HE2  PHE 865           2HE      PHE 865   3.405 -10.898  -1.129
  238    HZ   PHE 865           HZ       PHE 865   4.517  -8.682  -1.066
  239    H    SER 866           H        SER 866  -1.946 -11.217   1.873
  240    HA   SER 866           HA       SER 866  -2.039 -11.825  -0.705
  241   1HB   SER 866          1HB       SER 866  -4.441 -12.475  -0.440
  242   2HB   SER 866          2HB       SER 866  -3.426 -12.971   0.936
  243    HG   SER 866           HG       SER 866  -4.886 -11.936   2.036
  244    H    ARG 867           H        ARG 867  -4.571  -9.555   0.509
  245    HA   ARG 867           HA       ARG 867  -5.014  -8.550  -2.180
  246   1HB   ARG 867          1HB       ARG 867  -6.033  -7.374   0.424
  247   2HB   ARG 867          2HB       ARG 867  -6.773  -7.287  -1.192
  248   1HG   ARG 867          1HG       ARG 867  -8.010  -9.068  -0.509
  249   2HG   ARG 867          2HG       ARG 867  -6.533 -10.016  -0.805
  250   1HD   ARG 867          1HD       ARG 867  -5.908  -9.209   1.641
  251   2HD   ARG 867          2HD       ARG 867  -7.665  -8.994   1.792
  252    HE   ARG 867           HE       ARG 867  -7.191 -11.556   0.688
  253   1HH1  ARG 867          2HH2      ARG 867  -6.656  -9.743   3.676
  254   2HH1  ARG 867          1HH2      ARG 867  -6.725 -11.155   4.706
  255   1HH2  ARG 867          2HH1      ARG 867  -7.281 -13.422   2.049
  256   2HH2  ARG 867          1HH1      ARG 867  -7.081 -13.252   3.779
  257    H    LEU 868           H        LEU 868  -3.577  -7.303   0.871
  258    HA   LEU 868           HA       LEU 868  -3.056  -4.714   0.386
  259   1HB   LEU 868          1HB       LEU 868  -1.488  -6.924   1.608
  260   2HB   LEU 868          2HB       LEU 868  -0.565  -5.458   1.199
  261    HG   LEU 868           HG       LEU 868  -2.739  -5.853   3.210
  262   1HD1  LEU 868          1HD1      LEU 868  -0.068  -4.637   2.936
  263   2HD1  LEU 868          2HD1      LEU 868  -1.218  -3.609   3.824
  264   3HD1  LEU 868          3HD1      LEU 868  -0.889  -5.266   4.385
  265   1HD2  LEU 868          1HD2      LEU 868  -3.312  -3.399   3.056
  266   2HD2  LEU 868          2HD2      LEU 868  -2.441  -3.346   1.504
  267   3HD2  LEU 868          3HD2      LEU 868  -3.892  -4.363   1.676
  268    H    ARG 869           H        ARG 869  -1.169  -7.410  -1.080
  269    HA   ARG 869           HA       ARG 869   0.467  -5.664  -2.669
  270   1HB   ARG 869          1HB       ARG 869   0.273  -8.448  -2.064
  271   2HB   ARG 869          2HB       ARG 869   0.211  -8.280  -3.835
  272   1HG   ARG 869          1HG       ARG 869   2.194  -6.584  -3.463
  273   2HG   ARG 869          2HG       ARG 869   2.379  -7.435  -1.910
  274   1HD   ARG 869          1HD       ARG 869   2.646  -8.515  -4.721
  275   2HD   ARG 869          2HD       ARG 869   3.776  -8.657  -3.357
  276    HE   ARG 869           HE       ARG 869   1.553  -9.994  -2.465
  277   1HH1  ARG 869          2HH2      ARG 869   3.533 -10.151  -5.390
  278   2HH1  ARG 869          1HH2      ARG 869   3.255 -11.858  -5.652
  279   1HH2  ARG 869          2HH1      ARG 869   1.186 -12.249  -2.811
  280   2HH2  ARG 869          1HH1      ARG 869   1.917 -13.054  -4.181
  281    H    ARG 870           H        ARG 870  -1.541  -8.217  -4.131
  282    HA   ARG 870           HA       ARG 870  -1.967  -7.153  -6.575
  283   1HB   ARG 870          1HB       ARG 870  -3.316  -9.046  -4.872
  284   2HB   ARG 870          2HB       ARG 870  -4.529  -8.095  -5.761
  285   1HG   ARG 870          1HG       ARG 870  -3.852 -10.060  -7.082
  286   2HG   ARG 870          2HG       ARG 870  -3.314  -8.565  -7.883
  287   1HD   ARG 870          1HD       ARG 870  -1.406  -9.940  -7.976
  288   2HD   ARG 870          2HD       ARG 870  -1.101  -8.913  -6.558
  289    HE   ARG 870           HE       ARG 870  -1.108 -10.809  -5.257
  290   1HH1  ARG 870          2HH2      ARG 870  -2.932 -11.404  -8.227
  291   2HH1  ARG 870          1HH2      ARG 870  -3.227 -13.091  -7.869
  292   1HH2  ARG 870          2HH1      ARG 870  -1.497 -13.037  -4.785
  293   2HH2  ARG 870          1HH1      ARG 870  -2.409 -14.022  -5.908
  294    H    TYR 871           H        TYR 871  -4.176  -6.492  -3.790
  295    HA   TYR 871           HA       TYR 871  -5.860  -4.660  -4.960
  296   1HB   TYR 871          1HB       TYR 871  -5.818  -5.564  -2.572
  297   2HB   TYR 871          2HB       TYR 871  -4.650  -4.282  -2.209
  298    HD1  TYR 871           1HD      TYR 871  -7.761  -4.281  -4.314
  299    HD2  TYR 871           2HD      TYR 871  -5.718  -2.703  -0.880
  300    HE1  TYR 871           1HE      TYR 871  -9.625  -2.690  -3.936
  301    HE2  TYR 871           2HE      TYR 871  -7.582  -1.112  -0.502
  302    HH   TYR 871           HH       TYR 871 -10.238  -1.103  -1.180
  303    H    PHE 872           H        PHE 872  -3.077  -3.558  -2.949
  304    HA   PHE 872           HA       PHE 872  -3.003  -0.933  -3.723
  305   1HB   PHE 872          1HB       PHE 872  -1.529  -2.108  -2.057
  306   2HB   PHE 872          2HB       PHE 872  -0.557  -2.701  -3.415
  307    HD1  PHE 872           1HD      PHE 872   0.018  -0.648  -5.166
  308    HD2  PHE 872           2HD      PHE 872  -0.627  -0.309  -0.933
  309    HE1  PHE 872           1HE      PHE 872   1.347   1.446  -5.131
  310    HE2  PHE 872           2HE      PHE 872   0.702   1.785  -0.898
  311    HZ   PHE 872           HZ       PHE 872   1.689   2.662  -2.997
  312    H    VAL 873           H        VAL 873  -0.263  -2.701  -5.045
  313    HA   VAL 873           HA       VAL 873   0.292  -1.358  -7.256
  314    HB   VAL 873           HB       VAL 873   1.590  -3.226  -7.237
  315   1HG1  VAL 873          1HG1      VAL 873   0.334  -4.202  -5.341
  316   2HG1  VAL 873          2HG1      VAL 873  -0.890  -4.827  -6.472
  317   3HG1  VAL 873          3HG1      VAL 873   0.774  -5.454  -6.526
  318   1HG2  VAL 873          1HG2      VAL 873   1.033  -4.778  -9.005
  319   2HG2  VAL 873          2HG2      VAL 873  -0.703  -4.418  -8.848
  320   3HG2  VAL 873          3HG2      VAL 873   0.408  -3.181  -9.484
  321    H    ALA 874           H        ALA 874  -2.546  -3.518  -6.969
  322    HA   ALA 874           HA       ALA 874  -3.422  -3.370  -9.645
  323   1HB   ALA 874          1HB       ALA 874  -4.376  -4.966  -8.107
  324   2HB   ALA 874          2HB       ALA 874  -4.937  -3.668  -7.026
  325   3HB   ALA 874          3HB       ALA 874  -5.679  -3.872  -8.631
  326    H    PHE 875           H        PHE 875  -4.179  -1.283  -6.811
  327    HA   PHE 875           HA       PHE 875  -6.063   0.409  -7.831
  328   1HB   PHE 875          1HB       PHE 875  -3.566   1.246  -6.318
  329   2HB   PHE 875          2HB       PHE 875  -5.080   2.161  -6.423
  330    HD1  PHE 875           1HD      PHE 875  -5.739  -1.331  -6.290
  331    HD2  PHE 875           2HD      PHE 875  -4.720   2.042  -3.832
  332    HE1  PHE 875           1HE      PHE 875  -6.602  -2.524  -4.294
  333    HE2  PHE 875           2HE      PHE 875  -5.584   0.848  -1.836
  334    HZ   PHE 875           HZ       PHE 875  -6.524  -1.435  -2.068
  335    H    ASP 876           H        ASP 876  -2.526   0.570  -8.464
  336    HA   ASP 876           HA       ASP 876  -2.335   1.144 -11.027
  337   1HB   ASP 876          1HB       ASP 876  -3.876   3.337  -9.759
  338   2HB   ASP 876          2HB       ASP 876  -2.560   3.860 -10.833
  339    H    GLY 877           H        GLY 877  -1.167   1.121  -8.044
  340   1HA   GLY 877          1HA       GLY 877   1.078   2.999  -8.507
  341   2HA   GLY 877          2HA       GLY 877   0.684   2.171  -6.983
  342    H    ASP 878           H        ASP 878   2.668   1.185  -6.621
  343    HA   ASP 878           HA       ASP 878   3.186  -1.199  -8.217
  344   1HB   ASP 878          1HB       ASP 878   4.821   1.279  -8.452
  345   2HB   ASP 878          2HB       ASP 878   5.722  -0.240  -8.251
  346    H    LEU 879           H        LEU 879   4.774  -2.603  -7.179
  347    HA   LEU 879           HA       LEU 879   5.350  -1.835  -4.362
  348   1HB   LEU 879          1HB       LEU 879   4.432  -4.588  -5.261
  349   2HB   LEU 879          2HB       LEU 879   4.650  -3.999  -3.595
  350    HG   LEU 879           HG       LEU 879   2.523  -3.223  -5.614
  351   1HD1  LEU 879          1HD1      LEU 879   1.625  -4.904  -4.313
  352   2HD1  LEU 879          2HD1      LEU 879   2.690  -4.550  -2.932
  353   3HD1  LEU 879          3HD1      LEU 879   1.273  -3.521  -3.249
  354   1HD2  LEU 879          1HD2      LEU 879   3.854  -1.539  -3.619
  355   2HD2  LEU 879          2HD2      LEU 879   2.672  -1.091  -4.873
  356   3HD2  LEU 879          3HD2      LEU 879   2.111  -1.700  -3.297
  357    H    VAL 880           H        VAL 880   7.468  -1.968  -3.942
  358    HA   VAL 880           HA       VAL 880   9.130  -3.653  -5.740
  359    HB   VAL 880           HB       VAL 880  10.561  -1.869  -3.923
  360   1HG1  VAL 880          1HG1      VAL 880  11.840  -1.524  -5.814
  361   2HG1  VAL 880          2HG1      VAL 880  11.047  -3.043  -6.296
  362   3HG1  VAL 880          3HG1      VAL 880  10.425  -1.486  -6.893
  363   1HG2  VAL 880          1HG2      VAL 880   8.850  -0.293  -3.931
  364   2HG2  VAL 880          2HG2      VAL 880   9.705   0.154  -5.427
  365   3HG2  VAL 880          3HG2      VAL 880   8.223  -0.828  -5.509
  366    H    GLN 881           H        GLN 881  10.454  -5.248  -4.924
  367    HA   GLN 881           HA       GLN 881   9.716  -6.403  -2.413
  368   1HB   GLN 881          1HB       GLN 881  12.211  -6.962  -4.054
  369   2HB   GLN 881          2HB       GLN 881  11.375  -8.062  -2.932
  370   1HG   GLN 881          1HG       GLN 881   9.921  -8.707  -4.529
  371   2HG   GLN 881          2HG       GLN 881   9.540  -7.021  -4.942
  372   1HE2  GLN 881          1HE2      GLN 881   9.871  -6.606  -7.047
  373   2HE2  GLN 881          2HE2      GLN 881  11.184  -7.238  -8.018
  374    H    GLU 882           H        GLU 882  10.557  -6.172  -0.402
  375    HA   GLU 882           HA       GLU 882  11.782  -4.071   0.632
  376   1HB   GLU 882          1HB       GLU 882  11.230  -6.141   1.890
  377   2HB   GLU 882          2HB       GLU 882  12.699  -6.909   1.241
  378   1HG   GLU 882          1HG       GLU 882  13.759  -4.596   2.198
  379   2HG   GLU 882          2HG       GLU 882  12.402  -4.798   3.327
  380    H    PHE 883           H        PHE 883  13.952  -6.809  -0.257
  381    HA   PHE 883           HA       PHE 883  16.273  -5.169  -0.351
  382   1HB   PHE 883          1HB       PHE 883  17.371  -7.101  -1.187
  383   2HB   PHE 883          2HB       PHE 883  16.134  -7.679  -0.058
  384    HD1  PHE 883           1HD      PHE 883  17.246  -7.584  -3.547
  385    HD2  PHE 883           2HD      PHE 883  14.096  -8.797  -0.890
  386    HE1  PHE 883           1HE      PHE 883  16.314  -9.047  -5.319
  387    HE2  PHE 883           2HE      PHE 883  13.165 -10.260  -2.662
  388    HZ   PHE 883           HZ       PHE 883  14.274 -10.385  -4.877
  389    H    ASP 884           H        ASP 884  13.723  -4.576  -2.115
  390    HA   ASP 884           HA       ASP 884  15.323  -3.703  -4.438
  391   1HB   ASP 884          1HB       ASP 884  12.812  -5.408  -4.593
  392   2HB   ASP 884          2HB       ASP 884  13.495  -4.513  -5.968
  393    H    MET 885           H        MET 885  15.101  -1.562  -3.783
  394    HA   MET 885           HA       MET 885  12.425  -0.429  -4.239
  395   1HB   MET 885          1HB       MET 885  13.064   0.995  -2.033
  396   2HB   MET 885          2HB       MET 885  12.065  -0.478  -1.978
  397   1HG   MET 885          1HG       MET 885  14.267  -1.767  -1.725
  398   2HG   MET 885          2HG       MET 885  15.033  -0.198  -1.423
  399   1HE   MET 885          1HE       MET 885  12.346  -2.772   1.103
  400   2HE   MET 885          2HE       MET 885  11.337  -1.546   0.299
  401   3HE   MET 885          3HE       MET 885  12.380  -2.614  -0.670
  402    H    THR 886           H        THR 886  15.911  -0.056  -3.626
  403    HA   THR 886           HA       THR 886  16.818   2.302  -3.805
  404    HB   THR 886           HB       THR 886  18.351   1.787  -5.517
  405    HG1  THR 886           1HG      THR 886  16.446   0.014  -6.641
  406   1HG2  THR 886          1HG2      THR 886  18.162   0.057  -3.662
  407   2HG2  THR 886          2HG2      THR 886  17.198  -0.933  -4.784
  408   3HG2  THR 886          3HG2      THR 886  18.890  -0.540  -5.173
  409    H    SER 887           H        SER 887  14.821   1.169  -6.585
  410    HA   SER 887           HA       SER 887  14.472   3.992  -7.402
  411   1HB   SER 887          1HB       SER 887  14.441   1.354  -8.720
  412   2HB   SER 887          2HB       SER 887  13.110   2.424  -9.222
  413    HG   SER 887           HG       SER 887  14.569   3.342 -10.403
  414    H    ALA 888           H        ALA 888  12.951   1.528  -5.575
  415    HA   ALA 888           HA       ALA 888  10.254   1.734  -6.093
  416   1HB   ALA 888          1HB       ALA 888  10.942   0.242  -4.394
  417   2HB   ALA 888          2HB       ALA 888  11.810   1.517  -3.504
  418   3HB   ALA 888          3HB       ALA 888  10.030   1.500  -3.526
  419    H    THR 889           H        THR 889   8.670   2.903  -4.407
  420    HA   THR 889           HA       THR 889   9.507   5.758  -4.254
  421    HB   THR 889           HB       THR 889   7.759   4.835  -6.119
  422    HG1  THR 889           1HG      THR 889   7.662   6.902  -6.417
  423   1HG2  THR 889          1HG2      THR 889   5.555   4.818  -5.407
  424   2HG2  THR 889          2HG2      THR 889   6.345   4.200  -3.936
  425   3HG2  THR 889          3HG2      THR 889   5.877   5.914  -4.041
  426    H    HIS 890           H        HIS 890   7.329   3.157  -3.094
  427    HA   HIS 890           HA       HIS 890   7.228   4.593  -0.483
  428   1HB   HIS 890          1HB       HIS 890   5.055   3.197  -2.052
  429   2HB   HIS 890          2HB       HIS 890   4.944   3.390  -0.292
  430    HD1  HIS 890           1HD      HIS 890   6.236   6.100  -2.736
  431    HD2  HIS 890           2HD      HIS 890   3.053   5.208  -0.131
  432    HE1  HIS 890           1HE      HIS 890   4.805   8.213  -2.573
  433    H    VAL 891           H        VAL 891   6.863   3.134   1.381
  434    HA   VAL 891           HA       VAL 891   7.526   0.304   0.915
  435    HB   VAL 891           HB       VAL 891   9.371   0.478   2.650
  436   1HG1  VAL 891          1HG1      VAL 891  10.171   0.164   0.475
  437   2HG1  VAL 891          2HG1      VAL 891   9.481   1.697  -0.109
  438   3HG1  VAL 891          3HG1      VAL 891  10.937   1.710   0.914
  439   1HG2  VAL 891          1HG2      VAL 891   9.046   3.439   1.999
  440   2HG2  VAL 891          2HG2      VAL 891   8.739   2.672   3.575
  441   3HG2  VAL 891          3HG2      VAL 891  10.393   2.731   2.922
  442    H    LEU 892           H        LEU 892   6.360  -0.942   2.265
  443    HA   LEU 892           HA       LEU 892   4.740   0.365   4.313
  444   1HB   LEU 892          1HB       LEU 892   4.401  -1.804   2.627
  445   2HB   LEU 892          2HB       LEU 892   4.731  -2.578   4.195
  446    HG   LEU 892           HG       LEU 892   2.982  -0.364   4.678
  447   1HD1  LEU 892          1HD1      LEU 892   1.563  -0.291   2.928
  448   2HD1  LEU 892          2HD1      LEU 892   2.632  -1.411   2.049
  449   3HD1  LEU 892          3HD1      LEU 892   1.297  -2.048   3.040
  450   1HD2  LEU 892          1HD2      LEU 892   1.405  -2.358   5.212
  451   2HD2  LEU 892          2HD2      LEU 892   2.782  -3.389   4.755
  452   3HD2  LEU 892          3HD2      LEU 892   2.936  -2.249   6.113
  453    H    GLY 893           H        GLY 893   5.383   0.654   6.360
  454   1HA   GLY 893          1HA       GLY 893   6.542   0.395   8.325
  455   2HA   GLY 893          2HA       GLY 893   6.514  -1.350   7.982
  456    H    SER 894           H        SER 894   8.509   1.305   8.479
  457    HA   SER 894           HA       SER 894  10.806   1.449   8.443
  458   1HB   SER 894          1HB       SER 894  10.393  -1.367   7.489
  459   2HB   SER 894          2HB       SER 894  11.988  -0.615   7.246
  460    HG   SER 894           HG       SER 894  12.179  -0.318   9.410
  461    H    ARG 895           H        ARG 895  12.642   1.655   6.787
  462    HA   ARG 895           HA       ARG 895  11.636   1.990   4.027
  463   1HB   ARG 895          1HB       ARG 895  12.659   4.284   3.965
  464   2HB   ARG 895          2HB       ARG 895  11.232   4.164   5.023
  465   1HG   ARG 895          1HG       ARG 895  12.562   4.137   6.996
  466   2HG   ARG 895          2HG       ARG 895  14.051   3.785   6.086
  467   1HD   ARG 895          1HD       ARG 895  13.071   6.151   4.940
  468   2HD   ARG 895          2HD       ARG 895  12.793   6.359   6.683
  469    HE   ARG 895           HE       ARG 895  15.440   5.341   6.135
  470   1HH1  ARG 895          2HH2      ARG 895  13.425   8.246   6.142
  471   2HH1  ARG 895          1HH2      ARG 895  14.766   9.342   6.388
  472   1HH2  ARG 895          2HH1      ARG 895  17.212   6.789   6.460
  473   2HH2  ARG 895          1HH1      ARG 895  16.926   8.511   6.569
  474    H    ASP 896           H        ASP 896  14.265   1.800   6.396
  475    HA   ASP 896           HA       ASP 896  16.614   2.051   5.404
  476   1HB   ASP 896          1HB       ASP 896  16.511   0.528   7.182
  477   2HB   ASP 896          2HB       ASP 896  15.410  -0.563   6.313
  478    H    LYS 897           H        LYS 897  15.177  -1.023   4.224
  479    HA   LYS 897           HA       LYS 897  16.670  -1.558   2.076
  480   1HB   LYS 897          1HB       LYS 897  14.042  -1.772   1.044
  481   2HB   LYS 897          2HB       LYS 897  14.993  -3.036   1.861
  482   1HG   LYS 897          1HG       LYS 897  13.057  -2.905   3.192
  483   2HG   LYS 897          2HG       LYS 897  14.203  -1.860   4.065
  484   1HD   LYS 897          1HD       LYS 897  13.230   0.070   2.629
  485   2HD   LYS 897          2HD       LYS 897  11.900  -1.055   2.262
  486   1HE   LYS 897          1HE       LYS 897  12.001  -1.382   4.937
  487   2HE   LYS 897          2HE       LYS 897  12.631   0.277   4.841
  488   1HZ   LYS 897          1HZ       LYS 897  10.699   0.999   3.861
  489   2HZ   LYS 897          2HZ       LYS 897  10.190  -0.514   3.447
  490   3HZ   LYS 897          3HZ       LYS 897  10.162  -0.038   5.026
  491    H    ASN 898           H        ASN 898  14.393   1.158   2.302
  492    HA   ASN 898           HA       ASN 898  15.742   2.482   0.094
  493   1HB   ASN 898          1HB       ASN 898  13.543   0.832  -0.521
  494   2HB   ASN 898          2HB       ASN 898  12.900   2.488  -0.516
  495   1HD2  ASN 898          1HD2      ASN 898  12.753   3.067  -2.629
  496   2HD2  ASN 898          2HD2      ASN 898  14.064   2.970  -3.786
  497    HA   PRO 899           HA       PRO 899  14.248   5.374   3.253
  498   1HB   PRO 899          1HB       PRO 899  16.284   7.164   2.977
  499   2HB   PRO 899          2HB       PRO 899  16.510   5.597   3.820
  500   1HG   PRO 899          1HG       PRO 899  17.142   6.235   0.924
  501   2HG   PRO 899          2HG       PRO 899  18.234   5.492   2.138
  502   1HD   PRO 899          1HD       PRO 899  16.810   3.966   0.386
  503   2HD   PRO 899          2HD       PRO 899  17.009   3.447   2.088
  504    H    ALA 900           H        ALA 900  14.718   5.452  -0.155
  505    HA   ALA 900           HA       ALA 900  13.749   8.207  -0.467
  506   1HB   ALA 900          1HB       ALA 900  13.995   6.259  -2.739
  507   2HB   ALA 900          2HB       ALA 900  14.381   7.996  -2.682
  508   3HB   ALA 900          3HB       ALA 900  15.482   6.814  -1.932
  509    H    ALA 901           H        ALA 901  12.380   5.252   0.267
  510    HA   ALA 901           HA       ALA 901   9.986   5.608  -1.412
  511   1HB   ALA 901          1HB       ALA 901  10.959   3.349  -1.030
  512   2HB   ALA 901          2HB       ALA 901  10.649   3.531   0.713
  513   3HB   ALA 901          3HB       ALA 901   9.287   3.476  -0.433
  514    H    GLN 902           H        GLN 902   8.179   4.500   0.599
  515    HA   GLN 902           HA       GLN 902   8.020   6.810   2.476
  516   1HB   GLN 902          1HB       GLN 902   5.957   5.630   0.620
  517   2HB   GLN 902          2HB       GLN 902   5.448   6.385   2.150
  518   1HG   GLN 902          1HG       GLN 902   7.112   7.676  -0.051
  519   2HG   GLN 902          2HG       GLN 902   5.425   8.055   0.361
  520   1HE2  GLN 902          1HE2      GLN 902   6.031   7.669   3.303
  521   2HE2  GLN 902          2HE2      GLN 902   6.851   9.137   3.788
  522    H    GLN 903           H        GLN 903   7.713   6.275   4.573
  523    HA   GLN 903           HA       GLN 903   7.551   3.417   5.225
  524   1HB   GLN 903          1HB       GLN 903   8.086   5.967   6.764
  525   2HB   GLN 903          2HB       GLN 903   7.766   4.431   7.604
  526   1HG   GLN 903          1HG       GLN 903   9.868   3.736   7.207
  527   2HG   GLN 903          2HG       GLN 903   9.642   3.968   5.460
  528   1HE2  GLN 903          1HE2      GLN 903  10.143   6.049   4.512
  529   2HE2  GLN 903          2HE2      GLN 903  11.262   7.136   5.307
  530    H    VAL 904           H        VAL 904   5.259   3.673   4.093
  531    HA   VAL 904           HA       VAL 904   3.218   4.761   5.888
  532    HB   VAL 904           HB       VAL 904   1.927   4.742   4.036
  533   1HG1  VAL 904          1HG1      VAL 904   4.427   5.161   3.249
  534   2HG1  VAL 904          2HG1      VAL 904   4.198   3.608   2.410
  535   3HG1  VAL 904          3HG1      VAL 904   3.124   4.981   2.049
  536   1HG2  VAL 904          1HG2      VAL 904   1.897   2.636   2.518
  537   2HG2  VAL 904          2HG2      VAL 904   2.901   1.881   3.779
  538   3HG2  VAL 904          3HG2      VAL 904   1.268   2.468   4.175
  539    H    SER 905           H        SER 905   1.242   3.245   6.275
  540    HA   SER 905           HA       SER 905   2.211   0.529   7.008
  541   1HB   SER 905          1HB       SER 905   1.581   0.753   9.198
  542   2HB   SER 905          2HB       SER 905   1.947   2.465   8.873
  543    HG   SER 905           HG       SER 905  -0.201   2.853   8.549
  544    HA   PRO 906           HA       PRO 906  -1.747  -1.010   5.790
  545   1HB   PRO 906          1HB       PRO 906  -3.045  -2.076   7.935
  546   2HB   PRO 906          2HB       PRO 906  -1.483  -2.736   7.352
  547   1HG   PRO 906          1HG       PRO 906  -1.912  -0.737   9.590
  548   2HG   PRO 906          2HG       PRO 906  -0.973  -2.263   9.660
  549   1HD   PRO 906          1HD       PRO 906   0.240   0.131   9.184
  550   2HD   PRO 906          2HD       PRO 906   0.756  -1.339   8.303
  551    H    GLU 907           H        GLU 907  -1.852   1.287   8.480
  552    HA   GLU 907           HA       GLU 907  -4.670   1.861   8.262
  553   1HB   GLU 907          1HB       GLU 907  -2.303   2.893   9.734
  554   2HB   GLU 907          2HB       GLU 907  -3.601   4.073   9.434
  555   1HG   GLU 907          1HG       GLU 907  -4.751   3.166  11.141
  556   2HG   GLU 907          2HG       GLU 907  -4.891   1.668  10.196
  557    H    TRP 908           H        TRP 908  -1.712   3.015   6.699
  558    HA   TRP 908           HA       TRP 908  -2.812   5.420   5.615
  559   1HB   TRP 908          1HB       TRP 908  -0.411   4.977   5.793
  560   2HB   TRP 908          2HB       TRP 908  -0.559   3.626   4.661
  561    HD1  TRP 908           HD       TRP 908  -0.824   7.458   4.765
  562    HE1  TRP 908           1HE      TRP 908  -0.335   8.413   2.455
  563    HE3  TRP 908           3HE      TRP 908  -0.455   3.078   2.143
  564    HZ2  TRP 908           2HZ      TRP 908   0.157   7.408  -0.214
  565    HZ3  TRP 908           3HZ      TRP 908   0.024   3.117  -0.278
  566    HH2  TRP 908           HH       TRP 908   0.331   5.268  -1.468
  567    H    ILE 909           H        ILE 909  -2.325   2.131   4.216
  568    HA   ILE 909           HA       ILE 909  -3.360   2.540   1.687
  569    HB   ILE 909           HB       ILE 909  -3.235   0.243   3.593
  570   1HG1  ILE 909          1HG1      ILE 909  -2.558  -0.313   0.848
  571   2HG1  ILE 909          2HG1      ILE 909  -1.849   1.255   1.304
  572   1HG2  ILE 909          1HG2      ILE 909  -4.457  -1.198   1.957
  573   2HG2  ILE 909          2HG2      ILE 909  -5.514   0.017   2.715
  574   3HG2  ILE 909          3HG2      ILE 909  -4.923   0.264   1.054
  575   1HD1  ILE 909          1HD1      ILE 909  -1.403  -1.470   2.539
  576   2HD1  ILE 909          2HD1      ILE 909  -0.202  -0.273   1.999
  577   3HD1  ILE 909          3HD1      ILE 909  -1.127   0.006   3.494
  578    H    TRP 910           H        TRP 910  -5.243   1.538   4.606
  579    HA   TRP 910           HA       TRP 910  -7.776   1.694   3.350
  580   1HB   TRP 910          1HB       TRP 910  -7.294   2.314   6.260
  581   2HB   TRP 910          2HB       TRP 910  -8.665   1.482   5.514
  582    HD1  TRP 910           HD       TRP 910  -5.976   0.717   7.672
  583    HE1  TRP 910           1HE      TRP 910  -5.211  -1.709   7.565
  584    HE3  TRP 910           3HE      TRP 910  -8.160  -0.621   3.241
  585    HZ2  TRP 910           2HZ      TRP 910  -5.505  -3.966   5.777
  586    HZ3  TRP 910           3HZ      TRP 910  -7.895  -2.914   2.369
  587    HH2  TRP 910           HH       TRP 910  -6.574  -4.595   3.621
  588    H    ALA 911           H        ALA 911  -6.144   4.062   5.535
  589    HA   ALA 911           HA       ALA 911  -8.041   6.099   5.365
  590   1HB   ALA 911          1HB       ALA 911  -6.134   7.616   5.901
  591   2HB   ALA 911          2HB       ALA 911  -6.154   6.153   6.915
  592   3HB   ALA 911          3HB       ALA 911  -5.009   6.280   5.558
  593    H    CYS 912           H        CYS 912  -5.434   5.206   3.104
  594    HA   CYS 912           HA       CYS 912  -5.799   7.519   1.413
  595   1HB   CYS 912          1HB       CYS 912  -4.535   4.833   0.744
  596   2HB   CYS 912          2HB       CYS 912  -4.247   6.395  -0.062
  597    HG   CYS 912           HG       CYS 912  -2.730   5.050   2.221
  598    H    ILE 913           H        ILE 913  -6.210   4.064   0.500
  599    HA   ILE 913           HA       ILE 913  -7.817   4.383  -1.688
  600    HB   ILE 913           HB       ILE 913  -7.002   2.209  -0.963
  601   1HG1  ILE 913          1HG1      ILE 913 -10.022   2.051  -0.748
  602   2HG1  ILE 913          2HG1      ILE 913  -9.228   2.508  -2.274
  603   1HG2  ILE 913          1HG2      ILE 913  -7.183   1.551   1.184
  604   2HG2  ILE 913          2HG2      ILE 913  -8.082   3.045   1.543
  605   3HG2  ILE 913          3HG2      ILE 913  -8.959   1.573   1.062
  606   1HD1  ILE 913          1HD1      ILE 913  -8.093   0.424  -2.436
  607   2HD1  ILE 913          2HD1      ILE 913  -8.414   0.025  -0.731
  608   3HD1  ILE 913          3HD1      ILE 913  -9.742  -0.001  -1.917
  609    H    ARG 914           H        ARG 914  -8.745   4.698   1.724
  610    HA   ARG 914           HA       ARG 914 -11.585   4.805   1.189
  611   1HB   ARG 914          1HB       ARG 914 -10.569   4.129   3.374
  612   2HB   ARG 914          2HB       ARG 914 -10.008   5.804   3.592
  613   1HG   ARG 914          1HG       ARG 914 -12.307   5.059   4.642
  614   2HG   ARG 914          2HG       ARG 914 -12.185   6.640   3.834
  615   1HD   ARG 914          1HD       ARG 914 -12.964   5.503   1.705
  616   2HD   ARG 914          2HD       ARG 914 -13.286   4.051   2.677
  617    HE   ARG 914           HE       ARG 914 -14.918   6.420   2.508
  618   1HH1  ARG 914          2HH2      ARG 914 -13.810   3.869   4.692
  619   2HH1  ARG 914          1HH2      ARG 914 -15.222   3.947   5.720
  620   1HH2  ARG 914          2HH1      ARG 914 -16.784   6.522   3.867
  621   2HH2  ARG 914          1HH1      ARG 914 -16.918   5.460   5.250
  622    H    LYS 915           H        LYS 915  -8.905   7.120   1.352
  623    HA   LYS 915           HA       LYS 915 -10.765   9.397   1.189
  624   1HB   LYS 915          1HB       LYS 915  -7.735   9.177   1.321
  625   2HB   LYS 915          2HB       LYS 915  -8.625  10.715   1.228
  626   1HG   LYS 915          1HG       LYS 915  -9.287   8.655   3.348
  627   2HG   LYS 915          2HG       LYS 915  -7.962   9.820   3.584
  628   1HD   LYS 915          1HD       LYS 915  -9.458  11.693   3.364
  629   2HD   LYS 915          2HD       LYS 915 -10.783  10.647   2.799
  630   1HE   LYS 915          1HE       LYS 915  -9.652   9.821   5.395
  631   2HE   LYS 915          2HE       LYS 915 -10.368  11.447   5.422
  632   1HZ   LYS 915          1HZ       LYS 915 -12.112   9.901   4.034
  633   2HZ   LYS 915          2HZ       LYS 915 -11.638   8.945   5.292
  634   3HZ   LYS 915          3HZ       LYS 915 -12.283  10.435   5.586
  635    H    ARG 916           H        ARG 916  -9.673   7.131  -0.933
  636    HA   ARG 916           HA       ARG 916  -9.411   7.053  -3.206
  637   1HB   ARG 916          1HB       ARG 916 -11.486   8.969  -2.614
  638   2HB   ARG 916          2HB       ARG 916 -10.589   9.496  -4.058
  639   1HG   ARG 916          1HG       ARG 916 -11.294   6.589  -3.852
  640   2HG   ARG 916          2HG       ARG 916 -12.613   7.730  -4.204
  641   1HD   ARG 916          1HD       ARG 916 -10.314   8.446  -5.786
  642   2HD   ARG 916          2HD       ARG 916 -10.634   6.711  -5.997
  643    HE   ARG 916           HE       ARG 916 -13.025   8.362  -6.180
  644   1HH1  ARG 916          2HH2      ARG 916 -10.234   7.039  -7.900
  645   2HH1  ARG 916          1HH2      ARG 916 -10.992   7.123  -9.474
  646   1HH2  ARG 916          2HH1      ARG 916 -14.026   8.472  -8.260
  647   2HH2  ARG 916          1HH1      ARG 916 -13.154   7.940  -9.679
  648    H    ARG 917           H        ARG 917  -7.757   9.083  -1.302
  649    HA   ARG 917           HA       ARG 917  -5.974   9.877  -3.502
  650   1HB   ARG 917          1HB       ARG 917  -6.042  12.174  -3.113
  651   2HB   ARG 917          2HB       ARG 917  -7.755  11.727  -2.922
  652   1HG   ARG 917          1HG       ARG 917  -7.353  13.023  -1.003
  653   2HG   ARG 917          2HG       ARG 917  -7.113  11.364  -0.403
  654   1HD   ARG 917          1HD       ARG 917  -5.019  11.912   0.204
  655   2HD   ARG 917          2HD       ARG 917  -4.627  12.215  -1.503
  656    HE   ARG 917           HE       ARG 917  -5.291  14.214   0.555
  657   1HH1  ARG 917          2HH2      ARG 917  -4.793  13.448  -2.861
  658   2HH1  ARG 917          1HH2      ARG 917  -4.496  15.107  -3.330
  659   1HH2  ARG 917          2HH1      ARG 917  -4.899  16.405  -0.066
  660   2HH2  ARG 917          1HH1      ARG 917  -4.557  16.793  -1.737
  661    H    LEU 918           H        LEU 918  -3.968   9.319  -2.912
  662    HA   LEU 918           HA       LEU 918  -3.172   8.125  -0.608
  663   1HB   LEU 918          1HB       LEU 918  -1.731   9.960  -2.521
  664   2HB   LEU 918          2HB       LEU 918  -0.882   9.308  -1.098
  665    HG   LEU 918           HG       LEU 918  -0.512   7.444  -2.325
  666   1HD1  LEU 918          1HD1      LEU 918  -2.460   5.887  -2.579
  667   2HD1  LEU 918          2HD1      LEU 918  -2.353   6.602  -0.952
  668   3HD1  LEU 918          3HD1      LEU 918  -3.545   7.222  -2.120
  669   1HD2  LEU 918          1HD2      LEU 918  -0.828   8.519  -4.430
  670   2HD2  LEU 918          2HD2      LEU 918  -1.843   7.058  -4.501
  671   3HD2  LEU 918          3HD2      LEU 918  -2.587   8.645  -4.189
  672    H    VAL 919           H        VAL 919  -3.010   8.628   1.497
  673    HA   VAL 919           HA       VAL 919  -3.270  11.490   2.241
  674    HB   VAL 919           HB       VAL 919  -4.339  10.781   4.164
  675   1HG1  VAL 919          1HG1      VAL 919  -6.056   9.738   3.144
  676   2HG1  VAL 919          2HG1      VAL 919  -4.985   9.342   1.778
  677   3HG1  VAL 919          3HG1      VAL 919  -5.145   8.209   3.142
  678   1HG2  VAL 919          1HG2      VAL 919  -3.889   8.724   5.331
  679   2HG2  VAL 919          2HG2      VAL 919  -3.046   8.037   3.922
  680   3HG2  VAL 919          3HG2      VAL 919  -2.313   9.381   4.829
  681    H    ALA 920           H        ALA 920  -2.241  11.424   4.803
  682    HA   ALA 920           HA       ALA 920   0.562  11.669   4.291
  683   1HB   ALA 920          1HB       ALA 920   0.107  11.458   7.086
  684   2HB   ALA 920          2HB       ALA 920   0.296  12.942   6.121
  685   3HB   ALA 920          3HB       ALA 920  -1.325  12.260   6.398
  686    HA   PRO 921           HA       PRO 921   1.386   7.293   4.778
  687   1HB   PRO 921          1HB       PRO 921   3.973   7.376   3.927
  688   2HB   PRO 921          2HB       PRO 921   2.598   7.589   2.795
  689   1HG   PRO 921          1HG       PRO 921   4.220   9.765   4.146
  690   2HG   PRO 921          2HG       PRO 921   3.866   9.600   2.395
  691   1HD   PRO 921          1HD       PRO 921   2.354  11.196   4.007
  692   2HD   PRO 921          2HD       PRO 921   1.583  10.203   2.733
  693    H    CYS 922           H        CYS 922   1.957   6.302   6.641
  694    HA   CYS 922           HA       CYS 922   3.356   5.821   8.462
  695   1HB   CYS 922          1HB       CYS 922   5.041   7.453   7.285
  696   2HB   CYS 922          2HB       CYS 922   4.426   8.644   8.458
  697    HG   CYS 922           HG       CYS 922   5.604   7.912  10.351
  Start of MODEL    4
    1    H    GLY 835           H        GLY 835  -7.527   1.093  10.498
    2   1HA   GLY 835          1HA       GLY 835  -8.063  -1.005   9.463
    3   2HA   GLY 835          2HA       GLY 835  -8.650  -1.144  11.137
    4    H    SER 836           H        SER 836  -9.730   0.175   7.951
    5    HA   SER 836           HA       SER 836 -12.474  -0.761   8.631
    6   1HB   SER 836          1HB       SER 836 -12.039   1.706   8.150
    7   2HB   SER 836          2HB       SER 836 -11.667   1.222   6.478
    8    HG   SER 836           HG       SER 836 -13.914   1.820   6.965
    9    H    ALA 837           H        ALA 837  -9.981  -2.189   7.418
   10    HA   ALA 837           HA       ALA 837 -10.259  -2.754   4.735
   11   1HB   ALA 837          1HB       ALA 837  -9.003  -4.664   5.161
   12   2HB   ALA 837          2HB       ALA 837  -8.669  -3.702   6.621
   13   3HB   ALA 837          3HB       ALA 837  -9.864  -5.020   6.678
   14    H    ASP 838           H        ASP 838 -11.780  -4.750   7.336
   15    HA   ASP 838           HA       ASP 838 -13.456  -6.231   5.655
   16   1HB   ASP 838          1HB       ASP 838 -14.852  -6.517   7.737
   17   2HB   ASP 838          2HB       ASP 838 -13.124  -6.869   7.949
   18    H    GLU 839           H        GLU 839 -13.571  -2.878   6.473
   19    HA   GLU 839           HA       GLU 839 -16.417  -2.717   5.623
   20   1HB   GLU 839          1HB       GLU 839 -14.673  -1.185   7.469
   21   2HB   GLU 839          2HB       GLU 839 -15.735  -0.197   6.438
   22   1HG   GLU 839          1HG       GLU 839 -17.252  -2.441   7.370
   23   2HG   GLU 839          2HG       GLU 839 -16.422  -1.729   8.771
   24    H    THR 840           H        THR 840 -13.198  -2.336   4.539
   25    HA   THR 840           HA       THR 840 -14.107  -0.496   2.377
   26    HB   THR 840           HB       THR 840 -11.310  -1.041   3.448
   27    HG1  THR 840           1HG      THR 840 -12.730   0.240   4.767
   28   1HG2  THR 840          1HG2      THR 840 -11.541  -0.509   0.967
   29   2HG2  THR 840          2HG2      THR 840 -12.245   1.054   1.448
   30   3HG2  THR 840          3HG2      THR 840 -10.571   0.654   1.903
   31    H    LEU 841           H        LEU 841 -11.421  -2.864   2.752
   32    HA   LEU 841           HA       LEU 841 -11.594  -3.711   0.030
   33   1HB   LEU 841          1HB       LEU 841  -9.531  -3.893   1.325
   34   2HB   LEU 841          2HB       LEU 841 -10.319  -5.002   2.474
   35    HG   LEU 841           HG       LEU 841  -8.894  -5.798   0.252
   36   1HD1  LEU 841          1HD1      LEU 841  -9.398  -7.350   1.970
   37   2HD1  LEU 841          2HD1      LEU 841 -11.150  -7.073   1.827
   38   3HD1  LEU 841          3HD1      LEU 841 -10.285  -7.972   0.558
   39   1HD2  LEU 841          1HD2      LEU 841 -11.375  -6.719  -0.820
   40   2HD2  LEU 841          2HD2      LEU 841 -11.500  -4.951  -0.656
   41   3HD2  LEU 841          3HD2      LEU 841 -10.171  -5.666  -1.600
   42    H    CYS 842           H        CYS 842 -13.747  -4.176   2.519
   43    HA   CYS 842           HA       CYS 842 -14.388  -6.920   2.412
   44   1HB   CYS 842          1HB       CYS 842 -15.489  -5.825   4.121
   45   2HB   CYS 842          2HB       CYS 842 -15.815  -4.380   3.131
   46    HG   CYS 842           HG       CYS 842 -18.119  -5.067   3.205
   47    H    GLN 843           H        GLN 843 -14.572  -4.507  -0.014
   48    HA   GLN 843           HA       GLN 843 -16.770  -5.845  -1.453
   49   1HB   GLN 843          1HB       GLN 843 -15.107  -3.568  -2.525
   50   2HB   GLN 843          2HB       GLN 843 -16.822  -3.947  -2.814
   51   1HG   GLN 843          1HG       GLN 843 -16.364  -3.549   0.019
   52   2HG   GLN 843          2HG       GLN 843 -15.738  -2.157  -0.892
   53   1HE2  GLN 843          1HE2      GLN 843 -18.134  -2.431   0.906
   54   2HE2  GLN 843          2HE2      GLN 843 -19.497  -1.916  -0.065
   55    H    THR 844           H        THR 844 -15.020  -7.767  -1.242
   56    HA   THR 844           HA       THR 844 -13.779  -9.251  -2.468
   57    HB   THR 844           HB       THR 844 -15.307  -7.829  -4.357
   58    HG1  THR 844           1HG      THR 844 -13.620 -10.091  -4.692
   59   1HG2  THR 844          1HG2      THR 844 -12.348  -7.810  -4.955
   60   2HG2  THR 844          2HG2      THR 844 -13.511  -8.037  -6.284
   61   3HG2  THR 844          3HG2      THR 844 -13.574  -6.563  -5.288
   62    H    LYS 845           H        LYS 845 -12.943  -6.066  -3.950
   63    HA   LYS 845           HA       LYS 845 -10.305  -6.156  -2.679
   64   1HB   LYS 845          1HB       LYS 845 -10.796  -6.833  -5.544
   65   2HB   LYS 845          2HB       LYS 845  -9.439  -5.732  -5.202
   66   1HG   LYS 845          1HG       LYS 845  -9.884  -8.419  -3.832
   67   2HG   LYS 845          2HG       LYS 845  -8.761  -8.144  -5.185
   68   1HD   LYS 845          1HD       LYS 845  -7.229  -7.682  -3.571
   69   2HD   LYS 845          2HD       LYS 845  -8.072  -6.121  -3.427
   70   1HE   LYS 845          1HE       LYS 845  -8.194  -6.820  -1.229
   71   2HE   LYS 845          2HE       LYS 845  -9.688  -7.550  -1.854
   72   1HZ   LYS 845          1HZ       LYS 845  -8.606  -9.219  -0.727
   73   2HZ   LYS 845          2HZ       LYS 845  -8.254  -9.535  -2.307
   74   3HZ   LYS 845          3HZ       LYS 845  -7.120  -8.840  -1.332
   75    H    VAL 846           H        VAL 846 -12.972  -4.605  -4.171
   76    HA   VAL 846           HA       VAL 846 -13.358  -2.409  -4.805
   77    HB   VAL 846           HB       VAL 846 -13.584  -1.242  -2.876
   78   1HG1  VAL 846          1HG1      VAL 846 -13.225  -3.966  -2.341
   79   2HG1  VAL 846          2HG1      VAL 846 -12.209  -3.153  -1.127
   80   3HG1  VAL 846          3HG1      VAL 846 -13.943  -2.765  -1.241
   81   1HG2  VAL 846          1HG2      VAL 846 -10.773  -1.856  -1.936
   82   2HG2  VAL 846          2HG2      VAL 846 -11.058  -0.638  -3.202
   83   3HG2  VAL 846          3HG2      VAL 846 -11.784  -0.433  -1.590
   84    H    LEU 847           H        LEU 847 -10.044  -2.457  -3.361
   85    HA   LEU 847           HA       LEU 847  -8.074  -1.572  -4.114
   86   1HB   LEU 847          1HB       LEU 847  -9.278  -1.508  -6.893
   87   2HB   LEU 847          2HB       LEU 847  -7.580  -1.758  -6.422
   88    HG   LEU 847           HG       LEU 847  -8.569  -3.904  -7.064
   89   1HD1  LEU 847          1HD1      LEU 847  -7.237  -3.367  -4.689
   90   2HD1  LEU 847          2HD1      LEU 847  -8.640  -4.316  -4.144
   91   3HD1  LEU 847          3HD1      LEU 847  -7.530  -4.989  -5.362
   92   1HD2  LEU 847          1HD2      LEU 847 -10.932  -2.942  -6.262
   93   2HD2  LEU 847          2HD2      LEU 847 -10.607  -4.692  -6.290
   94   3HD2  LEU 847          3HD2      LEU 847 -10.495  -3.790  -4.759
   95    H    LEU 848           H        LEU 848 -10.053  -0.036  -6.658
   96    HA   LEU 848           HA       LEU 848 -10.658   2.155  -6.986
   97   1HB   LEU 848          1HB       LEU 848 -10.372   1.965  -4.060
   98   2HB   LEU 848          2HB       LEU 848 -10.058   3.596  -4.700
   99    HG   LEU 848           HG       LEU 848 -12.468   1.988  -5.595
  100   1HD1  LEU 848          1HD1      LEU 848 -13.592   3.653  -3.837
  101   2HD1  LEU 848          2HD1      LEU 848 -12.989   2.055  -3.335
  102   3HD1  LEU 848          3HD1      LEU 848 -12.006   3.509  -3.042
  103   1HD2  LEU 848          1HD2      LEU 848 -11.411   4.767  -5.847
  104   2HD2  LEU 848          2HD2      LEU 848 -12.399   3.815  -6.980
  105   3HD2  LEU 848          3HD2      LEU 848 -13.165   4.616  -5.588
  106    H    ASP 849           H        ASP 849  -9.643   4.366  -7.178
  107    HA   ASP 849           HA       ASP 849  -6.851   4.025  -7.925
  108   1HB   ASP 849          1HB       ASP 849  -7.158   6.506  -8.530
  109   2HB   ASP 849          2HB       ASP 849  -8.146   5.324  -9.415
  110    H    ILE 850           H        ILE 850  -6.706   3.477  -5.359
  111    HA   ILE 850           HA       ILE 850  -6.368   5.871  -3.727
  112    HB   ILE 850           HB       ILE 850  -5.218   3.313  -2.789
  113   1HG1  ILE 850          1HG1      ILE 850  -7.198   2.716  -4.367
  114   2HG1  ILE 850          2HG1      ILE 850  -7.226   2.060  -2.712
  115   1HG2  ILE 850          1HG2      ILE 850  -7.552   4.669  -1.508
  116   2HG2  ILE 850          2HG2      ILE 850  -6.045   4.063  -0.781
  117   3HG2  ILE 850          3HG2      ILE 850  -6.054   5.622  -1.639
  118   1HD1  ILE 850          1HD1      ILE 850  -9.398   2.930  -2.956
  119   2HD1  ILE 850          2HD1      ILE 850  -8.539   4.253  -2.133
  120   3HD1  ILE 850          3HD1      ILE 850  -8.832   4.338  -3.886
  121    H    PHE 851           H        PHE 851  -3.989   3.276  -3.623
  122    HA   PHE 851           HA       PHE 851  -1.793   5.057  -3.568
  123   1HB   PHE 851          1HB       PHE 851  -1.585   2.210  -4.529
  124   2HB   PHE 851          2HB       PHE 851  -0.463   3.133  -3.515
  125    HD1  PHE 851           1HD      PHE 851  -2.731   0.516  -3.465
  126    HD2  PHE 851           2HD      PHE 851  -1.692   4.040  -1.239
  127    HE1  PHE 851           1HE      PHE 851  -3.767  -0.461  -1.435
  128    HE2  PHE 851           2HE      PHE 851  -2.728   3.063   0.791
  129    HZ   PHE 851           HZ       PHE 851  -3.765   0.812   0.694
  130    H    THR 852           H        THR 852  -3.535   5.669  -5.813
  131    HA   THR 852           HA       THR 852  -2.819   4.778  -8.301
  132    HB   THR 852           HB       THR 852  -4.220   6.919  -7.303
  133    HG1  THR 852           1HG      THR 852  -4.946   6.391  -9.192
  134   1HG2  THR 852          1HG2      THR 852  -1.741   7.945  -8.748
  135   2HG2  THR 852          2HG2      THR 852  -3.210   8.913  -8.474
  136   3HG2  THR 852          3HG2      THR 852  -2.254   8.335  -7.088
  137    H    GLY 853           H        GLY 853  -0.793   4.184  -8.888
  138   1HA   GLY 853          1HA       GLY 853   1.385   4.465  -9.573
  139   2HA   GLY 853          2HA       GLY 853   1.170   6.220  -9.386
  140    H    VAL 854           H        VAL 854   0.231   4.714  -6.530
  141    HA   VAL 854           HA       VAL 854   2.630   5.649  -5.163
  142    HB   VAL 854           HB       VAL 854  -0.032   4.476  -4.343
  143   1HG1  VAL 854          1HG1      VAL 854   2.088   5.248  -2.333
  144   2HG1  VAL 854          2HG1      VAL 854   0.646   4.229  -2.112
  145   3HG1  VAL 854          3HG1      VAL 854   2.055   3.597  -2.998
  146   1HG2  VAL 854          1HG2      VAL 854  -0.168   6.804  -4.698
  147   2HG2  VAL 854          2HG2      VAL 854   0.132   6.681  -2.948
  148   3HG2  VAL 854          3HG2      VAL 854   1.466   7.092  -4.053
  149    H    ARG 855           H        ARG 855   4.416   4.404  -5.413
  150    HA   ARG 855           HA       ARG 855   4.118   1.464  -5.353
  151   1HB   ARG 855          1HB       ARG 855   6.220   1.377  -6.366
  152   2HB   ARG 855          2HB       ARG 855   5.551   2.885  -7.036
  153   1HG   ARG 855          1HG       ARG 855   6.665   4.024  -4.964
  154   2HG   ARG 855          2HG       ARG 855   7.621   2.526  -4.855
  155   1HD   ARG 855          1HD       ARG 855   8.661   4.406  -6.235
  156   2HD   ARG 855          2HD       ARG 855   8.525   2.833  -7.049
  157    HE   ARG 855           HE       ARG 855   6.731   3.687  -8.379
  158   1HH1  ARG 855          2HH2      ARG 855   8.206   6.057  -6.210
  159   2HH1  ARG 855          1HH2      ARG 855   7.562   7.442  -7.062
  160   1HH2  ARG 855          2HH1      ARG 855   5.879   5.517  -9.505
  161   2HH2  ARG 855          1HH1      ARG 855   6.235   7.134  -8.940
  162    H    LEU 856           H        LEU 856   3.609   1.166  -3.136
  163    HA   LEU 856           HA       LEU 856   5.712   2.015  -1.218
  164   1HB   LEU 856          1HB       LEU 856   4.067   2.172   0.341
  165   2HB   LEU 856          2HB       LEU 856   2.986   2.239  -1.072
  166    HG   LEU 856           HG       LEU 856   2.558  -0.134  -0.953
  167   1HD1  LEU 856          1HD1      LEU 856   5.029  -0.065   0.687
  168   2HD1  LEU 856          2HD1      LEU 856   3.763  -1.156   1.298
  169   3HD1  LEU 856          3HD1      LEU 856   4.388  -1.357  -0.356
  170   1HD2  LEU 856          1HD2      LEU 856   1.669   1.615   0.899
  171   2HD2  LEU 856          2HD2      LEU 856   1.227  -0.109   0.928
  172   3HD2  LEU 856          3HD2      LEU 856   2.535   0.492   1.975
  173    H    TYR 857           H        TYR 857   6.952   0.542  -0.135
  174    HA   TYR 857           HA       TYR 857   7.029  -2.153  -1.198
  175   1HB   TYR 857          1HB       TYR 857   9.151  -1.639  -0.643
  176   2HB   TYR 857          2HB       TYR 857   8.647  -0.401   0.520
  177    HD1  TYR 857           1HD      TYR 857   8.077  -4.114   0.364
  178    HD2  TYR 857           2HD      TYR 857   9.694  -0.789   2.549
  179    HE1  TYR 857           1HE      TYR 857   8.669  -5.631   2.234
  180    HE2  TYR 857           2HE      TYR 857  10.286  -2.306   4.420
  181    HH   TYR 857           HH       TYR 857   9.740  -4.492   5.338
  182    H    LEU 858           H        LEU 858   5.285  -3.401  -0.670
  183    HA   LEU 858           HA       LEU 858   4.140  -3.315   2.007
  184   1HB   LEU 858          1HB       LEU 858   2.806  -3.699  -0.080
  185   2HB   LEU 858          2HB       LEU 858   3.640  -5.259  -0.279
  186    HG   LEU 858           HG       LEU 858   2.412  -6.250   1.357
  187   1HD1  LEU 858          1HD1      LEU 858   1.807  -4.984   3.497
  188   2HD1  LEU 858          2HD1      LEU 858   3.548  -5.177   3.180
  189   3HD1  LEU 858          3HD1      LEU 858   2.751  -3.621   2.848
  190   1HD2  LEU 858          1HD2      LEU 858   0.582  -3.922   1.673
  191   2HD2  LEU 858          2HD2      LEU 858   0.862  -4.460  -0.001
  192   3HD2  LEU 858          3HD2      LEU 858   0.223  -5.602   1.206
  193    HA   PRO 859           HA       PRO 859   7.205  -6.260   3.435
  194   1HB   PRO 859          1HB       PRO 859   6.603  -6.056   6.084
  195   2HB   PRO 859          2HB       PRO 859   7.440  -4.738   5.200
  196   1HG   PRO 859          1HG       PRO 859   4.470  -4.977   5.762
  197   2HG   PRO 859          2HG       PRO 859   5.533  -3.574   6.107
  198   1HD   PRO 859          1HD       PRO 859   4.036  -3.698   3.833
  199   2HD   PRO 859          2HD       PRO 859   5.703  -3.049   3.787
  200    HA   PRO 860           HA       PRO 860   4.581  -9.813   3.580
  201   1HB   PRO 860          1HB       PRO 860   6.367 -11.674   4.456
  202   2HB   PRO 860          2HB       PRO 860   6.529 -10.890   2.851
  203   1HG   PRO 860          1HG       PRO 860   7.901 -10.092   5.434
  204   2HG   PRO 860          2HG       PRO 860   8.671 -10.402   3.843
  205   1HD   PRO 860          1HD       PRO 860   8.029  -7.877   4.643
  206   2HD   PRO 860          2HD       PRO 860   7.781  -8.381   2.944
  207    H    SER 861           H        SER 861   6.281  -8.483   6.348
  208    HA   SER 861           HA       SER 861   4.975 -10.227   8.285
  209   1HB   SER 861          1HB       SER 861   7.134  -8.313   8.228
  210   2HB   SER 861          2HB       SER 861   5.991  -7.877   9.521
  211    HG   SER 861           HG       SER 861   7.736  -9.531   9.926
  212    H    THR 862           H        THR 862   4.081  -7.504   6.428
  213    HA   THR 862           HA       THR 862   2.408  -6.173   8.348
  214    HB   THR 862           HB       THR 862   3.180  -5.895   5.583
  215    HG1  THR 862           1HG      THR 862   2.692  -3.796   6.068
  216   1HG2  THR 862          1HG2      THR 862   1.023  -5.098   4.674
  217   2HG2  THR 862          2HG2      THR 862   0.933  -6.824   5.096
  218   3HG2  THR 862          3HG2      THR 862   0.201  -5.607   6.169
  219    HA   PRO 863           HA       PRO 863  -0.991  -8.972   8.429
  220   1HB   PRO 863          1HB       PRO 863  -2.903  -7.331   9.466
  221   2HB   PRO 863          2HB       PRO 863  -1.468  -7.831  10.419
  222   1HG   PRO 863          1HG       PRO 863  -1.819  -5.272   8.833
  223   2HG   PRO 863          2HG       PRO 863  -1.317  -5.429  10.548
  224   1HD   PRO 863          1HD       PRO 863   0.517  -5.167   8.548
  225   2HD   PRO 863          2HD       PRO 863   0.817  -6.285   9.913
  226    H    ASP 864           H        ASP 864  -2.795  -9.508   7.168
  227    HA   ASP 864           HA       ASP 864  -4.266  -9.393   5.414
  228   1HB   ASP 864          1HB       ASP 864  -4.154  -6.700   6.458
  229   2HB   ASP 864          2HB       ASP 864  -4.308  -6.652   4.689
  230    H    PHE 865           H        PHE 865  -1.077  -8.925   5.310
  231    HA   PHE 865           HA       PHE 865  -0.236  -7.685   3.052
  232   1HB   PHE 865          1HB       PHE 865   1.053  -9.191   4.656
  233   2HB   PHE 865          2HB       PHE 865   0.513 -10.555   3.664
  234    HD1  PHE 865           1HD      PHE 865   2.019  -7.149   3.107
  235    HD2  PHE 865           2HD      PHE 865   2.034 -11.328   2.112
  236    HE1  PHE 865           1HE      PHE 865   3.916  -6.772   1.555
  237    HE2  PHE 865           2HE      PHE 865   3.931 -10.951   0.559
  238    HZ   PHE 865           HZ       PHE 865   4.872  -8.673   0.281
  239    H    SER 866           H        SER 866  -1.685 -10.990   3.100
  240    HA   SER 866           HA       SER 866  -1.652 -11.842   0.590
  241   1HB   SER 866          1HB       SER 866  -3.068 -13.051   1.995
  242   2HB   SER 866          2HB       SER 866  -3.975 -11.603   2.497
  243    HG   SER 866           HG       SER 866  -4.021 -12.854  -0.053
  244    H    ARG 867           H        ARG 867  -4.489  -9.782   1.378
  245    HA   ARG 867           HA       ARG 867  -4.844  -9.006  -1.352
  246   1HB   ARG 867          1HB       ARG 867  -5.901  -7.506   1.059
  247   2HB   ARG 867          2HB       ARG 867  -6.654  -7.717  -0.541
  248   1HG   ARG 867          1HG       ARG 867  -7.828  -9.360   0.542
  249   2HG   ARG 867          2HG       ARG 867  -6.370 -10.322   0.199
  250   1HD   ARG 867          1HD       ARG 867  -5.698  -8.954   2.527
  251   2HD   ARG 867          2HD       ARG 867  -7.416  -9.338   2.767
  252    HE   ARG 867           HE       ARG 867  -6.033 -11.643   1.787
  253   1HH1  ARG 867          2HH2      ARG 867  -6.399  -9.609   4.656
  254   2HH1  ARG 867          1HH2      ARG 867  -6.027 -10.895   5.783
  255   1HH2  ARG 867          2HH1      ARG 867  -5.543 -13.341   3.275
  256   2HH2  ARG 867          1HH1      ARG 867  -5.540 -13.023   4.995
  257    H    LEU 868           H        LEU 868  -3.431  -7.372   1.520
  258    HA   LEU 868           HA       LEU 868  -2.974  -4.845   0.708
  259   1HB   LEU 868          1HB       LEU 868  -1.296  -6.846   2.168
  260   2HB   LEU 868          2HB       LEU 868  -0.515  -5.326   1.669
  261    HG   LEU 868           HG       LEU 868  -2.762  -5.781   3.610
  262   1HD1  LEU 868          1HD1      LEU 868  -1.312  -3.440   4.167
  263   2HD1  LEU 868          2HD1      LEU 868  -1.071  -5.038   4.912
  264   3HD1  LEU 868          3HD1      LEU 868  -0.105  -4.562   3.494
  265   1HD2  LEU 868          1HD2      LEU 868  -3.328  -3.301   3.317
  266   2HD2  LEU 868          2HD2      LEU 868  -2.462  -3.383   1.764
  267   3HD2  LEU 868          3HD2      LEU 868  -3.909  -4.386   2.031
  268    H    ARG 869           H        ARG 869  -1.002  -7.664  -0.363
  269    HA   ARG 869           HA       ARG 869   0.663  -6.147  -2.115
  270   1HB   ARG 869          1HB       ARG 869   0.993  -8.522  -1.151
  271   2HB   ARG 869          2HB       ARG 869  -0.066  -9.065  -2.475
  272   1HG   ARG 869          1HG       ARG 869   1.813  -9.126  -3.742
  273   2HG   ARG 869          2HG       ARG 869   1.715  -7.349  -3.753
  274   1HD   ARG 869          1HD       ARG 869   3.871  -7.665  -2.940
  275   2HD   ARG 869          2HD       ARG 869   2.948  -7.571  -1.425
  276    HE   ARG 869           HE       ARG 869   3.255  -9.880  -1.087
  277   1HH1  ARG 869          2HH2      ARG 869   4.560  -8.781  -4.185
  278   2HH1  ARG 869          1HH2      ARG 869   5.485 -10.239  -4.468
  279   1HH2  ARG 869          2HH1      ARG 869   4.477 -11.805  -1.462
  280   2HH2  ARG 869          1HH1      ARG 869   5.437 -11.963  -2.915
  281    H    ARG 870           H        ARG 870  -1.371  -8.764  -3.400
  282    HA   ARG 870           HA       ARG 870  -1.738  -7.871  -5.926
  283   1HB   ARG 870          1HB       ARG 870  -2.666  -9.978  -5.062
  284   2HB   ARG 870          2HB       ARG 870  -3.892  -9.073  -4.141
  285   1HG   ARG 870          1HG       ARG 870  -4.961  -9.785  -6.171
  286   2HG   ARG 870          2HG       ARG 870  -4.624  -8.048  -6.366
  287   1HD   ARG 870          1HD       ARG 870  -3.490  -8.540  -8.246
  288   2HD   ARG 870          2HD       ARG 870  -2.291  -9.385  -7.243
  289    HE   ARG 870           HE       ARG 870  -4.232 -11.275  -7.534
  290   1HH1  ARG 870          2HH2      ARG 870  -2.534  -9.165  -9.807
  291   2HH1  ARG 870          1HH2      ARG 870  -2.631 -10.294 -11.140
  292   1HH2  ARG 870          2HH1      ARG 870  -4.360 -12.766  -9.295
  293   2HH2  ARG 870          1HH1      ARG 870  -3.672 -12.347 -10.848
  294    H    TYR 871           H        TYR 871  -4.104  -7.090  -3.306
  295    HA   TYR 871           HA       TYR 871  -5.732  -5.331  -4.595
  296   1HB   TYR 871          1HB       TYR 871  -5.702  -6.042  -2.140
  297   2HB   TYR 871          2HB       TYR 871  -4.549  -4.723  -1.874
  298    HD1  TYR 871           1HD      TYR 871  -5.623  -3.026  -0.714
  299    HD2  TYR 871           2HD      TYR 871  -7.662  -4.952  -3.968
  300    HE1  TYR 871           1HE      TYR 871  -7.505  -1.427  -0.482
  301    HE2  TYR 871           2HE      TYR 871  -9.543  -3.353  -3.736
  302    HH   TYR 871           HH       TYR 871 -10.222  -1.575  -1.191
  303    H    PHE 872           H        PHE 872  -3.035  -4.000  -2.616
  304    HA   PHE 872           HA       PHE 872  -2.951  -1.466  -3.610
  305   1HB   PHE 872          1HB       PHE 872  -1.482  -2.482  -1.844
  306   2HB   PHE 872          2HB       PHE 872  -0.497  -3.187  -3.137
  307    HD1  PHE 872           1HD      PHE 872  -0.665  -0.548  -0.891
  308    HD2  PHE 872           2HD      PHE 872   0.153  -1.330  -5.035
  309    HE1  PHE 872           1HE      PHE 872   0.651   1.550  -1.028
  310    HE2  PHE 872           2HE      PHE 872   1.469   0.768  -5.171
  311    HZ   PHE 872           HZ       PHE 872   1.719   2.208  -3.167
  312    H    VAL 873           H        VAL 873  -0.184  -3.305  -4.768
  313    HA   VAL 873           HA       VAL 873   0.355  -2.119  -7.082
  314    HB   VAL 873           HB       VAL 873   1.713  -3.940  -6.828
  315   1HG1  VAL 873          1HG1      VAL 873   0.483  -4.895  -4.956
  316   2HG1  VAL 873          2HG1      VAL 873  -0.791  -5.490  -6.047
  317   3HG1  VAL 873          3HG1      VAL 873   0.842  -6.194  -6.119
  318   1HG2  VAL 873          1HG2      VAL 873  -0.275  -5.559  -8.399
  319   2HG2  VAL 873          2HG2      VAL 873   0.322  -4.039  -9.107
  320   3HG2  VAL 873          3HG2      VAL 873   1.469  -5.329  -8.671
  321    H    ALA 874           H        ALA 874  -2.416  -4.331  -6.614
  322    HA   ALA 874           HA       ALA 874  -3.270  -4.466  -9.298
  323   1HB   ALA 874          1HB       ALA 874  -5.561  -4.836  -8.181
  324   2HB   ALA 874          2HB       ALA 874  -4.251  -5.955  -7.732
  325   3HB   ALA 874          3HB       ALA 874  -4.706  -4.631  -6.633
  326    H    PHE 875           H        PHE 875  -4.004  -2.094  -6.704
  327    HA   PHE 875           HA       PHE 875  -5.962  -0.575  -7.904
  328   1HB   PHE 875          1HB       PHE 875  -3.521   0.471  -6.431
  329   2HB   PHE 875          2HB       PHE 875  -5.062   1.320  -6.639
  330    HD1  PHE 875           1HD      PHE 875  -4.716   1.437  -4.038
  331    HD2  PHE 875           2HD      PHE 875  -5.628  -2.158  -6.205
  332    HE1  PHE 875           1HE      PHE 875  -5.565   0.396  -1.953
  333    HE2  PHE 875           2HE      PHE 875  -6.478  -3.199  -4.120
  334    HZ   PHE 875           HZ       PHE 875  -6.447  -1.922  -1.994
  335    H    ASP 876           H        ASP 876  -2.429  -0.460  -8.525
  336    HA   ASP 876           HA       ASP 876  -2.209  -0.090 -11.115
  337   1HB   ASP 876          1HB       ASP 876  -3.726   2.240 -10.037
  338   2HB   ASP 876          2HB       ASP 876  -2.457   2.600 -11.228
  339    H    GLY 877           H        GLY 877  -1.062   0.129  -8.141
  340   1HA   GLY 877          1HA       GLY 877   1.175   1.980  -8.746
  341   2HA   GLY 877          2HA       GLY 877   0.762   1.303  -7.154
  342    H    ASP 878           H        ASP 878   2.722   0.343  -6.656
  343    HA   ASP 878           HA       ASP 878   3.268  -2.183  -7.992
  344   1HB   ASP 878          1HB       ASP 878   4.773   0.245  -8.657
  345   2HB   ASP 878          2HB       ASP 878   5.812  -1.056  -8.038
  346    H    LEU 879           H        LEU 879   4.914  -3.434  -6.821
  347    HA   LEU 879           HA       LEU 879   5.447  -2.367  -4.094
  348   1HB   LEU 879          1HB       LEU 879   4.634  -5.231  -4.685
  349   2HB   LEU 879          2HB       LEU 879   4.771  -4.431  -3.101
  350    HG   LEU 879           HG       LEU 879   2.699  -3.969  -5.273
  351   1HD1  LEU 879          1HD1      LEU 879   1.795  -5.551  -3.860
  352   2HD1  LEU 879          2HD1      LEU 879   2.800  -5.047  -2.481
  353   3HD1  LEU 879          3HD1      LEU 879   1.366  -4.094  -2.931
  354   1HD2  LEU 879          1HD2      LEU 879   2.117  -2.255  -3.139
  355   2HD2  LEU 879          2HD2      LEU 879   3.869  -2.056  -3.382
  356   3HD2  LEU 879          3HD2      LEU 879   2.745  -1.772  -4.733
  357    H    VAL 880           H        VAL 880   7.561  -2.423  -3.632
  358    HA   VAL 880           HA       VAL 880   9.278  -4.237  -5.245
  359    HB   VAL 880           HB       VAL 880  10.644  -2.229  -3.618
  360   1HG1  VAL 880          1HG1      VAL 880  10.464  -2.416  -6.639
  361   2HG1  VAL 880          2HG1      VAL 880  11.835  -1.881  -5.638
  362   3HG1  VAL 880          3HG1      VAL 880  11.389  -3.604  -5.690
  363   1HG2  VAL 880          1HG2      VAL 880   8.973  -0.655  -3.831
  364   2HG2  VAL 880          2HG2      VAL 880   9.729  -0.451  -5.430
  365   3HG2  VAL 880          3HG2      VAL 880   8.264  -1.447  -5.259
  366    H    GLN 881           H        GLN 881  10.636  -5.702  -4.260
  367    HA   GLN 881           HA       GLN 881   9.907  -6.610  -1.649
  368   1HB   GLN 881          1HB       GLN 881  12.427  -7.253  -3.223
  369   2HB   GLN 881          2HB       GLN 881  11.646  -8.250  -1.973
  370   1HG   GLN 881          1HG       GLN 881  10.261  -9.162  -3.493
  371   2HG   GLN 881          2HG       GLN 881   9.721  -7.553  -4.021
  372   1HE2  GLN 881          1HE2      GLN 881  10.986 -10.359  -5.153
  373   2HE2  GLN 881          2HE2      GLN 881  11.921  -9.766  -6.508
  374    H    GLU 882           H        GLU 882  10.721  -6.153   0.335
  375    HA   GLU 882           HA       GLU 882  11.867  -3.917   1.160
  376   1HB   GLU 882          1HB       GLU 882  11.365  -5.866   2.617
  377   2HB   GLU 882          2HB       GLU 882  12.865  -6.647   2.063
  378   1HG   GLU 882          1HG       GLU 882  13.884  -4.261   2.787
  379   2HG   GLU 882          2HG       GLU 882  12.483  -4.298   3.880
  380    H    PHE 883           H        PHE 883  14.122  -6.665   0.551
  381    HA   PHE 883           HA       PHE 883  16.388  -4.948   0.299
  382   1HB   PHE 883          1HB       PHE 883  17.565  -6.935  -0.338
  383   2HB   PHE 883          2HB       PHE 883  16.401  -7.375   0.923
  384    HD1  PHE 883           1HD      PHE 883  14.407  -8.707   0.388
  385    HD2  PHE 883           2HD      PHE 883  17.335  -7.752  -2.605
  386    HE1  PHE 883           1HE      PHE 883  13.467 -10.462  -1.091
  387    HE2  PHE 883           2HE      PHE 883  16.396  -9.507  -4.085
  388    HZ   PHE 883           HZ       PHE 883  14.462 -10.862  -3.328
  389    H    ASP 884           H        ASP 884  13.862  -4.624  -1.528
  390    HA   ASP 884           HA       ASP 884  15.450  -4.021  -3.938
  391   1HB   ASP 884          1HB       ASP 884  12.969  -5.778  -3.911
  392   2HB   ASP 884          2HB       ASP 884  13.692  -5.077  -5.375
  393    H    MET 885           H        MET 885  15.157  -1.822  -3.447
  394    HA   MET 885           HA       MET 885  12.459  -0.827  -4.098
  395   1HB   MET 885          1HB       MET 885  13.029   0.861  -2.067
  396   2HB   MET 885          2HB       MET 885  12.071  -0.623  -1.851
  397   1HG   MET 885          1HG       MET 885  14.311  -1.808  -1.435
  398   2HG   MET 885          2HG       MET 885  15.018  -0.189  -1.295
  399   1HE   MET 885          1HE       MET 885  12.355  -2.549   1.467
  400   2HE   MET 885          2HE       MET 885  11.338  -1.462   0.490
  401   3HE   MET 885          3HE       MET 885  12.439  -2.608  -0.311
  402    H    THR 886           H        THR 886  15.922  -0.265  -3.473
  403    HA   THR 886           HA       THR 886  16.770   2.071  -3.923
  404    HB   THR 886           HB       THR 886  18.329   1.412  -5.565
  405    HG1  THR 886           1HG      THR 886  17.773   0.312  -7.283
  406   1HG2  THR 886          1HG2      THR 886  18.036  -0.134  -3.491
  407   2HG2  THR 886          2HG2      THR 886  17.331  -1.296  -4.640
  408   3HG2  THR 886          3HG2      THR 886  19.008  -0.740  -4.853
  409    H    SER 887           H        SER 887  14.889   0.581  -6.619
  410    HA   SER 887           HA       SER 887  14.460   3.282  -7.739
  411   1HB   SER 887          1HB       SER 887  14.495   0.508  -8.739
  412   2HB   SER 887          2HB       SER 887  13.144   1.481  -9.370
  413    HG   SER 887           HG       SER 887  15.865   2.293  -9.346
  414    H    ALA 888           H        ALA 888  12.969   1.006  -5.654
  415    HA   ALA 888           HA       ALA 888  10.275   1.094  -6.205
  416   1HB   ALA 888          1HB       ALA 888  10.926  -0.169  -4.335
  417   2HB   ALA 888          2HB       ALA 888  11.840   1.181  -3.621
  418   3HB   ALA 888          3HB       ALA 888  10.060   1.206  -3.607
  419    H    THR 889           H        THR 889   8.675   2.422  -4.619
  420    HA   THR 889           HA       THR 889   9.442   5.292  -4.823
  421    HB   THR 889           HB       THR 889   7.724   4.114  -6.574
  422    HG1  THR 889           1HG      THR 889   6.825   6.300  -6.679
  423   1HG2  THR 889          1HG2      THR 889   5.819   5.407  -4.640
  424   2HG2  THR 889          2HG2      THR 889   5.511   4.166  -5.877
  425   3HG2  THR 889          3HG2      THR 889   6.302   3.720  -4.346
  426    H    HIS 890           H        HIS 890   7.330   2.789  -3.370
  427    HA   HIS 890           HA       HIS 890   7.171   4.520  -0.949
  428   1HB   HIS 890          1HB       HIS 890   5.038   2.908  -2.358
  429   2HB   HIS 890          2HB       HIS 890   4.911   3.295  -0.632
  430    HD1  HIS 890           1HD      HIS 890   6.141   5.724  -3.389
  431    HD2  HIS 890           2HD      HIS 890   3.005   5.096  -0.653
  432    HE1  HIS 890           1HE      HIS 890   4.673   7.817  -3.460
  433    H    VAL 891           H        VAL 891   6.765   3.254   1.065
  434    HA   VAL 891           HA       VAL 891   7.500   0.413   0.939
  435    HB   VAL 891           HB       VAL 891   9.316   0.874   2.699
  436   1HG1  VAL 891          1HG1      VAL 891   9.331   0.967  -0.186
  437   2HG1  VAL 891          2HG1      VAL 891  10.582   2.069   0.437
  438   3HG1  VAL 891          3HG1      VAL 891  10.589   0.354   0.914
  439   1HG2  VAL 891          1HG2      VAL 891   8.736   3.196   3.200
  440   2HG2  VAL 891          2HG2      VAL 891  10.364   3.143   2.482
  441   3HG2  VAL 891          3HG2      VAL 891   8.972   3.654   1.496
  442    H    LEU 892           H        LEU 892   6.213  -0.634   2.331
  443    HA   LEU 892           HA       LEU 892   4.598   0.854   4.221
  444   1HB   LEU 892          1HB       LEU 892   4.432  -1.592   2.864
  445   2HB   LEU 892          2HB       LEU 892   4.629  -2.045   4.574
  446    HG   LEU 892           HG       LEU 892   2.801   0.216   4.270
  447   1HD1  LEU 892          1HD1      LEU 892   1.018  -1.593   3.365
  448   2HD1  LEU 892          2HD1      LEU 892   1.917  -0.515   2.271
  449   3HD1  LEU 892          3HD1      LEU 892   2.466  -2.190   2.519
  450   1HD2  LEU 892          1HD2      LEU 892   3.021  -1.205   6.281
  451   2HD2  LEU 892          2HD2      LEU 892   1.364  -1.274   5.635
  452   3HD2  LEU 892          3HD2      LEU 892   2.490  -2.621   5.343
  453    H    GLY 893           H        GLY 893   5.155   1.402   6.242
  454   1HA   GLY 893          1HA       GLY 893   6.371   1.509   8.192
  455   2HA   GLY 893          2HA       GLY 893   6.279  -0.267   8.162
  456    H    SER 894           H        SER 894   8.361   2.390   8.138
  457    HA   SER 894           HA       SER 894  10.678   2.359   8.193
  458   1HB   SER 894          1HB       SER 894  10.384  -0.458   7.076
  459   2HB   SER 894          2HB       SER 894  11.916   0.300   7.573
  460    HG   SER 894           HG       SER 894  11.387   0.057   9.600
  461    H    ARG 895           H        ARG 895  12.490   2.454   6.554
  462    HA   ARG 895           HA       ARG 895  11.538   2.527   3.758
  463   1HB   ARG 895          1HB       ARG 895  12.566   4.822   3.520
  464   2HB   ARG 895          2HB       ARG 895  11.085   4.776   4.506
  465   1HG   ARG 895          1HG       ARG 895  12.313   4.932   6.545
  466   2HG   ARG 895          2HG       ARG 895  13.852   4.549   5.738
  467   1HD   ARG 895          1HD       ARG 895  12.791   6.805   4.386
  468   2HD   ARG 895          2HD       ARG 895  12.573   7.126   6.120
  469    HE   ARG 895           HE       ARG 895  15.209   6.112   5.613
  470   1HH1  ARG 895          2HH2      ARG 895  13.169   8.977   5.250
  471   2HH1  ARG 895          1HH2      ARG 895  14.506  10.104   5.310
  472   1HH2  ARG 895          2HH1      ARG 895  16.974   7.601   5.693
  473   2HH2  ARG 895          1HH1      ARG 895  16.675   9.319   5.563
  474    H    ASP 896           H        ASP 896  14.129   2.633   6.182
  475    HA   ASP 896           HA       ASP 896  16.490   2.811   5.212
  476   1HB   ASP 896          1HB       ASP 896  16.437   1.472   7.113
  477   2HB   ASP 896          2HB       ASP 896  15.286   0.321   6.399
  478    H    LYS 897           H        LYS 897  15.133  -0.392   4.322
  479    HA   LYS 897           HA       LYS 897  16.674  -1.105   2.260
  480   1HB   LYS 897          1HB       LYS 897  14.056  -1.468   1.226
  481   2HB   LYS 897          2HB       LYS 897  15.035  -2.634   2.149
  482   1HG   LYS 897          1HG       LYS 897  13.073  -2.429   3.446
  483   2HG   LYS 897          2HG       LYS 897  14.208  -1.316   4.247
  484   1HD   LYS 897          1HD       LYS 897  13.228   0.496   2.663
  485   2HD   LYS 897          2HD       LYS 897  11.903  -0.660   2.390
  486   1HE   LYS 897          1HE       LYS 897  12.059  -0.763   5.099
  487   2HE   LYS 897          2HE       LYS 897  12.609   0.905   4.830
  488   1HZ   LYS 897          1HZ       LYS 897  10.632   1.450   3.850
  489   2HZ   LYS 897          2HZ       LYS 897  10.200  -0.111   3.538
  490   3HZ   LYS 897          3HZ       LYS 897  10.152   0.465   5.083
  491    H    ASN 898           H        ASN 898  14.315   1.553   2.170
  492    HA   ASN 898           HA       ASN 898  15.675   2.672  -0.152
  493   1HB   ASN 898          1HB       ASN 898  13.465   0.957  -0.575
  494   2HB   ASN 898          2HB       ASN 898  12.847   2.611  -0.779
  495   1HD2  ASN 898          1HD2      ASN 898  12.681   2.804  -2.977
  496   2HD2  ASN 898          2HD2      ASN 898  14.017   2.595  -4.089
  497    HA   PRO 899           HA       PRO 899  14.149   5.855   2.701
  498   1HB   PRO 899          1HB       PRO 899  16.176   7.620   2.258
  499   2HB   PRO 899          2HB       PRO 899  16.406   6.147   3.254
  500   1HG   PRO 899          1HG       PRO 899  17.052   6.496   0.313
  501   2HG   PRO 899          2HG       PRO 899  18.141   5.885   1.601
  502   1HD   PRO 899          1HD       PRO 899  16.736   4.182   0.003
  503   2HD   PRO 899          2HD       PRO 899  16.927   3.838   1.749
  504    H    ALA 900           H        ALA 900  14.639   5.594  -0.696
  505    HA   ALA 900           HA       ALA 900  13.644   8.297  -1.281
  506   1HB   ALA 900          1HB       ALA 900  13.762   7.291  -3.680
  507   2HB   ALA 900          2HB       ALA 900  15.285   7.598  -2.813
  508   3HB   ALA 900          3HB       ALA 900  14.632   5.945  -2.905
  509    H    ALA 901           H        ALA 901  12.283   5.469  -0.221
  510    HA   ALA 901           HA       ALA 901   9.911   5.613  -1.976
  511   1HB   ALA 901          1HB       ALA 901  10.632   3.731   0.306
  512   2HB   ALA 901          2HB       ALA 901   9.223   3.574  -0.770
  513   3HB   ALA 901          3HB       ALA 901  10.869   3.404  -1.427
  514    H    GLN 902           H        GLN 902   8.106   4.656   0.117
  515    HA   GLN 902           HA       GLN 902   7.904   7.116   1.787
  516   1HB   GLN 902          1HB       GLN 902   5.891   5.781  -0.008
  517   2HB   GLN 902          2HB       GLN 902   5.331   6.592   1.474
  518   1HG   GLN 902          1HG       GLN 902   6.991   7.824  -0.763
  519   2HG   GLN 902          2HG       GLN 902   5.291   8.177  -0.387
  520   1HE2  GLN 902          1HE2      GLN 902   5.873   7.947   2.576
  521   2HE2  GLN 902          2HE2      GLN 902   6.649   9.458   3.000
  522    H    GLN 903           H        GLN 903   7.536   6.767   3.919
  523    HA   GLN 903           HA       GLN 903   7.413   3.968   4.809
  524   1HB   GLN 903          1HB       GLN 903   7.880   6.640   6.162
  525   2HB   GLN 903          2HB       GLN 903   7.635   5.141   7.090
  526   1HG   GLN 903          1HG       GLN 903   9.771   4.542   6.728
  527   2HG   GLN 903          2HG       GLN 903   9.507   4.613   4.972
  528   1HE2  GLN 903          1HE2      GLN 903   9.983   6.559   3.818
  529   2HE2  GLN 903          2HE2      GLN 903  11.023   7.788   4.506
  530    H    VAL 904           H        VAL 904   5.132   4.075   3.661
  531    HA   VAL 904           HA       VAL 904   3.064   5.320   5.315
  532    HB   VAL 904           HB       VAL 904   1.787   5.081   3.468
  533   1HG1  VAL 904          1HG1      VAL 904   4.284   5.454   2.656
  534   2HG1  VAL 904          2HG1      VAL 904   4.090   3.815   1.991
  535   3HG1  VAL 904          3HG1      VAL 904   2.996   5.120   1.474
  536   1HG2  VAL 904          1HG2      VAL 904   1.187   2.809   3.881
  537   2HG2  VAL 904          2HG2      VAL 904   1.756   2.841   2.195
  538   3HG2  VAL 904          3HG2      VAL 904   2.821   2.225   3.481
  539    H    SER 905           H        SER 905   1.114   3.849   5.883
  540    HA   SER 905           HA       SER 905   2.112   1.239   6.910
  541   1HB   SER 905          1HB       SER 905   1.579   3.493   8.472
  542   2HB   SER 905          2HB       SER 905   0.096   2.517   8.604
  543    HG   SER 905           HG       SER 905   2.756   1.617   9.037
  544    HA   PRO 906           HA       PRO 906  -1.801  -0.503   5.823
  545   1HB   PRO 906          1HB       PRO 906  -3.115  -1.341   8.058
  546   2HB   PRO 906          2HB       PRO 906  -1.532  -2.034   7.575
  547   1HG   PRO 906          1HG       PRO 906  -2.031   0.199   9.564
  548   2HG   PRO 906          2HG       PRO 906  -1.068  -1.292   9.822
  549   1HD   PRO 906          1HD       PRO 906   0.112   1.054   9.092
  550   2HD   PRO 906          2HD       PRO 906   0.667  -0.497   8.392
  551    H    GLU 907           H        GLU 907  -1.983   2.089   8.223
  552    HA   GLU 907           HA       GLU 907  -4.809   2.581   7.891
  553   1HB   GLU 907          1HB       GLU 907  -2.474   3.988   9.174
  554   2HB   GLU 907          2HB       GLU 907  -4.004   4.864   8.932
  555   1HG   GLU 907          1HG       GLU 907  -3.877   3.736  11.159
  556   2HG   GLU 907          2HG       GLU 907  -5.230   3.154  10.166
  557    H    TRP 908           H        TRP 908  -1.846   3.550   6.241
  558    HA   TRP 908           HA       TRP 908  -2.948   5.832   4.895
  559   1HB   TRP 908          1HB       TRP 908  -0.544   5.448   5.182
  560   2HB   TRP 908          2HB       TRP 908  -0.645   3.988   4.188
  561    HD1  TRP 908           HD       TRP 908  -0.877   7.805   3.920
  562    HE1  TRP 908           1HE      TRP 908  -0.374   8.532   1.531
  563    HE3  TRP 908           3HE      TRP 908  -0.594   3.195   1.714
  564    HZ2  TRP 908           2HZ      TRP 908   0.094   7.275  -1.033
  565    HZ3  TRP 908           3HZ      TRP 908  -0.119   3.000  -0.699
  566    HH2  TRP 908           HH       TRP 908   0.226   5.025  -2.084
  567    H    ILE 909           H        ILE 909  -2.501   2.381   3.985
  568    HA   ILE 909           HA       ILE 909  -3.447   2.513   1.360
  569    HB   ILE 909           HB       ILE 909  -3.316   0.430   3.504
  570   1HG1  ILE 909          1HG1      ILE 909  -2.511  -0.413   0.884
  571   2HG1  ILE 909          2HG1      ILE 909  -1.893   1.237   1.141
  572   1HG2  ILE 909          1HG2      ILE 909  -4.342  -1.132   1.645
  573   2HG2  ILE 909          2HG2      ILE 909  -5.427  -0.237   2.736
  574   3HG2  ILE 909          3HG2      ILE 909  -5.128   0.364   1.088
  575   1HD1  ILE 909          1HD1      ILE 909  -1.631  -0.794   3.355
  576   2HD1  ILE 909          2HD1      ILE 909  -0.500  -0.854   1.982
  577   3HD1  ILE 909          3HD1      ILE 909  -0.606   0.613   2.984
  578    H    TRP 910           H        TRP 910  -5.325   1.880   4.379
  579    HA   TRP 910           HA       TRP 910  -7.855   1.790   3.087
  580   1HB   TRP 910          1HB       TRP 910  -7.386   2.753   5.908
  581   2HB   TRP 910          2HB       TRP 910  -8.763   1.849   5.262
  582    HD1  TRP 910           HD       TRP 910  -6.116   1.308   7.516
  583    HE1  TRP 910           1HE      TRP 910  -5.348  -1.115   7.672
  584    HE3  TRP 910           3HE      TRP 910  -8.211  -0.482   3.202
  585    HZ2  TRP 910           2HZ      TRP 910  -5.604  -3.544   6.119
  586    HZ3  TRP 910           3HZ      TRP 910  -7.927  -2.852   2.575
  587    HH2  TRP 910           HH       TRP 910  -6.630  -4.392   4.018
  588    H    ALA 911           H        ALA 911  -6.353   4.437   5.035
  589    HA   ALA 911           HA       ALA 911  -8.295   6.383   4.538
  590   1HB   ALA 911          1HB       ALA 911  -6.243   6.418   6.104
  591   2HB   ALA 911          2HB       ALA 911  -5.328   6.981   4.685
  592   3HB   ALA 911          3HB       ALA 911  -6.689   7.945   5.306
  593    H    CYS 912           H        CYS 912  -5.596   5.258   2.521
  594    HA   CYS 912           HA       CYS 912  -5.853   7.388   0.580
  595   1HB   CYS 912          1HB       CYS 912  -4.499   4.661   0.490
  596   2HB   CYS 912          2HB       CYS 912  -4.340   5.916  -0.764
  597    HG   CYS 912           HG       CYS 912  -4.053   7.032   2.215
  598    H    ILE 913           H        ILE 913  -6.279   3.844   0.085
  599    HA   ILE 913           HA       ILE 913  -7.771   3.942  -2.224
  600    HB   ILE 913           HB       ILE 913  -6.980   1.855  -1.268
  601   1HG1  ILE 913          1HG1      ILE 913 -10.005   1.703  -1.135
  602   2HG1  ILE 913          2HG1      ILE 913  -9.160   2.003  -2.673
  603   1HG2  ILE 913          1HG2      ILE 913  -7.214   1.428   0.932
  604   2HG2  ILE 913          2HG2      ILE 913  -8.164   2.923   1.107
  605   3HG2  ILE 913          3HG2      ILE 913  -8.984   1.385   0.746
  606   1HD1  ILE 913          1HD1      ILE 913  -8.352  -0.295  -0.870
  607   2HD1  ILE 913          2HD1      ILE 913  -9.695  -0.464  -2.027
  608   3HD1  ILE 913          3HD1      ILE 913  -8.057  -0.086  -2.613
  609    H    ARG 914           H        ARG 914  -8.816   4.643   1.085
  610    HA   ARG 914           HA       ARG 914 -11.641   4.649   0.441
  611   1HB   ARG 914          1HB       ARG 914 -10.741   4.207   2.720
  612   2HB   ARG 914          2HB       ARG 914 -10.137   5.880   2.785
  613   1HG   ARG 914          1HG       ARG 914 -12.701   6.372   2.074
  614   2HG   ARG 914          2HG       ARG 914 -12.938   4.847   2.960
  615   1HD   ARG 914          1HD       ARG 914 -12.452   5.797   4.965
  616   2HD   ARG 914          2HD       ARG 914 -11.104   6.741   4.294
  617    HE   ARG 914           HE       ARG 914 -13.541   7.846   3.344
  618   1HH1  ARG 914          2HH2      ARG 914 -11.697   7.436   6.332
  619   2HH1  ARG 914          1HH2      ARG 914 -12.326   8.886   7.081
  620   1HH2  ARG 914          2HH1      ARG 914 -14.373   9.762   4.333
  621   2HH2  ARG 914          1HH1      ARG 914 -13.852  10.213   5.941
  622    H    LYS 915           H        LYS 915  -8.971   6.964   0.386
  623    HA   LYS 915           HA       LYS 915 -10.828   9.213  -0.041
  624   1HB   LYS 915          1HB       LYS 915  -7.804   9.002   0.188
  625   2HB   LYS 915          2HB       LYS 915  -8.675  10.523  -0.121
  626   1HG   LYS 915          1HG       LYS 915  -9.445   8.755   2.212
  627   2HG   LYS 915          2HG       LYS 915  -8.083   9.893   2.351
  628   1HD   LYS 915          1HD       LYS 915  -9.527  11.770   1.776
  629   2HD   LYS 915          2HD       LYS 915 -10.888  10.671   1.449
  630   1HE   LYS 915          1HE       LYS 915 -11.250  11.536   3.651
  631   2HE   LYS 915          2HE       LYS 915 -10.659   9.873   3.863
  632   1HZ   LYS 915          1HZ       LYS 915  -9.536  12.264   4.764
  633   2HZ   LYS 915          2HZ       LYS 915  -9.083  10.713   5.093
  634   3HZ   LYS 915          3HZ       LYS 915  -8.458  11.494   3.781
  635    H    ARG 916           H        ARG 916  -9.720   6.731  -1.886
  636    HA   ARG 916           HA       ARG 916  -9.379   6.411  -4.129
  637   1HB   ARG 916          1HB       ARG 916 -11.225   8.798  -4.013
  638   2HB   ARG 916          2HB       ARG 916 -10.634   8.193  -5.579
  639   1HG   ARG 916          1HG       ARG 916 -12.767   7.114  -5.037
  640   2HG   ARG 916          2HG       ARG 916 -11.457   5.911  -4.967
  641   1HD   ARG 916          1HD       ARG 916 -12.911   5.647  -3.020
  642   2HD   ARG 916          2HD       ARG 916 -11.322   6.248  -2.500
  643    HE   ARG 916           HE       ARG 916 -12.622   8.570  -2.741
  644   1HH1  ARG 916          2HH2      ARG 916 -13.692   5.484  -1.386
  645   2HH1  ARG 916          1HH2      ARG 916 -14.787   6.214  -0.233
  646   1HH2  ARG 916          2HH1      ARG 916 -14.069   9.534  -1.219
  647   2HH2  ARG 916          1HH1      ARG 916 -15.001   8.523  -0.138
  648    H    ARG 917           H        ARG 917  -7.740   8.574  -2.440
  649    HA   ARG 917           HA       ARG 917  -5.962   9.201  -4.681
  650   1HB   ARG 917          1HB       ARG 917  -6.109  11.519  -4.595
  651   2HB   ARG 917          2HB       ARG 917  -7.810  11.061  -4.338
  652   1HG   ARG 917          1HG       ARG 917  -7.420  12.608  -2.607
  653   2HG   ARG 917          2HG       ARG 917  -7.166  11.042  -1.800
  654   1HD   ARG 917          1HD       ARG 917  -5.087  11.702  -1.255
  655   2HD   ARG 917          2HD       ARG 917  -4.683  11.747  -2.985
  656    HE   ARG 917           HE       ARG 917  -6.079  14.130  -2.068
  657   1HH1  ARG 917          2HH2      ARG 917  -2.957  12.497  -2.361
  658   2HH1  ARG 917          1HH2      ARG 917  -2.026  13.978  -2.343
  659   1HH2  ARG 917          2HH1      ARG 917  -4.850  16.086  -2.044
  660   2HH2  ARG 917          1HH1      ARG 917  -3.105  16.024  -2.163
  661    H    LEU 918           H        LEU 918  -3.950   8.796  -3.989
  662    HA   LEU 918           HA       LEU 918  -3.186   7.900  -1.537
  663   1HB   LEU 918          1HB       LEU 918  -1.735   9.534  -3.621
  664   2HB   LEU 918          2HB       LEU 918  -0.910   9.050  -2.119
  665    HG   LEU 918           HG       LEU 918  -0.483   7.079  -3.147
  666   1HD1  LEU 918          1HD1      LEU 918  -2.411   5.468  -3.254
  667   2HD1  LEU 918          2HD1      LEU 918  -2.302   6.336  -1.703
  668   3HD1  LEU 918          3HD1      LEU 918  -3.511   6.826  -2.914
  669   1HD2  LEU 918          1HD2      LEU 918  -0.844   7.981  -5.351
  670   2HD2  LEU 918          2HD2      LEU 918  -1.710   6.427  -5.283
  671   3HD2  LEU 918          3HD2      LEU 918  -2.611   7.955  -5.137
  672    H    VAL 919           H        VAL 919  -3.131   8.662   0.491
  673    HA   VAL 919           HA       VAL 919  -3.455  11.586   0.869
  674    HB   VAL 919           HB       VAL 919  -4.581  11.092   2.817
  675   1HG1  VAL 919          1HG1      VAL 919  -5.336   8.422   2.271
  676   2HG1  VAL 919          2HG1      VAL 919  -6.184   9.903   1.765
  677   3HG1  VAL 919          3HG1      VAL 919  -4.983   9.152   0.686
  678   1HG2  VAL 919          1HG2      VAL 919  -2.416   9.143   3.085
  679   2HG2  VAL 919          2HG2      VAL 919  -3.359   9.967   4.350
  680   3HG2  VAL 919          3HG2      VAL 919  -3.975   8.468   3.616
  681    H    ALA 920           H        ALA 920  -2.517  11.608   3.576
  682    HA   ALA 920           HA       ALA 920   0.303  11.970   3.065
  683   1HB   ALA 920          1HB       ALA 920  -0.023  13.397   4.765
  684   2HB   ALA 920          2HB       ALA 920  -1.652  12.733   5.041
  685   3HB   ALA 920          3HB       ALA 920  -0.246  12.011   5.859
  686    HA   PRO 921           HA       PRO 921   1.220   7.686   3.998
  687   1HB   PRO 921          1HB       PRO 921   3.827   7.757   3.211
  688   2HB   PRO 921          2HB       PRO 921   2.481   7.822   2.028
  689   1HG   PRO 921          1HG       PRO 921   4.009  10.162   3.203
  690   2HG   PRO 921          2HG       PRO 921   3.710   9.819   1.468
  691   1HD   PRO 921          1HD       PRO 921   2.114  11.522   2.876
  692   2HD   PRO 921          2HD       PRO 921   1.405  10.390   1.685
  693    H    CYS 922           H        CYS 922   1.746   6.904   5.968
  694    HA   CYS 922           HA       CYS 922   4.021   7.778   7.463
  695   1HB   CYS 922          1HB       CYS 922   2.236   9.696   7.691
  696   2HB   CYS 922          2HB       CYS 922   1.431   8.558   8.801
  697    HG   CYS 922           HG       CYS 922   4.628   8.699   9.074
  Start of MODEL    5
    1    H    GLY 835           H        GLY 835  -9.337  -0.853  11.407
    2   1HA   GLY 835          1HA       GLY 835  -7.773  -2.636   9.668
    3   2HA   GLY 835          2HA       GLY 835  -8.434  -3.358  11.152
    4    H    SER 836           H        SER 836  -9.794  -0.845   8.965
    5    HA   SER 836           HA       SER 836 -12.372  -2.173   8.981
    6   1HB   SER 836          1HB       SER 836 -12.851  -0.310   7.257
    7   2HB   SER 836          2HB       SER 836 -12.440   0.191   8.915
    8    HG   SER 836           HG       SER 836 -11.033   1.348   7.826
    9    H    ALA 837           H        ALA 837  -9.587  -3.045   7.531
   10    HA   ALA 837           HA       ALA 837  -9.807  -3.314   4.853
   11   1HB   ALA 837          1HB       ALA 837  -8.181  -4.428   6.560
   12   2HB   ALA 837          2HB       ALA 837  -9.322  -5.793   6.513
   13   3HB   ALA 837          3HB       ALA 837  -8.507  -5.263   5.022
   14    H    ASP 838           H        ASP 838 -11.181  -5.904   6.956
   15    HA   ASP 838           HA       ASP 838 -12.719  -7.182   5.064
   16   1HB   ASP 838          1HB       ASP 838 -12.426  -7.961   7.375
   17   2HB   ASP 838          2HB       ASP 838 -13.426  -6.618   7.968
   18    H    GLU 839           H        GLU 839 -13.488  -4.189   6.860
   19    HA   GLU 839           HA       GLU 839 -16.163  -4.015   5.744
   20   1HB   GLU 839          1HB       GLU 839 -14.548  -2.666   7.743
   21   2HB   GLU 839          2HB       GLU 839 -15.332  -1.481   6.672
   22   1HG   GLU 839          1HG       GLU 839 -17.161  -3.646   7.332
   23   2HG   GLU 839          2HG       GLU 839 -16.517  -2.898   8.809
   24    H    THR 840           H        THR 840 -12.918  -2.985   4.856
   25    HA   THR 840           HA       THR 840 -13.841  -1.016   2.921
   26    HB   THR 840           HB       THR 840 -11.100  -2.293   3.003
   27    HG1  THR 840           1HG      THR 840 -10.718  -0.499   4.537
   28   1HG2  THR 840          1HG2      THR 840 -11.724  -0.655   1.206
   29   2HG2  THR 840          2HG2      THR 840 -12.066   0.548   2.472
   30   3HG2  THR 840          3HG2      THR 840 -10.411  -0.070   2.257
   31    H    LEU 841           H        LEU 841 -12.357  -4.298   2.784
   32    HA   LEU 841           HA       LEU 841 -12.544  -4.526  -0.054
   33   1HB   LEU 841          1HB       LEU 841 -12.149  -6.420   2.258
   34   2HB   LEU 841          2HB       LEU 841 -12.435  -7.066   0.624
   35    HG   LEU 841           HG       LEU 841  -9.966  -6.428   1.539
   36   1HD1  LEU 841          1HD1      LEU 841 -10.196  -5.617  -1.259
   37   2HD1  LEU 841          2HD1      LEU 841  -9.437  -7.068  -0.562
   38   3HD1  LEU 841          3HD1      LEU 841 -11.182  -7.059  -0.917
   39   1HD2  LEU 841          1HD2      LEU 841  -9.759  -4.136   0.008
   40   2HD2  LEU 841          2HD2      LEU 841 -11.317  -3.894   0.835
   41   3HD2  LEU 841          3HD2      LEU 841  -9.838  -4.171   1.786
   42    H    CYS 842           H        CYS 842 -14.972  -4.228   2.202
   43    HA   CYS 842           HA       CYS 842 -16.849  -6.209   1.591
   44   1HB   CYS 842          1HB       CYS 842 -17.015  -4.424   3.368
   45   2HB   CYS 842          2HB       CYS 842 -17.435  -3.264   2.084
   46    HG   CYS 842           HG       CYS 842 -19.102  -5.482   3.618
   47    H    GLN 843           H        GLN 843 -15.388  -4.010  -0.525
   48    HA   GLN 843           HA       GLN 843 -17.683  -4.221  -2.417
   49   1HB   GLN 843          1HB       GLN 843 -15.460  -2.189  -2.646
   50   2HB   GLN 843          2HB       GLN 843 -17.114  -2.125  -3.299
   51   1HG   GLN 843          1HG       GLN 843 -17.174  -2.413  -0.408
   52   2HG   GLN 843          2HG       GLN 843 -16.180  -1.013  -0.868
   53   1HE2  GLN 843          1HE2      GLN 843 -19.205  -1.797   0.059
   54   2HE2  GLN 843          2HE2      GLN 843 -20.139  -0.610  -0.827
   55    H    THR 844           H        THR 844 -16.695  -6.449  -2.744
   56    HA   THR 844           HA       THR 844 -15.565  -7.869  -4.140
   57    HB   THR 844           HB       THR 844 -15.936  -5.473  -5.620
   58    HG1  THR 844           1HG      THR 844 -15.712  -7.013  -7.346
   59   1HG2  THR 844          1HG2      THR 844 -13.114  -6.545  -5.636
   60   2HG2  THR 844          2HG2      THR 844 -13.821  -5.913  -7.142
   61   3HG2  THR 844          3HG2      THR 844 -13.681  -4.859  -5.715
   62    H    LYS 845           H        LYS 845 -13.432  -4.972  -4.329
   63    HA   LYS 845           HA       LYS 845 -11.486  -6.233  -2.545
   64   1HB   LYS 845          1HB       LYS 845 -11.346  -6.683  -5.350
   65   2HB   LYS 845          2HB       LYS 845 -10.067  -5.512  -4.950
   66   1HG   LYS 845          1HG       LYS 845  -9.034  -7.608  -4.587
   67   2HG   LYS 845          2HG       LYS 845  -9.536  -7.101  -2.956
   68   1HD   LYS 845          1HD       LYS 845 -11.695  -8.509  -4.317
   69   2HD   LYS 845          2HD       LYS 845 -10.219  -9.503  -4.270
   70   1HE   LYS 845          1HE       LYS 845 -10.135  -8.613  -1.754
   71   2HE   LYS 845          2HE       LYS 845 -11.884  -8.430  -2.010
   72   1HZ   LYS 845          1HZ       LYS 845 -12.111 -10.667  -2.375
   73   2HZ   LYS 845          2HZ       LYS 845 -10.508 -10.917  -2.672
   74   3HZ   LYS 845          3HZ       LYS 845 -11.024 -10.612  -1.135
   75    H    VAL 846           H        VAL 846 -13.137  -3.621  -3.713
   76    HA   VAL 846           HA       VAL 846 -12.756  -1.340  -3.764
   77    HB   VAL 846           HB       VAL 846 -11.495  -0.705  -1.501
   78   1HG1  VAL 846          1HG1      VAL 846 -14.107  -2.197  -1.221
   79   2HG1  VAL 846          2HG1      VAL 846 -13.610  -0.651  -0.491
   80   3HG1  VAL 846          3HG1      VAL 846 -14.030  -0.726  -2.219
   81   1HG2  VAL 846          1HG2      VAL 846 -12.488  -3.202  -0.379
   82   2HG2  VAL 846          2HG2      VAL 846 -11.205  -3.515  -1.572
   83   3HG2  VAL 846          3HG2      VAL 846 -10.891  -2.439  -0.189
   84    H    LEU 847           H        LEU 847 -11.449  -0.151  -5.013
   85    HA   LEU 847           HA       LEU 847  -8.556  -0.175  -4.521
   86   1HB   LEU 847          1HB       LEU 847  -9.562  -0.746  -7.319
   87   2HB   LEU 847          2HB       LEU 847  -7.911  -0.906  -6.673
   88    HG   LEU 847           HG       LEU 847  -9.164  -3.100  -6.965
   89   1HD1  LEU 847          1HD1      LEU 847  -7.598  -3.693  -5.452
   90   2HD1  LEU 847          2HD1      LEU 847  -7.663  -2.088  -4.685
   91   3HD1  LEU 847          3HD1      LEU 847  -8.793  -3.364  -4.174
   92   1HD2  LEU 847          1HD2      LEU 847 -11.181  -1.629  -5.619
   93   2HD2  LEU 847          2HD2      LEU 847 -11.222  -3.349  -6.076
   94   3HD2  LEU 847          3HD2      LEU 847 -10.629  -2.868  -4.468
   95    H    LEU 848           H        LEU 848  -9.712   1.956  -3.810
   96    HA   LEU 848           HA       LEU 848 -10.538   3.764  -5.893
   97   1HB   LEU 848          1HB       LEU 848 -10.077   3.822  -2.958
   98   2HB   LEU 848          2HB       LEU 848  -9.865   5.375  -3.802
   99    HG   LEU 848           HG       LEU 848 -12.283   3.611  -4.299
  100   1HD1  LEU 848          1HD1      LEU 848 -13.013   5.793  -2.645
  101   2HD1  LEU 848          2HD1      LEU 848 -13.026   4.065  -2.219
  102   3HD1  LEU 848          3HD1      LEU 848 -11.587   5.055  -1.876
  103   1HD2  LEU 848          1HD2      LEU 848 -12.768   5.260  -5.755
  104   2HD2  LEU 848          2HD2      LEU 848 -12.752   6.437  -4.420
  105   3HD2  LEU 848          3HD2      LEU 848 -11.256   6.094  -5.322
  106    H    ASP 849           H        ASP 849  -9.255   6.102  -5.596
  107    HA   ASP 849           HA       ASP 849  -6.590   5.484  -6.708
  108   1HB   ASP 849          1HB       ASP 849  -8.232   8.042  -6.608
  109   2HB   ASP 849          2HB       ASP 849  -6.656   7.868  -7.409
  110    H    ILE 850           H        ILE 850  -6.376   4.849  -4.164
  111    HA   ILE 850           HA       ILE 850  -5.716   7.171  -2.514
  112    HB   ILE 850           HB       ILE 850  -4.749   4.786  -1.335
  113   1HG1  ILE 850          1HG1      ILE 850  -6.080   3.704  -3.255
  114   2HG1  ILE 850          2HG1      ILE 850  -6.502   3.188  -1.605
  115   1HG2  ILE 850          1HG2      ILE 850  -6.768   6.855  -0.943
  116   2HG2  ILE 850          2HG2      ILE 850  -7.362   5.271  -0.390
  117   3HG2  ILE 850          3HG2      ILE 850  -5.848   5.934   0.270
  118   1HD1  ILE 850          1HD1      ILE 850  -8.610   3.621  -2.539
  119   2HD1  ILE 850          2HD1      ILE 850  -8.240   5.159  -1.722
  120   3HD1  ILE 850          3HD1      ILE 850  -8.016   5.010  -3.482
  121    H    PHE 851           H        PHE 851  -3.675   4.292  -2.565
  122    HA   PHE 851           HA       PHE 851  -1.259   5.669  -2.443
  123   1HB   PHE 851          1HB       PHE 851  -1.521   3.046  -3.904
  124   2HB   PHE 851          2HB       PHE 851  -0.231   3.598  -2.822
  125    HD1  PHE 851           1HD      PHE 851  -2.540   1.171  -3.008
  126    HD2  PHE 851           2HD      PHE 851  -1.546   4.446  -0.413
  127    HE1  PHE 851           1HE      PHE 851  -3.633   0.002  -1.114
  128    HE2  PHE 851           2HE      PHE 851  -2.639   3.277   1.481
  129    HZ   PHE 851           HZ       PHE 851  -3.682   1.055   1.131
  130    H    THR 852           H        THR 852  -3.316   6.384  -4.718
  131    HA   THR 852           HA       THR 852  -2.456   5.954  -7.245
  132    HB   THR 852           HB       THR 852  -4.076   7.797  -6.051
  133    HG1  THR 852           1HG      THR 852  -3.016   7.906  -8.685
  134   1HG2  THR 852          1HG2      THR 852  -1.697   9.292  -7.236
  135   2HG2  THR 852          2HG2      THR 852  -3.245  10.035  -6.766
  136   3HG2  THR 852          3HG2      THR 852  -2.198   9.299  -5.528
  137    H    GLY 853           H        GLY 853  -0.392   5.638  -7.891
  138   1HA   GLY 853          1HA       GLY 853   1.725   6.274  -8.565
  139   2HA   GLY 853          2HA       GLY 853   1.408   7.909  -7.940
  140    H    VAL 854           H        VAL 854   0.602   5.713  -5.538
  141    HA   VAL 854           HA       VAL 854   3.063   6.341  -4.066
  142    HB   VAL 854           HB       VAL 854   0.388   5.099  -3.364
  143   1HG1  VAL 854          1HG1      VAL 854   2.403   3.986  -2.205
  144   2HG1  VAL 854          2HG1      VAL 854   2.680   5.562  -1.426
  145   3HG1  VAL 854          3HG1      VAL 854   1.157   4.685  -1.144
  146   1HG2  VAL 854          1HG2      VAL 854   1.876   7.670  -2.798
  147   2HG2  VAL 854          2HG2      VAL 854   0.209   7.442  -3.379
  148   3HG2  VAL 854          3HG2      VAL 854   0.615   7.098  -1.680
  149    H    ARG 855           H        ARG 855   4.779   5.073  -4.526
  150    HA   ARG 855           HA       ARG 855   4.314   2.194  -5.037
  151   1HB   ARG 855          1HB       ARG 855   6.409   2.187  -6.088
  152   2HB   ARG 855          2HB       ARG 855   5.780   3.804  -6.485
  153   1HG   ARG 855          1HG       ARG 855   6.975   4.560  -4.292
  154   2HG   ARG 855          2HG       ARG 855   7.871   3.029  -4.435
  155   1HD   ARG 855          1HD       ARG 855   8.979   5.044  -5.527
  156   2HD   ARG 855          2HD       ARG 855   8.742   3.637  -6.586
  157    HE   ARG 855           HE       ARG 855   6.916   4.787  -7.663
  158   1HH1  ARG 855          2HH2      ARG 855   8.762   6.697  -5.330
  159   2HH1  ARG 855          1HH2      ARG 855   8.226   8.238  -5.961
  160   1HH2  ARG 855          2HH1      ARG 855   6.208   6.823  -8.497
  161   2HH2  ARG 855          1HH1      ARG 855   6.770   8.310  -7.767
  162    H    LEU 856           H        LEU 856   3.788   1.617  -2.847
  163    HA   LEU 856           HA       LEU 856   5.996   1.941  -0.893
  164   1HB   LEU 856          1HB       LEU 856   4.397   1.889   0.728
  165   2HB   LEU 856          2HB       LEU 856   3.309   2.322  -0.612
  166    HG   LEU 856           HG       LEU 856   2.720  -0.005  -0.969
  167   1HD1  LEU 856          1HD1      LEU 856   3.778  -1.540   1.022
  168   2HD1  LEU 856          2HD1      LEU 856   4.491  -1.410  -0.604
  169   3HD1  LEU 856          3HD1      LEU 856   5.131  -0.421   0.730
  170   1HD2  LEU 856          1HD2      LEU 856   1.377  -0.260   0.901
  171   2HD2  LEU 856          2HD2      LEU 856   2.696   0.127   2.032
  172   3HD2  LEU 856          3HD2      LEU 856   1.883   1.430   1.132
  173    H    TYR 857           H        TYR 857   7.091   0.203  -0.037
  174    HA   TYR 857           HA       TYR 857   6.976  -2.259  -1.590
  175   1HB   TYR 857          1HB       TYR 857   9.146  -1.997  -1.057
  176   2HB   TYR 857          2HB       TYR 857   8.778  -0.927   0.307
  177    HD1  TYR 857           1HD      TYR 857   7.983  -4.530  -0.427
  178    HD2  TYR 857           2HD      TYR 857   9.809  -1.693   2.230
  179    HE1  TYR 857           1HE      TYR 857   8.526  -6.362   1.155
  180    HE2  TYR 857           2HE      TYR 857  10.352  -3.524   3.812
  181    HH   TYR 857           HH       TYR 857  10.159  -5.753   4.276
  182    H    LEU 858           H        LEU 858   5.175  -3.473  -1.196
  183    HA   LEU 858           HA       LEU 858   4.154  -3.776   1.522
  184   1HB   LEU 858          1HB       LEU 858   2.680  -3.659  -0.492
  185   2HB   LEU 858          2HB       LEU 858   3.377  -5.198  -1.054
  186    HG   LEU 858           HG       LEU 858   2.186  -6.421   0.451
  187   1HD1  LEU 858          1HD1      LEU 858   2.754  -4.139   2.379
  188   2HD1  LEU 858          2HD1      LEU 858   1.758  -5.547   2.817
  189   3HD1  LEU 858          3HD1      LEU 858   3.467  -5.770   2.373
  190   1HD2  LEU 858          1HD2      LEU 858   0.039  -5.646   0.516
  191   2HD2  LEU 858          2HD2      LEU 858   0.508  -4.123   1.308
  192   3HD2  LEU 858          3HD2      LEU 858   0.696  -4.306  -0.453
  193    HA   PRO 859           HA       PRO 859   7.011  -7.164   2.197
  194   1HB   PRO 859          1HB       PRO 859   6.552  -7.413   4.871
  195   2HB   PRO 859          2HB       PRO 859   7.459  -6.022   4.193
  196   1HG   PRO 859          1HG       PRO 859   4.509  -6.133   4.883
  197   2HG   PRO 859          2HG       PRO 859   5.705  -4.905   5.412
  198   1HD   PRO 859          1HD       PRO 859   4.098  -4.485   3.250
  199   2HD   PRO 859          2HD       PRO 859   5.812  -3.969   3.221
  200    HA   PRO 860           HA       PRO 860   4.111 -10.479   1.864
  201   1HB   PRO 860          1HB       PRO 860   5.760 -12.599   2.324
  202   2HB   PRO 860          2HB       PRO 860   5.938 -11.560   0.872
  203   1HG   PRO 860          1HG       PRO 860   7.453 -11.336   3.488
  204   2HG   PRO 860          2HG       PRO 860   8.143 -11.422   1.835
  205   1HD   PRO 860          1HD       PRO 860   7.742  -9.033   3.086
  206   2HD   PRO 860          2HD       PRO 860   7.399  -9.212   1.338
  207    H    SER 861           H        SER 861   5.978  -9.761   4.739
  208    HA   SER 861           HA       SER 861   4.593 -11.719   6.405
  209   1HB   SER 861          1HB       SER 861   6.921 -10.031   6.576
  210   2HB   SER 861          2HB       SER 861   5.861  -9.704   7.968
  211    HG   SER 861           HG       SER 861   7.395 -11.854   7.462
  212    H    THR 862           H        THR 862   3.998  -8.553   5.171
  213    HA   THR 862           HA       THR 862   2.513  -7.434   7.315
  214    HB   THR 862           HB       THR 862   3.030  -6.903   4.494
  215    HG1  THR 862           1HG      THR 862   2.802  -4.790   5.314
  216   1HG2  THR 862          1HG2      THR 862   0.275  -6.177   5.579
  217   2HG2  THR 862          2HG2      THR 862   0.949  -5.717   3.997
  218   3HG2  THR 862          3HG2      THR 862   0.581  -7.424   4.346
  219    HA   PRO 863           HA       PRO 863  -1.124  -9.913   7.318
  220   1HB   PRO 863          1HB       PRO 863  -2.818  -8.247   8.652
  221   2HB   PRO 863          2HB       PRO 863  -1.381  -8.969   9.447
  222   1HG   PRO 863          1HG       PRO 863  -1.593  -6.226   8.172
  223   2HG   PRO 863          2HG       PRO 863  -1.008  -6.617   9.822
  224   1HD   PRO 863          1HD       PRO 863   0.722  -6.283   7.743
  225   2HD   PRO 863          2HD       PRO 863   1.000  -7.569   8.957
  226    H    ASP 864           H        ASP 864  -2.882 -10.222   5.984
  227    HA   ASP 864           HA       ASP 864  -4.431  -9.805   4.346
  228   1HB   ASP 864          1HB       ASP 864  -4.210  -7.298   5.785
  229   2HB   ASP 864          2HB       ASP 864  -4.476  -6.995   4.054
  230    H    PHE 865           H        PHE 865  -1.364  -9.764   4.034
  231    HA   PHE 865           HA       PHE 865  -0.541  -8.051   2.001
  232   1HB   PHE 865          1HB       PHE 865   0.794  -9.778   3.307
  233   2HB   PHE 865          2HB       PHE 865   0.162 -10.993   2.183
  234    HD1  PHE 865           1HD      PHE 865   1.786  -7.600   2.030
  235    HD2  PHE 865           2HD      PHE 865   1.517 -11.567   0.405
  236    HE1  PHE 865           1HE      PHE 865   3.604  -7.068   0.430
  237    HE2  PHE 865           2HE      PHE 865   3.336 -11.035  -1.195
  238    HZ   PHE 865           HZ       PHE 865   4.380  -8.785  -1.183
  239    H    SER 866           H        SER 866  -2.224 -11.219   1.716
  240    HA   SER 866           HA       SER 866  -2.312 -11.841  -0.848
  241   1HB   SER 866          1HB       SER 866  -3.840 -12.854   0.742
  242   2HB   SER 866          2HB       SER 866  -4.769 -11.341   0.875
  243    HG   SER 866           HG       SER 866  -5.730 -11.781  -0.938
  244    H    ARG 867           H        ARG 867  -4.946  -9.593   0.070
  245    HA   ARG 867           HA       ARG 867  -5.051  -8.498  -2.587
  246   1HB   ARG 867          1HB       ARG 867  -6.259  -7.328  -0.059
  247   2HB   ARG 867          2HB       ARG 867  -6.836  -7.155  -1.734
  248   1HG   ARG 867          1HG       ARG 867  -7.985  -9.098  -1.620
  249   2HG   ARG 867          2HG       ARG 867  -6.570  -9.967  -0.980
  250   1HD   ARG 867          1HD       ARG 867  -7.292  -8.414   1.174
  251   2HD   ARG 867          2HD       ARG 867  -8.873  -8.770   0.447
  252    HE   ARG 867           HE       ARG 867  -7.358 -11.174   0.574
  253   1HH1  ARG 867          2HH2      ARG 867  -8.973  -8.821   2.661
  254   2HH1  ARG 867          1HH2      ARG 867  -9.323  -9.978   3.926
  255   1HH2  ARG 867          2HH1      ARG 867  -7.819 -12.702   2.245
  256   2HH2  ARG 867          1HH1      ARG 867  -8.664 -12.191   3.689
  257    H    LEU 868           H        LEU 868  -3.714  -7.415   0.552
  258    HA   LEU 868           HA       LEU 868  -3.111  -4.820   0.238
  259   1HB   LEU 868          1HB       LEU 868  -1.622  -7.145   1.339
  260   2HB   LEU 868          2HB       LEU 868  -0.654  -5.683   1.035
  261    HG   LEU 868           HG       LEU 868  -2.758  -6.175   3.055
  262   1HD1  LEU 868          1HD1      LEU 868  -0.970  -5.410   4.206
  263   2HD1  LEU 868          2HD1      LEU 868  -0.182  -4.835   2.717
  264   3HD1  LEU 868          3HD1      LEU 868  -1.352  -3.794   3.563
  265   1HD2  LEU 868          1HD2      LEU 868  -4.009  -4.740   1.456
  266   2HD2  LEU 868          2HD2      LEU 868  -3.648  -3.877   2.970
  267   3HD2  LEU 868          3HD2      LEU 868  -2.688  -3.549   1.508
  268    H    ARG 869           H        ARG 869  -1.229  -7.461  -1.337
  269    HA   ARG 869           HA       ARG 869   0.499  -5.710  -2.776
  270   1HB   ARG 869          1HB       ARG 869   0.831  -8.181  -2.299
  271   2HB   ARG 869          2HB       ARG 869  -0.368  -8.511  -3.574
  272   1HG   ARG 869          1HG       ARG 869   1.309  -8.365  -5.077
  273   2HG   ARG 869          2HG       ARG 869   1.416  -6.630  -4.695
  274   1HD   ARG 869          1HD       ARG 869   3.607  -7.495  -4.329
  275   2HD   ARG 869          2HD       ARG 869   2.893  -7.307  -2.712
  276    HE   ARG 869           HE       ARG 869   2.259  -9.872  -3.250
  277   1HH1  ARG 869          2HH2      ARG 869   5.263  -8.055  -3.671
  278   2HH1  ARG 869          1HH2      ARG 869   6.298  -9.446  -3.431
  279   1HH2  ARG 869          2HH1      ARG 869   3.626 -11.708  -2.934
  280   2HH2  ARG 869          1HH1      ARG 869   5.364 -11.528  -3.011
  281    H    ARG 870           H        ARG 870  -1.649  -7.950  -4.517
  282    HA   ARG 870           HA       ARG 870  -1.951  -6.567  -6.832
  283   1HB   ARG 870          1HB       ARG 870  -2.974  -8.813  -6.115
  284   2HB   ARG 870          2HB       ARG 870  -4.334  -7.860  -5.472
  285   1HG   ARG 870          1HG       ARG 870  -4.480  -6.757  -7.774
  286   2HG   ARG 870          2HG       ARG 870  -3.346  -8.004  -8.346
  287   1HD   ARG 870          1HD       ARG 870  -4.947  -9.604  -8.358
  288   2HD   ARG 870          2HD       ARG 870  -5.565  -9.112  -6.766
  289    HE   ARG 870           HE       ARG 870  -7.157  -7.763  -7.802
  290   1HH1  ARG 870          2HH2      ARG 870  -4.763  -8.929 -10.129
  291   2HH1  ARG 870          1HH2      ARG 870  -5.664  -8.395 -11.530
  292   1HH2  ARG 870          2HH1      ARG 870  -8.346  -7.058  -9.654
  293   2HH2  ARG 870          1HH1      ARG 870  -7.707  -7.329 -11.259
  294    H    TYR 871           H        TYR 871  -4.169  -6.185  -4.004
  295    HA   TYR 871           HA       TYR 871  -5.833  -4.220  -4.905
  296   1HB   TYR 871          1HB       TYR 871  -5.732  -5.297  -2.614
  297   2HB   TYR 871          2HB       TYR 871  -4.465  -4.130  -2.200
  298    HD1  TYR 871           1HD      TYR 871  -7.686  -3.761  -4.099
  299    HD2  TYR 871           2HD      TYR 871  -5.341  -2.601  -0.692
  300    HE1  TYR 871           1HE      TYR 871  -9.419  -2.102  -3.471
  301    HE2  TYR 871           2HE      TYR 871  -7.075  -0.942  -0.064
  302    HH   TYR 871           HH       TYR 871  -9.843  -0.780  -0.632
  303    H    PHE 872           H        PHE 872  -2.778  -3.452  -3.132
  304    HA   PHE 872           HA       PHE 872  -2.731  -0.725  -3.614
  305   1HB   PHE 872          1HB       PHE 872  -1.155  -2.220  -2.237
  306   2HB   PHE 872          2HB       PHE 872  -0.264  -2.470  -3.748
  307    HD1  PHE 872           1HD      PHE 872   0.590  -0.381  -4.990
  308    HD2  PHE 872           2HD      PHE 872  -0.744  -0.334  -0.907
  309    HE1  PHE 872           1HE      PHE 872   1.830   1.732  -4.610
  310    HE2  PHE 872           2HE      PHE 872   0.496   1.780  -0.527
  311    HZ   PHE 872           HZ       PHE 872   1.783   2.813  -2.378
  312    H    VAL 873           H        VAL 873  -0.171  -2.441  -5.316
  313    HA   VAL 873           HA       VAL 873   0.192  -0.873  -7.448
  314    HB   VAL 873           HB       VAL 873   1.546  -2.675  -7.701
  315   1HG1  VAL 873          1HG1      VAL 873   0.911  -3.971  -5.859
  316   2HG1  VAL 873          2HG1      VAL 873  -0.765  -4.146  -6.431
  317   3HG1  VAL 873          3HG1      VAL 873   0.543  -5.066  -7.212
  318   1HG2  VAL 873          1HG2      VAL 873   0.120  -2.583  -9.801
  319   2HG2  VAL 873          2HG2      VAL 873   0.862  -4.168  -9.475
  320   3HG2  VAL 873          3HG2      VAL 873  -0.859  -3.899  -9.111
  321    H    ALA 874           H        ALA 874  -2.605  -3.027  -6.998
  322    HA   ALA 874           HA       ALA 874  -3.697  -2.870  -9.588
  323   1HB   ALA 874          1HB       ALA 874  -4.670  -4.433  -8.122
  324   2HB   ALA 874          2HB       ALA 874  -4.859  -3.234  -6.819
  325   3HB   ALA 874          3HB       ALA 874  -5.911  -3.164  -8.254
  326    H    PHE 875           H        PHE 875  -4.325  -0.795  -6.702
  327    HA   PHE 875           HA       PHE 875  -6.179   0.952  -7.701
  328   1HB   PHE 875          1HB       PHE 875  -3.691   1.728  -6.143
  329   2HB   PHE 875          2HB       PHE 875  -5.211   2.636  -6.220
  330    HD1  PHE 875           1HD      PHE 875  -4.552   2.281  -3.600
  331    HD2  PHE 875           2HD      PHE 875  -6.144  -0.713  -6.236
  332    HE1  PHE 875           1HE      PHE 875  -5.404   1.013  -1.646
  333    HE2  PHE 875           2HE      PHE 875  -6.996  -1.981  -4.282
  334    HZ   PHE 875           HZ       PHE 875  -6.626  -1.118  -1.987
  335    H    ASP 876           H        ASP 876  -2.633   1.053  -8.287
  336    HA   ASP 876           HA       ASP 876  -2.404   1.701 -10.832
  337   1HB   ASP 876          1HB       ASP 876  -3.895   3.894  -9.504
  338   2HB   ASP 876          2HB       ASP 876  -2.557   4.413 -10.553
  339    H    GLY 877           H        GLY 877  -1.326   1.688  -7.760
  340   1HA   GLY 877          1HA       GLY 877   0.953   3.511  -8.101
  341   2HA   GLY 877          2HA       GLY 877   0.577   2.515  -6.676
  342    H    ASP 878           H        ASP 878   2.532   1.468  -6.414
  343    HA   ASP 878           HA       ASP 878   3.083  -0.691  -8.289
  344   1HB   ASP 878          1HB       ASP 878   4.645   1.819  -8.282
  345   2HB   ASP 878          2HB       ASP 878   5.622   0.344  -8.119
  346    H    LEU 879           H        LEU 879   4.771  -2.154  -7.436
  347    HA   LEU 879           HA       LEU 879   5.297  -1.747  -4.539
  348   1HB   LEU 879          1HB       LEU 879   3.678  -3.846  -5.858
  349   2HB   LEU 879          2HB       LEU 879   4.904  -4.456  -4.721
  350    HG   LEU 879           HG       LEU 879   3.993  -3.253  -2.904
  351   1HD1  LEU 879          1HD1      LEU 879   2.647  -1.586  -5.057
  352   2HD1  LEU 879          2HD1      LEU 879   2.135  -1.520  -3.354
  353   3HD1  LEU 879          3HD1      LEU 879   3.793  -1.054  -3.803
  354   1HD2  LEU 879          1HD2      LEU 879   2.339  -4.810  -2.953
  355   2HD2  LEU 879          2HD2      LEU 879   1.314  -3.492  -3.571
  356   3HD2  LEU 879          3HD2      LEU 879   2.095  -4.619  -4.706
  357    H    VAL 880           H        VAL 880   7.359  -2.187  -3.972
  358    HA   VAL 880           HA       VAL 880   9.031  -3.609  -5.991
  359    HB   VAL 880           HB       VAL 880  10.481  -1.949  -4.072
  360   1HG1  VAL 880          1HG1      VAL 880  11.201  -2.949  -6.328
  361   2HG1  VAL 880          2HG1      VAL 880  10.228  -1.666  -7.087
  362   3HG1  VAL 880          3HG1      VAL 880  11.614  -1.240  -6.054
  363   1HG2  VAL 880          1HG2      VAL 880   9.612   0.155  -5.483
  364   2HG2  VAL 880          2HG2      VAL 880   8.121  -0.816  -5.545
  365   3HG2  VAL 880          3HG2      VAL 880   8.812  -0.346  -3.974
  366    H    GLN 881           H        GLN 881  10.395  -5.233  -5.282
  367    HA   GLN 881           HA       GLN 881   9.661  -6.555  -2.846
  368   1HB   GLN 881          1HB       GLN 881  12.142  -7.019  -4.537
  369   2HB   GLN 881          2HB       GLN 881  11.300  -8.186  -3.489
  370   1HG   GLN 881          1HG       GLN 881   9.731  -8.642  -5.064
  371   2HG   GLN 881          2HG       GLN 881   9.552  -6.930  -5.507
  372   1HE2  GLN 881          1HE2      GLN 881  10.766  -6.057  -7.205
  373   2HE2  GLN 881          2HE2      GLN 881  11.740  -7.044  -8.274
  374    H    GLU 882           H        GLU 882  10.535  -6.471  -0.836
  375    HA   GLU 882           HA       GLU 882  11.773  -4.439   0.322
  376   1HB   GLU 882          1HB       GLU 882  11.232  -6.613   1.424
  377   2HB   GLU 882          2HB       GLU 882  12.723  -7.301   0.737
  378   1HG   GLU 882          1HG       GLU 882  13.768  -5.082   1.848
  379   2HG   GLU 882          2HG       GLU 882  12.369  -5.287   2.925
  380    H    PHE 883           H        PHE 883  13.909  -7.112  -0.821
  381    HA   PHE 883           HA       PHE 883  16.232  -5.452  -0.832
  382   1HB   PHE 883          1HB       PHE 883  17.322  -7.336  -1.831
  383   2HB   PHE 883          2HB       PHE 883  16.169  -7.951  -0.634
  384    HD1  PHE 883           1HD      PHE 883  17.045  -7.773  -4.186
  385    HD2  PHE 883           2HD      PHE 883  14.088  -9.068  -1.352
  386    HE1  PHE 883           1HE      PHE 883  16.009  -9.207  -5.923
  387    HE2  PHE 883           2HE      PHE 883  13.052 -10.503  -3.090
  388    HZ   PHE 883           HZ       PHE 883  14.012 -10.573  -5.375
  389    H    ASP 884           H        ASP 884  13.631  -4.864  -2.565
  390    HA   ASP 884           HA       ASP 884  15.205  -3.888  -4.875
  391   1HB   ASP 884          1HB       ASP 884  12.625  -5.489  -5.025
  392   2HB   ASP 884          2HB       ASP 884  13.336  -4.594  -6.386
  393    H    MET 885           H        MET 885  15.052  -1.820  -3.855
  394    HA   MET 885           HA       MET 885  12.413  -0.561  -4.297
  395   1HB   MET 885          1HB       MET 885  13.099   0.702  -2.019
  396   2HB   MET 885          2HB       MET 885  12.089  -0.763  -2.034
  397   1HG   MET 885          1HG       MET 885  14.288  -2.080  -1.898
  398   2HG   MET 885          2HG       MET 885  15.065  -0.536  -1.508
  399   1HE   MET 885          1HE       MET 885  12.275  -3.163   0.889
  400   2HE   MET 885          2HE       MET 885  11.352  -1.832   0.151
  401   3HE   MET 885          3HE       MET 885  12.326  -2.915  -0.873
  402    H    THR 886           H        THR 886  15.918  -0.348  -3.740
  403    HA   THR 886           HA       THR 886  16.872   2.015  -3.773
  404    HB   THR 886           HB       THR 886  18.418   1.532  -5.472
  405    HG1  THR 886           1HG      THR 886  17.750   0.069  -7.207
  406   1HG2  THR 886          1HG2      THR 886  18.925  -0.777  -5.190
  407   2HG2  THR 886          2HG2      THR 886  18.029  -0.328  -3.719
  408   3HG2  THR 886          3HG2      THR 886  17.208  -1.216  -5.025
  409    H    SER 887           H        SER 887  14.867   1.044  -6.609
  410    HA   SER 887           HA       SER 887  14.594   3.904  -7.318
  411   1HB   SER 887          1HB       SER 887  14.482   1.315  -8.729
  412   2HB   SER 887          2HB       SER 887  13.188   2.447  -9.193
  413    HG   SER 887           HG       SER 887  15.256   2.638 -10.341
  414    H    ALA 888           H        ALA 888  13.008   1.432  -5.566
  415    HA   ALA 888           HA       ALA 888  10.314   1.741  -6.081
  416   1HB   ALA 888          1HB       ALA 888  10.100   1.418  -3.510
  417   2HB   ALA 888          2HB       ALA 888  10.920   0.151  -4.454
  418   3HB   ALA 888          3HB       ALA 888  11.878   1.328  -3.525
  419    H    THR 889           H        THR 889   8.813   2.867  -4.237
  420    HA   THR 889           HA       THR 889   9.733   5.686  -3.986
  421    HB   THR 889           HB       THR 889   7.947   4.917  -5.890
  422    HG1  THR 889           1HG      THR 889   7.916   6.999  -6.092
  423   1HG2  THR 889          1HG2      THR 889   5.719   5.088  -5.162
  424   2HG2  THR 889          2HG2      THR 889   6.483   4.171  -3.842
  425   3HG2  THR 889          3HG2      THR 889   6.173   5.914  -3.652
  426    H    HIS 890           H        HIS 890   7.492   3.093  -2.946
  427    HA   HIS 890           HA       HIS 890   7.411   4.418  -0.276
  428   1HB   HIS 890          1HB       HIS 890   5.229   3.140  -1.923
  429   2HB   HIS 890          2HB       HIS 890   5.117   3.192  -0.154
  430    HD1  HIS 890           1HD      HIS 890   6.427   6.080  -2.374
  431    HD2  HIS 890           2HD      HIS 890   3.239   5.004   0.154
  432    HE1  HIS 890           1HE      HIS 890   5.010   8.183  -2.042
  433    H    VAL 891           H        VAL 891   6.926   2.845   1.511
  434    HA   VAL 891           HA       VAL 891   7.612   0.049   0.931
  435    HB   VAL 891           HB       VAL 891   9.379   0.259   2.852
  436   1HG1  VAL 891          1HG1      VAL 891   9.481   0.273   0.040
  437   2HG1  VAL 891          2HG1      VAL 891  10.600   1.564   0.541
  438   3HG1  VAL 891          3HG1      VAL 891  10.823  -0.093   1.151
  439   1HG2  VAL 891          1HG2      VAL 891   9.003   2.538   3.518
  440   2HG2  VAL 891          2HG2      VAL 891  10.561   2.516   2.655
  441   3HG2  VAL 891          3HG2      VAL 891   9.097   3.112   1.835
  442    H    LEU 892           H        LEU 892   6.572  -1.306   2.310
  443    HA   LEU 892           HA       LEU 892   4.946  -0.042   4.423
  444   1HB   LEU 892          1HB       LEU 892   4.491  -2.063   2.538
  445   2HB   LEU 892          2HB       LEU 892   4.660  -2.930   4.084
  446    HG   LEU 892           HG       LEU 892   3.072  -0.454   4.300
  447   1HD1  LEU 892          1HD1      LEU 892   2.448  -2.518   2.228
  448   2HD1  LEU 892          2HD1      LEU 892   1.096  -1.976   3.251
  449   3HD1  LEU 892          3HD1      LEU 892   2.013  -0.793   2.286
  450   1HD2  LEU 892          1HD2      LEU 892   3.264  -2.184   6.063
  451   2HD2  LEU 892          2HD2      LEU 892   1.577  -2.000   5.525
  452   3HD2  LEU 892          3HD2      LEU 892   2.544  -3.383   4.962
  453    H    GLY 893           H        GLY 893   5.564  -0.066   6.501
  454   1HA   GLY 893          1HA       GLY 893   6.244  -1.345   8.437
  455   2HA   GLY 893          2HA       GLY 893   7.345  -2.279   7.398
  456    H    SER 894           H        SER 894   9.154  -1.039   6.349
  457    HA   SER 894           HA       SER 894   9.949   1.346   7.931
  458   1HB   SER 894          1HB       SER 894  11.516  -1.213   7.486
  459   2HB   SER 894          2HB       SER 894  12.304   0.327   7.907
  460    HG   SER 894           HG       SER 894  10.595   0.325   9.656
  461    H    ARG 895           H        ARG 895  12.455   1.716   6.766
  462    HA   ARG 895           HA       ARG 895  11.808   1.949   3.867
  463   1HB   ARG 895          1HB       ARG 895  13.013   4.157   3.958
  464   2HB   ARG 895          2HB       ARG 895  11.482   4.131   4.865
  465   1HG   ARG 895          1HG       ARG 895  12.633   3.885   6.964
  466   2HG   ARG 895          2HG       ARG 895  14.184   3.576   6.149
  467   1HD   ARG 895          1HD       ARG 895  13.180   6.048   5.140
  468   2HD   ARG 895          2HD       ARG 895  13.010   6.100   6.907
  469    HE   ARG 895           HE       ARG 895  15.580   5.092   6.356
  470   1HH1  ARG 895          2HH2      ARG 895  13.699   8.044   5.854
  471   2HH1  ARG 895          1HH2      ARG 895  15.092   9.102   5.897
  472   1HH2  ARG 895          2HH1      ARG 895  17.419   6.490   6.413
  473   2HH2  ARG 895          1HH1      ARG 895  17.213   8.215   6.216
  474    H    ASP 896           H        ASP 896  14.238   1.634   6.451
  475    HA   ASP 896           HA       ASP 896  16.658   1.680   5.677
  476   1HB   ASP 896          1HB       ASP 896  16.316   0.137   7.397
  477   2HB   ASP 896          2HB       ASP 896  15.188  -0.840   6.433
  478    H    LYS 897           H        LYS 897  15.249  -1.327   4.347
  479    HA   LYS 897           HA       LYS 897  16.891  -1.823   2.290
  480   1HB   LYS 897          1HB       LYS 897  14.332  -2.078   1.106
  481   2HB   LYS 897          2HB       LYS 897  15.258  -3.330   1.968
  482   1HG   LYS 897          1HG       LYS 897  13.214  -3.228   3.156
  483   2HG   LYS 897          2HG       LYS 897  14.320  -2.232   4.133
  484   1HD   LYS 897          1HD       LYS 897  13.453  -0.252   2.656
  485   2HD   LYS 897          2HD       LYS 897  12.105  -1.349   2.269
  486   1HE   LYS 897          1HE       LYS 897  12.490  -1.535   5.071
  487   2HE   LYS 897          2HE       LYS 897  12.578   0.196   4.680
  488   1HZ   LYS 897          1HZ       LYS 897  10.336  -1.320   4.914
  489   2HZ   LYS 897          2HZ       LYS 897  10.435   0.221   4.335
  490   3HZ   LYS 897          3HZ       LYS 897  10.486  -1.057   3.293
  491    H    ASN 898           H        ASN 898  14.582   0.865   2.424
  492    HA   ASN 898           HA       ASN 898  16.007   2.181   0.245
  493   1HB   ASN 898          1HB       ASN 898  13.776   0.589  -0.388
  494   2HB   ASN 898          2HB       ASN 898  13.164   2.257  -0.365
  495   1HD2  ASN 898          1HD2      ASN 898  13.040   2.891  -2.459
  496   2HD2  ASN 898          2HD2      ASN 898  14.344   2.772  -3.622
  497    HA   PRO 899           HA       PRO 899  14.585   5.102   3.411
  498   1HB   PRO 899          1HB       PRO 899  16.666   6.840   3.141
  499   2HB   PRO 899          2HB       PRO 899  16.852   5.265   3.979
  500   1HG   PRO 899          1HG       PRO 899  17.502   5.894   1.085
  501   2HG   PRO 899          2HG       PRO 899  18.574   5.121   2.298
  502   1HD   PRO 899          1HD       PRO 899  17.112   3.636   0.541
  503   2HD   PRO 899          2HD       PRO 899  17.296   3.108   2.241
  504    H    ALA 900           H        ALA 900  14.967   5.130   0.014
  505    HA   ALA 900           HA       ALA 900  14.099   7.927  -0.297
  506   1HB   ALA 900          1HB       ALA 900  14.328   5.944  -2.551
  507   2HB   ALA 900          2HB       ALA 900  14.679   7.690  -2.535
  508   3HB   ALA 900          3HB       ALA 900  15.808   6.548  -1.766
  509    H    ALA 901           H        ALA 901  12.637   5.081   0.532
  510    HA   ALA 901           HA       ALA 901  10.230   5.543  -1.137
  511   1HB   ALA 901          1HB       ALA 901  11.179   3.242  -0.964
  512   2HB   ALA 901          2HB       ALA 901  10.896   3.285   0.792
  513   3HB   ALA 901          3HB       ALA 901   9.519   3.350  -0.333
  514    H    GLN 902           H        GLN 902   8.385   4.395   0.734
  515    HA   GLN 902           HA       GLN 902   8.383   6.475   2.870
  516   1HB   GLN 902          1HB       GLN 902   6.256   5.651   0.901
  517   2HB   GLN 902          2HB       GLN 902   5.784   6.230   2.516
  518   1HG   GLN 902          1HG       GLN 902   7.552   7.705   0.522
  519   2HG   GLN 902          2HG       GLN 902   5.867   8.101   0.920
  520   1HE2  GLN 902          1HE2      GLN 902   5.932   7.673   3.726
  521   2HE2  GLN 902          2HE2      GLN 902   6.945   8.903   4.450
  522    H    GLN 903           H        GLN 903   8.073   5.719   4.894
  523    HA   GLN 903           HA       GLN 903   7.716   2.824   5.220
  524   1HB   GLN 903          1HB       GLN 903   8.205   5.057   7.230
  525   2HB   GLN 903          2HB       GLN 903   8.229   3.314   7.588
  526   1HG   GLN 903          1HG       GLN 903  10.419   3.345   7.051
  527   2HG   GLN 903          2HG       GLN 903   9.911   3.584   5.365
  528   1HE2  GLN 903          1HE2      GLN 903   9.816   5.746   4.495
  529   2HE2  GLN 903          2HE2      GLN 903  10.744   7.040   5.224
  530    H    VAL 904           H        VAL 904   5.440   3.271   4.191
  531    HA   VAL 904           HA       VAL 904   3.485   4.361   6.070
  532    HB   VAL 904           HB       VAL 904   2.149   4.469   4.248
  533   1HG1  VAL 904          1HG1      VAL 904   4.386   3.382   2.541
  534   2HG1  VAL 904          2HG1      VAL 904   3.329   4.786   2.258
  535   3HG1  VAL 904          3HG1      VAL 904   4.641   4.887   3.456
  536   1HG2  VAL 904          1HG2      VAL 904   1.411   2.228   4.226
  537   2HG2  VAL 904          2HG2      VAL 904   2.091   2.447   2.595
  538   3HG2  VAL 904          3HG2      VAL 904   3.033   1.600   3.846
  539    H    SER 905           H        SER 905   1.420   2.914   6.369
  540    HA   SER 905           HA       SER 905   2.296   0.150   7.051
  541   1HB   SER 905          1HB       SER 905   1.756   2.196   8.881
  542   2HB   SER 905          2HB       SER 905   0.253   1.243   8.833
  543    HG   SER 905           HG       SER 905   2.889   0.317   9.325
  544    HA   PRO 906           HA       PRO 906  -1.596  -1.299   5.558
  545   1HB   PRO 906          1HB       PRO 906  -2.971  -2.490   7.586
  546   2HB   PRO 906          2HB       PRO 906  -1.385  -3.114   7.025
  547   1HG   PRO 906          1HG       PRO 906  -1.905  -1.249   9.358
  548   2HG   PRO 906          2HG       PRO 906  -0.965  -2.777   9.375
  549   1HD   PRO 906          1HD       PRO 906   0.258  -0.358   9.086
  550   2HD   PRO 906          2HD       PRO 906   0.812  -1.774   8.141
  551    H    GLU 907           H        GLU 907  -1.822   0.818   8.389
  552    HA   GLU 907           HA       GLU 907  -4.624   1.406   8.105
  553   1HB   GLU 907          1HB       GLU 907  -2.288   2.475   9.644
  554   2HB   GLU 907          2HB       GLU 907  -3.709   3.530   9.454
  555   1HG   GLU 907          1HG       GLU 907  -3.857   2.133  11.504
  556   2HG   GLU 907          2HG       GLU 907  -5.166   1.776  10.357
  557    H    TRP 908           H        TRP 908  -1.623   2.675   6.714
  558    HA   TRP 908           HA       TRP 908  -2.730   5.112   5.704
  559   1HB   TRP 908          1HB       TRP 908  -0.336   4.748   5.958
  560   2HB   TRP 908          2HB       TRP 908  -0.387   3.410   4.802
  561    HD1  TRP 908           HD       TRP 908  -0.674   7.228   4.968
  562    HE1  TRP 908           1HE      TRP 908  -0.138   8.233   2.690
  563    HE3  TRP 908           3HE      TRP 908  -0.285   2.907   2.252
  564    HZ2  TRP 908           2HZ      TRP 908   0.396   7.286   0.008
  565    HZ3  TRP 908           3HZ      TRP 908   0.238   2.999  -0.158
  566    HH2  TRP 908           HH       TRP 908   0.580   5.174  -1.293
  567    H    ILE 909           H        ILE 909  -2.250   1.846   4.278
  568    HA   ILE 909           HA       ILE 909  -3.161   2.400   1.688
  569    HB   ILE 909           HB       ILE 909  -2.968   0.000   3.455
  570   1HG1  ILE 909          1HG1      ILE 909  -2.235  -0.298   0.662
  571   2HG1  ILE 909          2HG1      ILE 909  -1.549   1.209   1.316
  572   1HG2  ILE 909          1HG2      ILE 909  -5.280  -0.048   2.356
  573   2HG2  ILE 909          2HG2      ILE 909  -4.432  -0.107   0.791
  574   3HG2  ILE 909          3HG2      ILE 909  -4.212  -1.420   1.973
  575   1HD1  ILE 909          1HD1      ILE 909  -0.148  -0.942   1.611
  576   2HD1  ILE 909          2HD1      ILE 909  -0.406   0.061   3.059
  577   3HD1  ILE 909          3HD1      ILE 909  -1.363  -1.421   2.820
  578    H    TRP 910           H        TRP 910  -5.056   1.175   4.510
  579    HA   TRP 910           HA       TRP 910  -7.568   1.231   3.227
  580   1HB   TRP 910          1HB       TRP 910  -7.094   1.827   6.152
  581   2HB   TRP 910          2HB       TRP 910  -8.489   1.036   5.407
  582    HD1  TRP 910           HD       TRP 910  -5.836   0.157   7.537
  583    HE1  TRP 910           1HE      TRP 910  -5.095  -2.273   7.350
  584    HE3  TRP 910           3HE      TRP 910  -7.978  -0.994   3.033
  585    HZ2  TRP 910           2HZ      TRP 910  -5.391  -4.459   5.477
  586    HZ3  TRP 910           3HZ      TRP 910  -7.727  -3.256   2.081
  587    HH2  TRP 910           HH       TRP 910  -6.439  -4.996   3.287
  588    H    ALA 911           H        ALA 911  -6.127   3.665   5.475
  589    HA   ALA 911           HA       ALA 911  -8.143   5.598   5.195
  590   1HB   ALA 911          1HB       ALA 911  -6.667   7.037   6.293
  591   2HB   ALA 911          2HB       ALA 911  -6.046   5.438   6.770
  592   3HB   ALA 911          3HB       ALA 911  -5.238   6.358   5.478
  593    H    CYS 912           H        CYS 912  -5.412   4.760   3.104
  594    HA   CYS 912           HA       CYS 912  -5.581   7.131   1.470
  595   1HB   CYS 912          1HB       CYS 912  -4.321   4.391   1.070
  596   2HB   CYS 912          2HB       CYS 912  -4.159   5.734  -0.089
  597    HG   CYS 912           HG       CYS 912  -2.253   6.624   0.945
  598    H    ILE 913           H        ILE 913  -6.072   3.749   0.362
  599    HA   ILE 913           HA       ILE 913  -7.585   4.260  -1.863
  600    HB   ILE 913           HB       ILE 913  -6.886   2.024  -1.378
  601   1HG1  ILE 913          1HG1      ILE 913  -9.913   2.122  -1.029
  602   2HG1  ILE 913          2HG1      ILE 913  -9.069   2.292  -2.587
  603   1HG2  ILE 913          1HG2      ILE 913  -8.634   1.196   0.721
  604   2HG2  ILE 913          2HG2      ILE 913  -6.858   1.310   0.759
  605   3HG2  ILE 913          3HG2      ILE 913  -7.850   2.701   1.259
  606   1HD1  ILE 913          1HD1      ILE 913  -8.674   0.062  -2.736
  607   2HD1  ILE 913          2HD1      ILE 913  -8.170  -0.044  -1.032
  608   3HD1  ILE 913          3HD1      ILE 913  -9.898  -0.107  -1.455
  609    H    ARG 914           H        ARG 914  -8.723   4.105   1.528
  610    HA   ARG 914           HA       ARG 914 -11.500   4.397   0.886
  611   1HB   ARG 914          1HB       ARG 914 -10.564   3.512   3.043
  612   2HB   ARG 914          2HB       ARG 914 -10.035   5.164   3.439
  613   1HG   ARG 914          1HG       ARG 914 -12.771   5.300   2.597
  614   2HG   ARG 914          2HG       ARG 914 -12.635   3.989   3.793
  615   1HD   ARG 914          1HD       ARG 914 -12.204   5.428   5.490
  616   2HD   ARG 914          2HD       ARG 914 -11.085   6.394   4.504
  617    HE   ARG 914           HE       ARG 914 -13.565   7.036   3.493
  618   1HH1  ARG 914          2HH2      ARG 914 -12.092   7.021   6.707
  619   2HH1  ARG 914          1HH2      ARG 914 -13.055   8.353   7.305
  620   1HH2  ARG 914          2HH1      ARG 914 -14.838   8.795   4.283
  621   2HH2  ARG 914          1HH1      ARG 914 -14.621   9.365   5.922
  622    H    LYS 915           H        LYS 915  -8.790   6.601   1.084
  623    HA   LYS 915           HA       LYS 915 -10.621   8.931   1.144
  624   1HB   LYS 915          1HB       LYS 915  -7.624   8.591   1.486
  625   2HB   LYS 915          2HB       LYS 915  -8.401  10.183   1.318
  626   1HG   LYS 915          1HG       LYS 915  -9.301   8.136   3.377
  627   2HG   LYS 915          2HG       LYS 915  -8.040   9.344   3.719
  628   1HD   LYS 915          1HD       LYS 915  -9.557  11.166   3.341
  629   2HD   LYS 915          2HD       LYS 915 -10.785  10.086   2.639
  630   1HE   LYS 915          1HE       LYS 915 -11.455  10.594   4.907
  631   2HE   LYS 915          2HE       LYS 915 -10.908   8.903   4.863
  632   1HZ   LYS 915          1HZ       LYS 915  -8.714   9.822   5.577
  633   2HZ   LYS 915          2HZ       LYS 915  -9.495  11.234   5.920
  634   3HZ   LYS 915          3HZ       LYS 915  -9.919   9.846   6.703
  635    H    ARG 916           H        ARG 916  -9.280   6.829  -1.073
  636    HA   ARG 916           HA       ARG 916  -8.934   6.927  -3.333
  637   1HB   ARG 916          1HB       ARG 916 -11.171   8.497  -2.780
  638   2HB   ARG 916          2HB       ARG 916 -10.162   9.546  -3.804
  639   1HG   ARG 916          1HG       ARG 916 -10.543   6.653  -4.570
  640   2HG   ARG 916          2HG       ARG 916 -11.835   7.827  -4.918
  641   1HD   ARG 916          1HD       ARG 916  -8.921   8.123  -5.752
  642   2HD   ARG 916          2HD       ARG 916 -10.237   7.584  -6.816
  643    HE   ARG 916           HE       ARG 916 -10.778  10.138  -5.536
  644   1HH1  ARG 916          2HH2      ARG 916  -9.177   8.500  -8.230
  645   2HH1  ARG 916          1HH2      ARG 916  -9.206   9.901  -9.278
  646   1HH2  ARG 916          2HH1      ARG 916 -10.817  11.987  -6.921
  647   2HH2  ARG 916          1HH1      ARG 916 -10.142  11.889  -8.531
  648    H    ARG 917           H        ARG 917  -7.617   9.091  -1.170
  649    HA   ARG 917           HA       ARG 917  -5.671  10.009  -3.212
  650   1HB   ARG 917          1HB       ARG 917  -5.840  12.247  -2.630
  651   2HB   ARG 917          2HB       ARG 917  -7.539  11.740  -2.471
  652   1HG   ARG 917          1HG       ARG 917  -7.139  12.877  -0.447
  653   2HG   ARG 917          2HG       ARG 917  -6.887  11.172  -0.001
  654   1HD   ARG 917          1HD       ARG 917  -4.776  11.636   0.612
  655   2HD   ARG 917          2HD       ARG 917  -4.416  12.194  -1.036
  656    HE   ARG 917           HE       ARG 917  -5.189  13.869   1.281
  657   1HH1  ARG 917          2HH2      ARG 917  -4.369  13.570  -2.146
  658   2HH1  ARG 917          1HH2      ARG 917  -4.028  15.273  -2.353
  659   1HH2  ARG 917          2HH1      ARG 917  -4.737  16.119   1.006
  660   2HH2  ARG 917          1HH1      ARG 917  -4.238  16.726  -0.556
  661    H    LEU 918           H        LEU 918  -3.685   9.403  -2.602
  662    HA   LEU 918           HA       LEU 918  -2.989   8.028  -0.344
  663   1HB   LEU 918          1HB       LEU 918  -1.473   9.895  -2.158
  664   2HB   LEU 918          2HB       LEU 918  -0.663   9.209  -0.729
  665    HG   LEU 918           HG       LEU 918  -0.312   7.324  -1.918
  666   1HD1  LEU 918          1HD1      LEU 918  -2.264   6.472  -0.771
  667   2HD1  LEU 918          2HD1      LEU 918  -3.356   7.273  -1.926
  668   3HD1  LEU 918          3HD1      LEU 918  -2.346   5.907  -2.457
  669   1HD2  LEU 918          1HD2      LEU 918  -1.363   7.057  -4.222
  670   2HD2  LEU 918          2HD2      LEU 918  -2.194   8.605  -3.938
  671   3HD2  LEU 918          3HD2      LEU 918  -0.415   8.546  -3.994
  672    H    VAL 919           H        VAL 919  -2.968   8.430   1.783
  673    HA   VAL 919           HA       VAL 919  -3.174  11.247   2.666
  674    HB   VAL 919           HB       VAL 919  -4.220  10.431   4.571
  675   1HG1  VAL 919          1HG1      VAL 919  -5.973   9.391   3.594
  676   2HG1  VAL 919          2HG1      VAL 919  -4.992   9.315   2.111
  677   3HG1  VAL 919          3HG1      VAL 919  -4.999   7.943   3.244
  678   1HG2  VAL 919          1HG2      VAL 919  -2.922   7.715   4.097
  679   2HG2  VAL 919          2HG2      VAL 919  -2.253   8.968   5.171
  680   3HG2  VAL 919          3HG2      VAL 919  -3.833   8.233   5.536
  681    H    ALA 920           H        ALA 920  -2.171  10.978   5.260
  682    HA   ALA 920           HA       ALA 920   0.641  11.288   4.768
  683   1HB   ALA 920          1HB       ALA 920  -0.275  12.613   6.497
  684   2HB   ALA 920          2HB       ALA 920  -1.119  11.228   7.232
  685   3HB   ALA 920          3HB       ALA 920   0.651  11.358   7.356
  686    HA   PRO 921           HA       PRO 921   1.465   6.894   5.056
  687   1HB   PRO 921          1HB       PRO 921   4.059   7.019   4.231
  688   2HB   PRO 921          2HB       PRO 921   2.693   7.284   3.099
  689   1HG   PRO 921          1HG       PRO 921   4.301   9.396   4.564
  690   2HG   PRO 921          2HG       PRO 921   3.962   9.313   2.805
  691   1HD   PRO 921          1HD       PRO 921   2.435  10.830   4.477
  692   2HD   PRO 921          2HD       PRO 921   1.676   9.898   3.151
  693    H    CYS 922           H        CYS 922   2.026   5.815   6.872
  694    HA   CYS 922           HA       CYS 922   2.738   6.929   9.261
  695   1HB   CYS 922          1HB       CYS 922   2.098   4.623   9.163
  696   2HB   CYS 922          2HB       CYS 922   3.461   4.220   8.090
  697    HG   CYS 922           HG       CYS 922   4.725   3.410   9.909
  Start of MODEL    6
    1    H    GLY 835           H        GLY 835 -12.490  -4.216  13.257
    2   1HA   GLY 835          1HA       GLY 835 -10.917  -4.150  11.572
    3   2HA   GLY 835          2HA       GLY 835 -11.898  -5.453  10.862
    4    H    SER 836           H        SER 836 -10.384  -2.938   9.797
    5    HA   SER 836           HA       SER 836 -12.614  -1.526   8.481
    6   1HB   SER 836          1HB       SER 836 -10.322  -0.576   9.495
    7   2HB   SER 836          2HB       SER 836  -9.739  -0.966   7.859
    8    HG   SER 836           HG       SER 836 -11.266   0.369   7.002
    9    H    ALA 837           H        ALA 837  -9.573  -3.231   7.533
   10    HA   ALA 837           HA       ALA 837  -9.847  -3.292   4.813
   11   1HB   ALA 837          1HB       ALA 837  -8.458  -5.205   4.828
   12   2HB   ALA 837          2HB       ALA 837  -8.072  -4.372   6.353
   13   3HB   ALA 837          3HB       ALA 837  -9.140  -5.796   6.362
   14    H    ASP 838           H        ASP 838 -11.184  -5.847   6.993
   15    HA   ASP 838           HA       ASP 838 -12.602  -7.303   5.125
   16   1HB   ASP 838          1HB       ASP 838 -13.665  -6.582   7.875
   17   2HB   ASP 838          2HB       ASP 838 -13.956  -8.070   6.949
   18    H    GLU 839           H        GLU 839 -13.553  -4.243   6.727
   19    HA   GLU 839           HA       GLU 839 -16.167  -4.203   5.479
   20   1HB   GLU 839          1HB       GLU 839 -14.613  -2.613   7.388
   21   2HB   GLU 839          2HB       GLU 839 -15.538  -1.600   6.254
   22   1HG   GLU 839          1HG       GLU 839 -17.156  -3.846   7.090
   23   2HG   GLU 839          2HG       GLU 839 -16.512  -3.016   8.523
   24    H    THR 840           H        THR 840 -12.915  -3.187   4.628
   25    HA   THR 840           HA       THR 840 -13.809  -1.364   2.535
   26    HB   THR 840           HB       THR 840 -11.038  -2.543   2.775
   27    HG1  THR 840           1HG      THR 840 -10.756  -0.694   4.262
   28   1HG2  THR 840          1HG2      THR 840 -10.430  -0.249   2.048
   29   2HG2  THR 840          2HG2      THR 840 -11.559  -1.015   0.905
   30   3HG2  THR 840          3HG2      THR 840 -12.152   0.204   2.059
   31    H    LEU 841           H        LEU 841 -12.269  -4.617   2.704
   32    HA   LEU 841           HA       LEU 841 -12.333  -5.039  -0.127
   33   1HB   LEU 841          1HB       LEU 841 -11.923  -6.734   2.327
   34   2HB   LEU 841          2HB       LEU 841 -12.171  -7.524   0.752
   35    HG   LEU 841           HG       LEU 841  -9.731  -6.757   1.618
   36   1HD1  LEU 841          1HD1      LEU 841 -10.930  -7.540  -0.815
   37   2HD1  LEU 841          2HD1      LEU 841  -9.932  -6.123  -1.219
   38   3HD1  LEU 841          3HD1      LEU 841  -9.192  -7.537  -0.430
   39   1HD2  LEU 841          1HD2      LEU 841  -9.586  -4.557  -0.059
   40   2HD2  LEU 841          2HD2      LEU 841 -11.139  -4.304   0.772
   41   3HD2  LEU 841          3HD2      LEU 841  -9.644  -4.490   1.718
   42    H    CYS 842           H        CYS 842 -14.839  -4.682   2.036
   43    HA   CYS 842           HA       CYS 842 -16.619  -6.776   1.485
   44   1HB   CYS 842          1HB       CYS 842 -16.747  -4.663   3.075
   45   2HB   CYS 842          2HB       CYS 842 -17.596  -3.935   1.689
   46    HG   CYS 842           HG       CYS 842 -18.295  -6.442   3.651
   47    H    GLN 843           H        GLN 843 -15.167  -4.673  -0.708
   48    HA   GLN 843           HA       GLN 843 -17.427  -5.000  -2.627
   49   1HB   GLN 843          1HB       GLN 843 -15.204  -2.979  -2.931
   50   2HB   GLN 843          2HB       GLN 843 -16.848  -2.955  -3.613
   51   1HG   GLN 843          1HG       GLN 843 -16.971  -3.084  -0.718
   52   2HG   GLN 843          2HG       GLN 843 -15.947  -1.721  -1.222
   53   1HE2  GLN 843          1HE2      GLN 843 -16.841  -0.094  -2.653
   54   2HE2  GLN 843          2HE2      GLN 843 -18.571   0.160  -2.727
   55    H    THR 844           H        THR 844 -16.301  -7.257  -2.667
   56    HA   THR 844           HA       THR 844 -15.164  -8.750  -3.981
   57    HB   THR 844           HB       THR 844 -15.596  -6.493  -5.650
   58    HG1  THR 844           1HG      THR 844 -16.170  -8.180  -6.728
   59   1HG2  THR 844          1HG2      THR 844 -13.388  -5.805  -5.851
   60   2HG2  THR 844          2HG2      THR 844 -12.741  -7.431  -5.523
   61   3HG2  THR 844          3HG2      THR 844 -13.438  -7.055  -7.117
   62    H    LYS 845           H        LYS 845 -13.095  -5.839  -4.437
   63    HA   LYS 845           HA       LYS 845 -11.117  -6.921  -2.558
   64   1HB   LYS 845          1HB       LYS 845 -10.781  -6.886  -5.551
   65   2HB   LYS 845          2HB       LYS 845  -9.373  -6.589  -4.505
   66   1HG   LYS 845          1HG       LYS 845 -11.237  -8.974  -4.181
   67   2HG   LYS 845          2HG       LYS 845  -9.732  -9.023  -5.130
   68   1HD   LYS 845          1HD       LYS 845  -8.592  -9.420  -3.227
   69   2HD   LYS 845          2HD       LYS 845  -9.085  -7.817  -2.633
   70   1HE   LYS 845          1HE       LYS 845  -9.933  -9.233  -0.975
   71   2HE   LYS 845          2HE       LYS 845 -11.340  -9.019  -2.040
   72   1HZ   LYS 845          1HZ       LYS 845  -9.465 -11.257  -2.283
   73   2HZ   LYS 845          2HZ       LYS 845 -10.841 -11.324  -1.376
   74   3HZ   LYS 845          3HZ       LYS 845 -10.938 -11.089  -3.005
   75    H    VAL 846           H        VAL 846 -12.839  -4.427  -3.921
   76    HA   VAL 846           HA       VAL 846 -12.531  -2.143  -4.086
   77    HB   VAL 846           HB       VAL 846 -11.317  -1.351  -1.838
   78   1HG1  VAL 846          1HG1      VAL 846 -13.917  -2.858  -1.532
   79   2HG1  VAL 846          2HG1      VAL 846 -13.454  -1.268  -0.880
   80   3HG1  VAL 846          3HG1      VAL 846 -13.833  -1.444  -2.610
   81   1HG2  VAL 846          1HG2      VAL 846 -10.953  -4.137  -1.740
   82   2HG2  VAL 846          2HG2      VAL 846 -10.756  -2.993  -0.390
   83   3HG2  VAL 846          3HG2      VAL 846 -12.312  -3.822  -0.633
   84    H    LEU 847           H        LEU 847 -11.238  -1.002  -5.394
   85    HA   LEU 847           HA       LEU 847  -8.357  -0.892  -4.845
   86   1HB   LEU 847          1HB       LEU 847  -9.278  -1.676  -7.621
   87   2HB   LEU 847          2HB       LEU 847  -7.640  -1.746  -6.926
   88    HG   LEU 847           HG       LEU 847  -8.819  -3.991  -7.103
   89   1HD1  LEU 847          1HD1      LEU 847  -7.430  -2.782  -4.841
   90   2HD1  LEU 847          2HD1      LEU 847  -8.522  -4.079  -4.300
   91   3HD1  LEU 847          3HD1      LEU 847  -7.270  -4.421  -5.517
   92   1HD2  LEU 847          1HD2      LEU 847 -10.920  -2.502  -5.923
   93   2HD2  LEU 847          2HD2      LEU 847 -10.891  -4.252  -6.251
   94   3HD2  LEU 847          3HD2      LEU 847 -10.363  -3.633  -4.667
   95    H    LEU 848           H        LEU 848  -9.762   1.211  -4.323
   96    HA   LEU 848           HA       LEU 848 -10.549   2.851  -6.528
   97   1HB   LEU 848          1HB       LEU 848 -10.126   3.140  -3.596
   98   2HB   LEU 848          2HB       LEU 848 -10.002   4.634  -4.555
   99    HG   LEU 848           HG       LEU 848 -12.301   2.704  -4.963
  100   1HD1  LEU 848          1HD1      LEU 848 -13.120   3.198  -2.922
  101   2HD1  LEU 848          2HD1      LEU 848 -11.721   4.243  -2.581
  102   3HD1  LEU 848          3HD1      LEU 848 -13.157   4.915  -3.390
  103   1HD2  LEU 848          1HD2      LEU 848 -12.984   4.290  -6.414
  104   2HD2  LEU 848          2HD2      LEU 848 -12.838   5.553  -5.168
  105   3HD2  LEU 848          3HD2      LEU 848 -11.428   5.116  -6.164
  106    H    ASP 849           H        ASP 849  -9.348   5.272  -6.293
  107    HA   ASP 849           HA       ASP 849  -6.649   4.690  -7.351
  108   1HB   ASP 849          1HB       ASP 849  -6.807   7.077  -8.130
  109   2HB   ASP 849          2HB       ASP 849  -8.061   6.006  -8.792
  110    H    ILE 850           H        ILE 850  -6.556   4.232  -4.722
  111    HA   ILE 850           HA       ILE 850  -5.999   6.651  -3.204
  112    HB   ILE 850           HB       ILE 850  -4.911   4.348  -1.933
  113   1HG1  ILE 850          1HG1      ILE 850  -6.213   3.128  -3.761
  114   2HG1  ILE 850          2HG1      ILE 850  -6.672   2.719  -2.091
  115   1HG2  ILE 850          1HG2      ILE 850  -6.707   6.469  -1.452
  116   2HG2  ILE 850          2HG2      ILE 850  -7.655   4.988  -1.178
  117   3HG2  ILE 850          3HG2      ILE 850  -6.145   5.258  -0.275
  118   1HD1  ILE 850          1HD1      ILE 850  -8.188   4.243  -4.176
  119   2HD1  ILE 850          2HD1      ILE 850  -8.781   3.115  -2.933
  120   3HD1  ILE 850          3HD1      ILE 850  -8.358   4.786  -2.490
  121    H    PHE 851           H        PHE 851  -3.800   3.879  -3.151
  122    HA   PHE 851           HA       PHE 851  -1.471   5.440  -3.071
  123   1HB   PHE 851          1HB       PHE 851  -1.518   2.697  -4.310
  124   2HB   PHE 851          2HB       PHE 851  -0.311   3.420  -3.234
  125    HD1  PHE 851           1HD      PHE 851  -2.459   0.836  -3.310
  126    HD2  PHE 851           2HD      PHE 851  -1.752   4.347  -0.938
  127    HE1  PHE 851           1HE      PHE 851  -3.542  -0.260  -1.366
  128    HE2  PHE 851           2HE      PHE 851  -2.835   3.251   1.006
  129    HZ   PHE 851           HZ       PHE 851  -3.729   0.948   0.792
  130    H    THR 852           H        THR 852  -3.445   6.049  -5.334
  131    HA   THR 852           HA       THR 852  -2.654   5.411  -7.850
  132    HB   THR 852           HB       THR 852  -4.206   7.367  -6.759
  133    HG1  THR 852           1HG      THR 852  -4.857   7.260  -8.735
  134   1HG2  THR 852          1HG2      THR 852  -3.296   9.530  -7.682
  135   2HG2  THR 852          2HG2      THR 852  -2.355   8.882  -6.318
  136   3HG2  THR 852          3HG2      THR 852  -1.752   8.697  -7.983
  137    H    GLY 853           H        GLY 853  -0.599   4.972  -8.470
  138   1HA   GLY 853          1HA       GLY 853   1.540   5.458  -9.180
  139   2HA   GLY 853          2HA       GLY 853   1.250   7.166  -8.782
  140    H    VAL 854           H        VAL 854   0.400   5.365  -6.098
  141    HA   VAL 854           HA       VAL 854   2.806   6.192  -4.677
  142    HB   VAL 854           HB       VAL 854   0.160   4.931  -3.954
  143   1HG1  VAL 854          1HG1      VAL 854   2.060   3.770  -2.718
  144   2HG1  VAL 854          2HG1      VAL 854   2.472   5.354  -2.020
  145   3HG1  VAL 854          3HG1      VAL 854   0.889   4.615  -1.677
  146   1HG2  VAL 854          1HG2      VAL 854   1.659   7.501  -3.477
  147   2HG2  VAL 854          2HG2      VAL 854  -0.037   7.253  -3.958
  148   3HG2  VAL 854          3HG2      VAL 854   0.462   6.966  -2.273
  149    H    ARG 855           H        ARG 855   4.612   5.007  -4.999
  150    HA   ARG 855           HA       ARG 855   4.359   2.075  -5.279
  151   1HB   ARG 855          1HB       ARG 855   6.444   2.136  -6.303
  152   2HB   ARG 855          2HB       ARG 855   5.800   3.733  -6.752
  153   1HG   ARG 855          1HG       ARG 855   6.921   4.621  -4.619
  154   2HG   ARG 855          2HG       ARG 855   7.774   3.061  -4.541
  155   1HD   ARG 855          1HD       ARG 855   8.988   4.977  -5.749
  156   2HD   ARG 855          2HD       ARG 855   8.866   3.434  -6.621
  157    HE   ARG 855           HE       ARG 855   6.801   4.528  -7.724
  158   1HH1  ARG 855          2HH2      ARG 855   9.664   6.266  -6.591
  159   2HH1  ARG 855          1HH2      ARG 855   9.497   7.571  -7.744
  160   1HH2  ARG 855          2HH1      ARG 855   6.580   6.252  -9.247
  161   2HH2  ARG 855          1HH1      ARG 855   7.739   7.563  -9.259
  162    H    LEU 856           H        LEU 856   3.847   1.493  -3.128
  163    HA   LEU 856           HA       LEU 856   5.936   2.134  -1.111
  164   1HB   LEU 856          1HB       LEU 856   4.281   2.205   0.435
  165   2HB   LEU 856          2HB       LEU 856   3.195   2.367  -0.966
  166    HG   LEU 856           HG       LEU 856   2.808  -0.027  -1.023
  167   1HD1  LEU 856          1HD1      LEU 856   3.970  -1.149   1.209
  168   2HD1  LEU 856          2HD1      LEU 856   4.628  -1.266  -0.441
  169   3HD1  LEU 856          3HD1      LEU 856   5.237  -0.019   0.673
  170   1HD2  LEU 856          1HD2      LEU 856   2.707   0.481   1.935
  171   2HD2  LEU 856          2HD2      LEU 856   1.811   1.589   0.868
  172   3HD2  LEU 856          3HD2      LEU 856   1.449  -0.154   0.847
  173    H    TYR 857           H        TYR 857   7.105   0.522  -0.137
  174    HA   TYR 857           HA       TYR 857   7.091  -2.067  -1.476
  175   1HB   TYR 857          1HB       TYR 857   9.249  -1.709  -0.970
  176   2HB   TYR 857          2HB       TYR 857   8.849  -0.494   0.257
  177    HD1  TYR 857           1HD      TYR 857   8.523  -4.220  -0.188
  178    HD2  TYR 857           2HD      TYR 857   9.545  -0.953   2.408
  179    HE1  TYR 857           1HE      TYR 857   9.122  -5.829   1.601
  180    HE2  TYR 857           2HE      TYR 857  10.144  -2.563   4.197
  181    HH   TYR 857           HH       TYR 857   9.857  -6.100   3.744
  182    H    LEU 858           H        LEU 858   5.275  -3.243  -0.969
  183    HA   LEU 858           HA       LEU 858   4.247  -3.355   1.739
  184   1HB   LEU 858          1HB       LEU 858   2.851  -3.586  -0.329
  185   2HB   LEU 858          2HB       LEU 858   3.654  -5.142  -0.652
  186    HG   LEU 858           HG       LEU 858   2.469  -6.220   0.964
  187   1HD1  LEU 858          1HD1      LEU 858   3.647  -5.252   2.818
  188   2HD1  LEU 858          2HD1      LEU 858   2.851  -3.676   2.586
  189   3HD1  LEU 858          3HD1      LEU 858   1.914  -5.068   3.180
  190   1HD2  LEU 858          1HD2      LEU 858   0.295  -5.577   0.800
  191   2HD2  LEU 858          2HD2      LEU 858   0.623  -3.975   1.501
  192   3HD2  LEU 858          3HD2      LEU 858   0.918  -4.266  -0.230
  193    HA   PRO 859           HA       PRO 859   7.301  -6.429   2.892
  194   1HB   PRO 859          1HB       PRO 859   6.774  -6.383   5.565
  195   2HB   PRO 859          2HB       PRO 859   7.608  -5.025   4.743
  196   1HG   PRO 859          1HG       PRO 859   4.651  -5.256   5.371
  197   2HG   PRO 859          2HG       PRO 859   5.746  -3.893   5.773
  198   1HD   PRO 859          1HD       PRO 859   4.186  -3.851   3.539
  199   2HD   PRO 859          2HD       PRO 859   5.862  -3.224   3.487
  200    HA   PRO 860           HA       PRO 860   4.635  -9.951   2.899
  201   1HB   PRO 860          1HB       PRO 860   6.407 -11.882   3.645
  202   2HB   PRO 860          2HB       PRO 860   6.557 -11.014   2.082
  203   1HG   PRO 860          1HG       PRO 860   7.978 -10.376   4.683
  204   2HG   PRO 860          2HG       PRO 860   8.720 -10.610   3.067
  205   1HD   PRO 860          1HD       PRO 860   8.126  -8.123   4.012
  206   2HD   PRO 860          2HD       PRO 860   7.846  -8.531   2.292
  207    H    SER 861           H        SER 861   6.413  -8.819   5.711
  208    HA   SER 861           HA       SER 861   5.096 -10.639   7.567
  209   1HB   SER 861          1HB       SER 861   7.310  -8.803   7.580
  210   2HB   SER 861          2HB       SER 861   6.193  -8.363   8.895
  211    HG   SER 861           HG       SER 861   7.628 -10.726   8.467
  212    H    THR 862           H        THR 862   4.265  -7.759   5.906
  213    HA   THR 862           HA       THR 862   2.660  -6.494   7.906
  214    HB   THR 862           HB       THR 862   3.257  -6.211   5.062
  215    HG1  THR 862           1HG      THR 862   2.191  -4.438   7.009
  216   1HG2  THR 862          1HG2      THR 862   0.876  -6.868   4.829
  217   2HG2  THR 862          2HG2      THR 862   0.420  -5.615   6.009
  218   3HG2  THR 862          3HG2      THR 862   1.114  -5.148   4.437
  219    HA   PRO 863           HA       PRO 863  -0.799  -9.216   8.016
  220   1HB   PRO 863          1HB       PRO 863  -2.643  -7.564   9.154
  221   2HB   PRO 863          2HB       PRO 863  -1.191  -8.119  10.049
  222   1HG   PRO 863          1HG       PRO 863  -1.534  -5.511   8.541
  223   2HG   PRO 863          2HG       PRO 863  -0.984  -5.725  10.235
  224   1HD   PRO 863          1HD       PRO 863   0.794  -5.447   8.188
  225   2HD   PRO 863          2HD       PRO 863   1.110  -6.607   9.513
  226    H    ASP 864           H        ASP 864  -2.582  -9.714   6.741
  227    HA   ASP 864           HA       ASP 864  -4.095  -9.533   5.028
  228   1HB   ASP 864          1HB       ASP 864  -3.956  -6.857   6.167
  229   2HB   ASP 864          2HB       ASP 864  -4.251  -6.793   4.416
  230    H    PHE 865           H        PHE 865  -0.955  -9.199   4.836
  231    HA   PHE 865           HA       PHE 865  -0.171  -7.764   2.631
  232   1HB   PHE 865          1HB       PHE 865   1.191  -9.299   4.133
  233   2HB   PHE 865          2HB       PHE 865   0.632 -10.644   3.125
  234    HD1  PHE 865           1HD      PHE 865   2.098  -7.212   2.623
  235    HD2  PHE 865           2HD      PHE 865   2.092 -11.354   1.485
  236    HE1  PHE 865           1HE      PHE 865   3.937  -6.773   1.018
  237    HE2  PHE 865           2HE      PHE 865   3.930 -10.915  -0.121
  238    HZ   PHE 865           HZ       PHE 865   4.853  -8.625  -0.354
  239    H    SER 866           H        SER 866  -1.756 -10.994   2.635
  240    HA   SER 866           HA       SER 866  -1.750 -11.886   0.150
  241   1HB   SER 866          1HB       SER 866  -3.873 -11.606   2.169
  242   2HB   SER 866          2HB       SER 866  -4.493 -11.781   0.510
  243    HG   SER 866           HG       SER 866  -3.537 -13.662   2.076
  244    H    ARG 867           H        ARG 867  -4.620  -9.849   0.596
  245    HA   ARG 867           HA       ARG 867  -4.598  -8.970  -2.109
  246   1HB   ARG 867          1HB       ARG 867  -5.981  -7.668   0.266
  247   2HB   ARG 867          2HB       ARG 867  -6.456  -7.574  -1.447
  248   1HG   ARG 867          1HG       ARG 867  -7.488  -9.596  -1.383
  249   2HG   ARG 867          2HG       ARG 867  -6.158 -10.340  -0.464
  250   1HD   ARG 867          1HD       ARG 867  -7.008  -9.143   1.588
  251   2HD   ARG 867          2HD       ARG 867  -8.411  -8.614   0.635
  252    HE   ARG 867           HE       ARG 867  -9.303 -10.750   0.779
  253   1HH1  ARG 867          2HH2      ARG 867  -5.906 -10.750   1.759
  254   2HH1  ARG 867          1HH2      ARG 867  -5.936 -12.394   2.356
  255   1HH2  ARG 867          2HH1      ARG 867  -9.343 -12.922   1.569
  256   2HH2  ARG 867          1HH1      ARG 867  -7.896 -13.632   2.248
  257    H    LEU 868           H        LEU 868  -3.428  -7.514   0.940
  258    HA   LEU 868           HA       LEU 868  -2.945  -4.935   0.410
  259   1HB   LEU 868          1HB       LEU 868  -1.375  -7.073   1.739
  260   2HB   LEU 868          2HB       LEU 868  -0.452  -5.616   1.300
  261    HG   LEU 868           HG       LEU 868  -2.660  -5.957   3.278
  262   1HD1  LEU 868          1HD1      LEU 868  -0.008  -4.703   3.000
  263   2HD1  LEU 868          2HD1      LEU 868  -1.193  -3.659   3.820
  264   3HD1  LEU 868          3HD1      LEU 868  -0.845  -5.283   4.460
  265   1HD2  LEU 868          1HD2      LEU 868  -3.298  -3.539   3.011
  266   2HD2  LEU 868          2HD2      LEU 868  -2.372  -3.505   1.491
  267   3HD2  LEU 868          3HD2      LEU 868  -3.801  -4.557   1.640
  268    H    ARG 869           H        ARG 869  -0.846  -7.577  -0.870
  269    HA   ARG 869           HA       ARG 869   0.797  -5.874  -2.440
  270   1HB   ARG 869          1HB       ARG 869   1.306  -8.238  -1.783
  271   2HB   ARG 869          2HB       ARG 869   0.067  -8.786  -2.938
  272   1HG   ARG 869          1HG       ARG 869   1.589  -8.666  -4.594
  273   2HG   ARG 869          2HG       ARG 869   1.737  -6.915  -4.309
  274   1HD   ARG 869          1HD       ARG 869   3.860  -7.315  -3.660
  275   2HD   ARG 869          2HD       ARG 869   3.175  -8.072  -2.206
  276    HE   ARG 869           HE       ARG 869   4.305  -9.432  -4.556
  277   1HH1  ARG 869          2HH2      ARG 869   2.413  -9.641  -1.577
  278   2HH1  ARG 869          1HH2      ARG 869   2.651 -11.363  -1.385
  279   1HH2  ARG 869          2HH1      ARG 869   4.619 -11.707  -4.302
  280   2HH2  ARG 869          1HH1      ARG 869   3.909 -12.541  -2.939
  281    H    ARG 870           H        ARG 870  -1.131  -8.358  -4.080
  282    HA   ARG 870           HA       ARG 870  -1.477  -7.178  -6.483
  283   1HB   ARG 870          1HB       ARG 870  -3.136  -9.002  -4.819
  284   2HB   ARG 870          2HB       ARG 870  -3.972  -8.221  -6.183
  285   1HG   ARG 870          1HG       ARG 870  -3.055  -9.831  -7.485
  286   2HG   ARG 870          2HG       ARG 870  -1.509  -8.975  -7.265
  287   1HD   ARG 870          1HD       ARG 870  -1.347 -10.327  -5.038
  288   2HD   ARG 870          2HD       ARG 870  -2.590 -11.370  -5.763
  289    HE   ARG 870           HE       ARG 870  -0.640 -11.131  -7.721
  290   1HH1  ARG 870          2HH2      ARG 870  -0.773 -12.183  -4.349
  291   2HH1  ARG 870          1HH2      ARG 870   0.530 -13.339  -4.515
  292   1HH2  ARG 870          2HH1      ARG 870   1.081 -12.657  -7.941
  293   2HH2  ARG 870          1HH1      ARG 870   1.587 -13.609  -6.563
  294    H    TYR 871           H        TYR 871  -3.748  -6.669  -3.720
  295    HA   TYR 871           HA       TYR 871  -5.494  -4.872  -4.820
  296   1HB   TYR 871          1HB       TYR 871  -5.412  -5.766  -2.454
  297   2HB   TYR 871          2HB       TYR 871  -4.207  -4.517  -2.098
  298    HD1  TYR 871           1HD      TYR 871  -5.196  -2.932  -0.720
  299    HD2  TYR 871           2HD      TYR 871  -7.379  -4.418  -4.107
  300    HE1  TYR 871           1HE      TYR 871  -7.012  -1.307  -0.262
  301    HE2  TYR 871           2HE      TYR 871  -9.195  -2.793  -3.650
  302    HH   TYR 871           HH       TYR 871  -9.766  -1.300  -0.924
  303    H    PHE 872           H        PHE 872  -2.506  -3.843  -3.063
  304    HA   PHE 872           HA       PHE 872  -2.587  -1.152  -3.759
  305   1HB   PHE 872          1HB       PHE 872  -1.002  -2.436  -2.197
  306   2HB   PHE 872          2HB       PHE 872  -0.040  -2.781  -3.644
  307    HD1  PHE 872           1HD      PHE 872   0.616  -0.690  -5.100
  308    HD2  PHE 872           2HD      PHE 872  -0.572  -0.505  -0.977
  309    HE1  PHE 872           1HE      PHE 872   1.747   1.506  -4.873
  310    HE2  PHE 872           2HE      PHE 872   0.558   1.691  -0.750
  311    HZ   PHE 872           HZ       PHE 872   1.717   2.696  -2.698
  312    H    VAL 873           H        VAL 873   0.093  -2.926  -5.218
  313    HA   VAL 873           HA       VAL 873   0.499  -1.523  -7.456
  314    HB   VAL 873           HB       VAL 873   1.900  -3.339  -7.357
  315   1HG1  VAL 873          1HG1      VAL 873   1.283  -4.937  -5.886
  316   2HG1  VAL 873          2HG1      VAL 873  -0.440  -4.547  -6.102
  317   3HG1  VAL 873          3HG1      VAL 873   0.358  -5.695  -7.204
  318   1HG2  VAL 873          1HG2      VAL 873   1.001  -3.260  -9.658
  319   2HG2  VAL 873          2HG2      VAL 873   1.370  -4.935  -9.181
  320   3HG2  VAL 873          3HG2      VAL 873  -0.315  -4.361  -9.187
  321    H    ALA 874           H        ALA 874  -2.282  -3.660  -6.903
  322    HA   ALA 874           HA       ALA 874  -3.271  -3.745  -9.552
  323   1HB   ALA 874          1HB       ALA 874  -4.522  -3.965  -6.807
  324   2HB   ALA 874          2HB       ALA 874  -5.518  -4.034  -8.280
  325   3HB   ALA 874          3HB       ALA 874  -4.238  -5.242  -8.013
  326    H    PHE 875           H        PHE 875  -4.081  -1.517  -6.830
  327    HA   PHE 875           HA       PHE 875  -5.953   0.097  -7.990
  328   1HB   PHE 875          1HB       PHE 875  -3.532   1.060  -6.431
  329   2HB   PHE 875          2HB       PHE 875  -5.073   1.915  -6.612
  330    HD1  PHE 875           1HD      PHE 875  -4.530   1.792  -3.964
  331    HD2  PHE 875           2HD      PHE 875  -5.863  -1.479  -6.408
  332    HE1  PHE 875           1HE      PHE 875  -5.401   0.640  -1.948
  333    HE2  PHE 875           2HE      PHE 875  -6.734  -2.631  -4.392
  334    HZ   PHE 875           HZ       PHE 875  -6.503  -1.571  -2.162
  335    H    ASP 876           H        ASP 876  -2.391   0.355  -8.454
  336    HA   ASP 876           HA       ASP 876  -2.107   0.807 -11.044
  337   1HB   ASP 876          1HB       ASP 876  -3.744   3.015  -9.931
  338   2HB   ASP 876          2HB       ASP 876  -2.396   3.523 -10.971
  339    H    GLY 877           H        GLY 877  -1.035   0.875  -8.048
  340   1HA   GLY 877          1HA       GLY 877   1.145   2.838  -8.430
  341   2HA   GLY 877          2HA       GLY 877   0.756   1.955  -6.936
  342    H    ASP 878           H        ASP 878   2.761   1.035  -6.543
  343    HA   ASP 878           HA       ASP 878   3.426  -1.279  -8.181
  344   1HB   ASP 878          1HB       ASP 878   4.851   1.279  -8.464
  345   2HB   ASP 878          2HB       ASP 878   5.920  -0.078  -8.047
  346    H    LEU 879           H        LEU 879   5.035  -2.642  -7.136
  347    HA   LEU 879           HA       LEU 879   5.580  -1.890  -4.311
  348   1HB   LEU 879          1HB       LEU 879   4.702  -4.662  -5.181
  349   2HB   LEU 879          2HB       LEU 879   4.847  -4.019  -3.528
  350    HG   LEU 879           HG       LEU 879   2.816  -3.250  -5.658
  351   1HD1  LEU 879          1HD1      LEU 879   1.239  -4.226  -4.252
  352   2HD1  LEU 879          2HD1      LEU 879   2.644  -5.273  -3.941
  353   3HD1  LEU 879          3HD1      LEU 879   2.229  -3.976  -2.794
  354   1HD2  LEU 879          1HD2      LEU 879   2.827  -1.171  -4.775
  355   2HD2  LEU 879          2HD2      LEU 879   2.241  -1.892  -3.257
  356   3HD2  LEU 879          3HD2      LEU 879   3.986  -1.652  -3.513
  357    H    VAL 880           H        VAL 880   7.686  -2.076  -3.844
  358    HA   VAL 880           HA       VAL 880   9.344  -3.776  -5.640
  359    HB   VAL 880           HB       VAL 880  10.983  -2.082  -4.076
  360   1HG1  VAL 880          1HG1      VAL 880  10.176  -2.494  -6.898
  361   2HG1  VAL 880          2HG1      VAL 880  10.796  -0.865  -6.538
  362   3HG1  VAL 880          3HG1      VAL 880  11.798  -2.295  -6.193
  363   1HG2  VAL 880          1HG2      VAL 880   8.419  -0.774  -5.034
  364   2HG2  VAL 880          2HG2      VAL 880   9.216  -0.627  -3.450
  365   3HG2  VAL 880          3HG2      VAL 880   9.933   0.149  -4.882
  366    H    GLN 881           H        GLN 881  10.685  -5.333  -4.780
  367    HA   GLN 881           HA       GLN 881   9.985  -6.347  -2.180
  368   1HB   GLN 881          1HB       GLN 881  12.347  -7.096  -3.942
  369   2HB   GLN 881          2HB       GLN 881  11.580  -8.091  -2.681
  370   1HG   GLN 881          1HG       GLN 881   9.658  -8.468  -3.963
  371   2HG   GLN 881          2HG       GLN 881   9.924  -7.027  -4.968
  372   1HE2  GLN 881          1HE2      GLN 881  10.617 -10.425  -4.512
  373   2HE2  GLN 881          2HE2      GLN 881  11.538 -10.661  -5.982
  374    H    GLU 882           H        GLU 882  10.941  -6.045  -0.231
  375    HA   GLU 882           HA       GLU 882  12.312  -3.939   0.608
  376   1HB   GLU 882          1HB       GLU 882  11.727  -5.838   2.058
  377   2HB   GLU 882          2HB       GLU 882  13.049  -6.798   1.351
  378   1HG   GLU 882          1HG       GLU 882  14.230  -4.352   2.110
  379   2HG   GLU 882          2HG       GLU 882  13.146  -4.779   3.452
  380    H    PHE 883           H        PHE 883  14.186  -6.851  -0.429
  381    HA   PHE 883           HA       PHE 883  16.627  -5.349  -0.656
  382   1HB   PHE 883          1HB       PHE 883  17.573  -7.385  -1.417
  383   2HB   PHE 883          2HB       PHE 883  16.359  -7.831  -0.206
  384    HD1  PHE 883           1HD      PHE 883  17.306  -7.973  -3.744
  385    HD2  PHE 883           2HD      PHE 883  14.236  -8.886  -0.882
  386    HE1  PHE 883           1HE      PHE 883  16.217  -9.473  -5.391
  387    HE2  PHE 883           2HE      PHE 883  13.147 -10.386  -2.529
  388    HZ   PHE 883           HZ       PHE 883  14.137 -10.680  -4.784
  389    H    ASP 884           H        ASP 884  14.064  -4.615  -2.274
  390    HA   ASP 884           HA       ASP 884  15.547  -3.942  -4.713
  391   1HB   ASP 884          1HB       ASP 884  13.030  -5.647  -4.724
  392   2HB   ASP 884          2HB       ASP 884  13.697  -4.834  -6.156
  393    H    MET 885           H        MET 885  15.332  -1.770  -4.224
  394    HA   MET 885           HA       MET 885  12.680  -0.643  -4.702
  395   1HB   MET 885          1HB       MET 885  13.551   0.717  -2.378
  396   2HB   MET 885          2HB       MET 885  12.132  -0.344  -2.545
  397   1HG   MET 885          1HG       MET 885  14.640  -1.841  -2.331
  398   2HG   MET 885          2HG       MET 885  14.368  -0.792  -0.930
  399   1HE   MET 885          1HE       MET 885  11.343  -1.426   0.554
  400   2HE   MET 885          2HE       MET 885  12.578  -2.442   1.334
  401   3HE   MET 885          3HE       MET 885  13.030  -0.866   0.643
  402    H    THR 886           H        THR 886  15.868   0.264  -3.255
  403    HA   THR 886           HA       THR 886  16.939   2.345  -3.622
  404    HB   THR 886           HB       THR 886  18.438   1.961  -5.399
  405    HG1  THR 886           1HG      THR 886  17.838   1.114  -7.278
  406   1HG2  THR 886          1HG2      THR 886  18.774  -0.525  -5.415
  407   2HG2  THR 886          2HG2      THR 886  18.505   0.128  -3.781
  408   3HG2  THR 886          3HG2      THR 886  17.186  -0.711  -4.633
  409    H    SER 887           H        SER 887  14.889   1.486  -6.462
  410    HA   SER 887           HA       SER 887  14.567   4.376  -7.019
  411   1HB   SER 887          1HB       SER 887  14.535   1.883  -8.574
  412   2HB   SER 887          2HB       SER 887  13.164   2.955  -8.948
  413    HG   SER 887           HG       SER 887  15.613   4.201  -8.665
  414    H    ALA 888           H        ALA 888  13.053   1.804  -5.367
  415    HA   ALA 888           HA       ALA 888  10.368   1.962  -5.811
  416   1HB   ALA 888          1HB       ALA 888  11.454   0.581  -4.062
  417   2HB   ALA 888          2HB       ALA 888  11.722   2.045  -3.085
  418   3HB   ALA 888          3HB       ALA 888  10.064   1.489  -3.418
  419    H    THR 889           H        THR 889   8.689   3.123  -4.333
  420    HA   THR 889           HA       THR 889   9.463   5.995  -4.122
  421    HB   THR 889           HB       THR 889   7.804   5.018  -6.035
  422    HG1  THR 889           1HG      THR 889   7.576   7.082  -6.337
  423   1HG2  THR 889          1HG2      THR 889   5.837   6.022  -3.988
  424   2HG2  THR 889          2HG2      THR 889   5.567   4.968  -5.397
  425   3HG2  THR 889          3HG2      THR 889   6.334   4.314  -3.930
  426    H    HIS 890           H        HIS 890   7.341   3.336  -2.998
  427    HA   HIS 890           HA       HIS 890   7.095   4.804  -0.415
  428   1HB   HIS 890          1HB       HIS 890   5.045   3.305  -2.046
  429   2HB   HIS 890          2HB       HIS 890   4.870   3.462  -0.289
  430    HD1  HIS 890           1HD      HIS 890   6.072   6.261  -2.684
  431    HD2  HIS 890           2HD      HIS 890   2.907   5.194  -0.122
  432    HE1  HIS 890           1HE      HIS 890   4.538   8.300  -2.521
  433    H    VAL 891           H        VAL 891   6.793   3.384   1.470
  434    HA   VAL 891           HA       VAL 891   7.527   0.564   1.097
  435    HB   VAL 891           HB       VAL 891   9.365   0.943   2.900
  436   1HG1  VAL 891          1HG1      VAL 891  10.761   0.576   1.160
  437   2HG1  VAL 891          2HG1      VAL 891   9.359   0.826   0.092
  438   3HG1  VAL 891          3HG1      VAL 891  10.436   2.189   0.480
  439   1HG2  VAL 891          1HG2      VAL 891   8.943   3.737   1.773
  440   2HG2  VAL 891          2HG2      VAL 891   8.931   3.235   3.481
  441   3HG2  VAL 891          3HG2      VAL 891  10.455   3.228   2.562
  442    H    LEU 892           H        LEU 892   6.342  -0.623   2.473
  443    HA   LEU 892           HA       LEU 892   4.754   0.715   4.508
  444   1HB   LEU 892          1HB       LEU 892   4.553  -1.619   2.956
  445   2HB   LEU 892          2HB       LEU 892   4.768  -2.198   4.626
  446    HG   LEU 892           HG       LEU 892   2.973   0.065   4.632
  447   1HD1  LEU 892          1HD1      LEU 892   2.603  -1.960   2.455
  448   2HD1  LEU 892          2HD1      LEU 892   1.157  -1.483   3.377
  449   3HD1  LEU 892          3HD1      LEU 892   2.110  -0.250   2.517
  450   1HD2  LEU 892          1HD2      LEU 892   1.463  -2.131   5.257
  451   2HD2  LEU 892          2HD2      LEU 892   3.103  -2.775   5.505
  452   3HD2  LEU 892          3HD2      LEU 892   2.570  -1.329   6.397
  453    H    GLY 893           H        GLY 893   5.360   1.075   6.558
  454   1HA   GLY 893          1HA       GLY 893   6.651   1.023   8.463
  455   2HA   GLY 893          2HA       GLY 893   6.522  -0.743   8.300
  456    H    SER 894           H        SER 894   8.623   1.955   8.249
  457    HA   SER 894           HA       SER 894  10.953   1.859   8.279
  458   1HB   SER 894          1HB       SER 894  10.701  -0.831   6.884
  459   2HB   SER 894          2HB       SER 894  12.156  -0.144   7.645
  460    HG   SER 894           HG       SER 894   9.760  -0.515   9.091
  461    H    ARG 895           H        ARG 895  12.714   1.997   6.568
  462    HA   ARG 895           HA       ARG 895  11.631   2.320   3.835
  463   1HB   ARG 895          1HB       ARG 895  12.789   4.568   3.719
  464   2HB   ARG 895          2HB       ARG 895  11.345   4.526   4.759
  465   1HG   ARG 895          1HG       ARG 895  12.668   4.424   6.754
  466   2HG   ARG 895          2HG       ARG 895  14.153   4.078   5.835
  467   1HD   ARG 895          1HD       ARG 895  13.048   6.491   4.785
  468   2HD   ARG 895          2HD       ARG 895  13.025   6.634   6.556
  469    HE   ARG 895           HE       ARG 895  15.550   5.598   5.687
  470   1HH1  ARG 895          2HH2      ARG 895  13.604   8.550   5.767
  471   2HH1  ARG 895          1HH2      ARG 895  14.986   9.623   5.780
  472   1HH2  ARG 895          2HH1      ARG 895  17.374   7.017   5.704
  473   2HH2  ARG 895          1HH1      ARG 895  17.135   8.749   5.744
  474    H    ASP 896           H        ASP 896  14.320   2.034   6.119
  475    HA   ASP 896           HA       ASP 896  16.649   2.174   5.065
  476   1HB   ASP 896          1HB       ASP 896  16.425   0.644   6.865
  477   2HB   ASP 896          2HB       ASP 896  15.385  -0.443   5.919
  478    H    LYS 897           H        LYS 897  15.108  -0.858   3.929
  479    HA   LYS 897           HA       LYS 897  16.509  -1.411   1.726
  480   1HB   LYS 897          1HB       LYS 897  13.836  -1.578   0.797
  481   2HB   LYS 897          2HB       LYS 897  14.804  -2.861   1.562
  482   1HG   LYS 897          1HG       LYS 897  12.877  -2.683   2.937
  483   2HG   LYS 897          2HG       LYS 897  14.126  -1.764   3.811
  484   1HD   LYS 897          1HD       LYS 897  13.222   0.287   2.463
  485   2HD   LYS 897          2HD       LYS 897  11.789  -0.732   2.186
  486   1HE   LYS 897          1HE       LYS 897  12.151  -1.111   4.861
  487   2HE   LYS 897          2HE       LYS 897  12.773   0.545   4.690
  488   1HZ   LYS 897          1HZ       LYS 897  10.305   0.164   5.093
  489   2HZ   LYS 897          2HZ       LYS 897  10.764   1.287   3.975
  490   3HZ   LYS 897          3HZ       LYS 897  10.230  -0.195   3.485
  491    H    ASN 898           H        ASN 898  14.217   1.301   2.003
  492    HA   ASN 898           HA       ASN 898  15.513   2.593  -0.278
  493   1HB   ASN 898          1HB       ASN 898  13.823   1.196  -1.386
  494   2HB   ASN 898          2HB       ASN 898  12.561   1.863  -0.328
  495   1HD2  ASN 898          1HD2      ASN 898  13.424   1.987  -3.392
  496   2HD2  ASN 898          2HD2      ASN 898  13.179   3.678  -3.773
  497    HA   PRO 899           HA       PRO 899  14.368   5.546   2.976
  498   1HB   PRO 899          1HB       PRO 899  16.475   7.227   2.581
  499   2HB   PRO 899          2HB       PRO 899  16.668   5.649   3.411
  500   1HG   PRO 899          1HG       PRO 899  17.163   6.258   0.483
  501   2HG   PRO 899          2HG       PRO 899  18.284   5.458   1.632
  502   1HD   PRO 899          1HD       PRO 899  16.683   4.010  -0.032
  503   2HD   PRO 899          2HD       PRO 899  16.952   3.479   1.655
  504    H    ALA 900           H        ALA 900  14.682   5.625  -0.459
  505    HA   ALA 900           HA       ALA 900  13.789   8.417  -0.693
  506   1HB   ALA 900          1HB       ALA 900  15.161   6.500  -2.341
  507   2HB   ALA 900          2HB       ALA 900  13.684   7.026  -3.182
  508   3HB   ALA 900          3HB       ALA 900  14.879   8.231  -2.645
  509    H    ALA 901           H        ALA 901  12.332   5.595   0.165
  510    HA   ALA 901           HA       ALA 901   9.913   5.991  -1.489
  511   1HB   ALA 901          1HB       ALA 901  10.785   3.702  -1.191
  512   2HB   ALA 901          2HB       ALA 901  10.634   3.872   0.575
  513   3HB   ALA 901          3HB       ALA 901   9.177   3.878  -0.448
  514    H    GLN 902           H        GLN 902   8.121   4.937   0.547
  515    HA   GLN 902           HA       GLN 902   8.098   7.225   2.458
  516   1HB   GLN 902          1HB       GLN 902   5.979   6.170   0.606
  517   2HB   GLN 902          2HB       GLN 902   5.489   6.822   2.188
  518   1HG   GLN 902          1HG       GLN 902   7.155   8.254   0.077
  519   2HG   GLN 902          2HG       GLN 902   5.463   8.602   0.498
  520   1HE2  GLN 902          1HE2      GLN 902   5.709   8.262   3.350
  521   2HE2  GLN 902          2HE2      GLN 902   6.649   9.606   3.963
  522    H    GLN 903           H        GLN 903   7.875   6.665   4.554
  523    HA   GLN 903           HA       GLN 903   7.630   3.813   5.185
  524   1HB   GLN 903          1HB       GLN 903   8.257   6.330   6.749
  525   2HB   GLN 903          2HB       GLN 903   7.951   4.777   7.562
  526   1HG   GLN 903          1HG       GLN 903  10.040   4.093   7.093
  527   2HG   GLN 903          2HG       GLN 903   9.743   4.325   5.357
  528   1HE2  GLN 903          1HE2      GLN 903  10.201   6.414   4.394
  529   2HE2  GLN 903          2HE2      GLN 903  11.362   7.492   5.139
  530    H    VAL 904           H        VAL 904   5.327   4.036   4.160
  531    HA   VAL 904           HA       VAL 904   3.347   5.232   5.951
  532    HB   VAL 904           HB       VAL 904   1.993   5.113   4.145
  533   1HG1  VAL 904          1HG1      VAL 904   4.471   5.513   3.277
  534   2HG1  VAL 904          2HG1      VAL 904   4.226   3.927   2.507
  535   3HG1  VAL 904          3HG1      VAL 904   3.136   5.280   2.122
  536   1HG2  VAL 904          1HG2      VAL 904   1.911   2.956   2.728
  537   2HG2  VAL 904          2HG2      VAL 904   2.994   2.253   3.954
  538   3HG2  VAL 904          3HG2      VAL 904   1.376   2.830   4.421
  539    H    SER 905           H        SER 905   1.335   3.704   6.369
  540    HA   SER 905           HA       SER 905   2.355   1.078   7.335
  541   1HB   SER 905          1HB       SER 905   1.614   1.451   9.466
  542   2HB   SER 905          2HB       SER 905   1.902   3.150   9.019
  543    HG   SER 905           HG       SER 905  -0.137   3.348   9.474
  544    HA   PRO 906           HA       PRO 906  -1.435  -0.720   5.973
  545   1HB   PRO 906          1HB       PRO 906  -2.726  -1.827   8.102
  546   2HB   PRO 906          2HB       PRO 906  -1.106  -2.393   7.580
  547   1HG   PRO 906          1HG       PRO 906  -1.736  -0.381   9.759
  548   2HG   PRO 906          2HG       PRO 906  -0.701  -1.841   9.892
  549   1HD   PRO 906          1HD       PRO 906   0.366   0.618   9.398
  550   2HD   PRO 906          2HD       PRO 906   1.005  -0.832   8.566
  551    H    GLU 907           H        GLU 907  -1.819   1.556   8.674
  552    HA   GLU 907           HA       GLU 907  -4.644   1.958   8.322
  553   1HB   GLU 907          1HB       GLU 907  -2.885   2.566  10.274
  554   2HB   GLU 907          2HB       GLU 907  -2.926   4.133   9.431
  555   1HG   GLU 907          1HG       GLU 907  -5.391   2.592  10.339
  556   2HG   GLU 907          2HG       GLU 907  -4.650   3.929  11.246
  557    H    TRP 908           H        TRP 908  -1.723   3.243   6.818
  558    HA   TRP 908           HA       TRP 908  -2.896   5.594   5.696
  559   1HB   TRP 908          1HB       TRP 908  -0.489   5.268   5.897
  560   2HB   TRP 908          2HB       TRP 908  -0.561   3.871   4.814
  561    HD1  TRP 908           HD       TRP 908  -0.952   7.689   4.778
  562    HE1  TRP 908           1HE      TRP 908  -0.480   8.578   2.438
  563    HE3  TRP 908           3HE      TRP 908  -0.447   3.235   2.308
  564    HZ2  TRP 908           2HZ      TRP 908   0.052   7.497  -0.193
  565    HZ3  TRP 908           3HZ      TRP 908   0.042   3.204  -0.110
  566    HH2  TRP 908           HH       TRP 908   0.294   5.321  -1.372
  567    H    ILE 909           H        ILE 909  -2.193   2.358   4.257
  568    HA   ILE 909           HA       ILE 909  -3.259   2.718   1.743
  569    HB   ILE 909           HB       ILE 909  -3.028   0.409   3.633
  570   1HG1  ILE 909          1HG1      ILE 909  -2.250  -0.042   0.887
  571   2HG1  ILE 909          2HG1      ILE 909  -1.626   1.537   1.421
  572   1HG2  ILE 909          1HG2      ILE 909  -5.007  -0.433   2.840
  573   2HG2  ILE 909          2HG2      ILE 909  -5.006   0.630   1.413
  574   3HG2  ILE 909          3HG2      ILE 909  -4.011  -0.845   1.424
  575   1HD1  ILE 909          1HD1      ILE 909  -0.441   0.578   3.243
  576   2HD1  ILE 909          2HD1      ILE 909  -1.356  -0.946   3.144
  577   3HD1  ILE 909          3HD1      ILE 909  -0.157  -0.544   1.891
  578    H    TRP 910           H        TRP 910  -5.084   1.605   4.658
  579    HA   TRP 910           HA       TRP 910  -7.618   1.543   3.440
  580   1HB   TRP 910          1HB       TRP 910  -7.074   2.359   6.301
  581   2HB   TRP 910          2HB       TRP 910  -8.493   1.521   5.655
  582    HD1  TRP 910           HD       TRP 910  -5.819   0.775   7.789
  583    HE1  TRP 910           1HE      TRP 910  -5.072  -1.659   7.745
  584    HE3  TRP 910           3HE      TRP 910  -7.995  -0.656   3.383
  585    HZ2  TRP 910           2HZ      TRP 910  -5.376  -3.957   6.012
  586    HZ3  TRP 910           3HZ      TRP 910  -7.745  -2.972   2.570
  587    HH2  TRP 910           HH       TRP 910  -6.442  -4.631   3.868
  588    H    ALA 911           H        ALA 911  -6.294   4.144   5.570
  589    HA   ALA 911           HA       ALA 911  -8.317   6.014   5.141
  590   1HB   ALA 911          1HB       ALA 911  -6.661   6.377   6.840
  591   2HB   ALA 911          2HB       ALA 911  -5.340   6.350   5.647
  592   3HB   ALA 911          3HB       ALA 911  -6.494   7.705   5.666
  593    H    CYS 912           H        CYS 912  -5.568   5.116   3.091
  594    HA   CYS 912           HA       CYS 912  -5.807   7.356   1.298
  595   1HB   CYS 912          1HB       CYS 912  -4.565   4.599   0.925
  596   2HB   CYS 912          2HB       CYS 912  -4.315   6.005  -0.140
  597    HG   CYS 912           HG       CYS 912  -4.046   6.858   2.877
  598    H    ILE 913           H        ILE 913  -6.244   3.908   0.400
  599    HA   ILE 913           HA       ILE 913  -7.808   4.264  -1.822
  600    HB   ILE 913           HB       ILE 913  -7.031   2.077  -1.223
  601   1HG1  ILE 913          1HG1      ILE 913 -10.058   2.114  -0.871
  602   2HG1  ILE 913          2HG1      ILE 913  -9.220   2.216  -2.438
  603   1HG2  ILE 913          1HG2      ILE 913  -6.989   1.447   0.939
  604   2HG2  ILE 913          2HG2      ILE 913  -7.975   2.862   1.380
  605   3HG2  ILE 913          3HG2      ILE 913  -8.765   1.332   0.929
  606   1HD1  ILE 913          1HD1      ILE 913  -8.253  -0.004  -0.765
  607   2HD1  ILE 913          2HD1      ILE 913  -9.986  -0.134  -1.154
  608   3HD1  ILE 913          3HD1      ILE 913  -8.786  -0.009  -2.464
  609    H    ARG 914           H        ARG 914  -8.873   4.269   1.595
  610    HA   ARG 914           HA       ARG 914 -11.671   4.444   0.999
  611   1HB   ARG 914          1HB       ARG 914 -10.599   3.726   3.185
  612   2HB   ARG 914          2HB       ARG 914 -10.227   5.442   3.479
  613   1HG   ARG 914          1HG       ARG 914 -12.967   5.273   2.662
  614   2HG   ARG 914          2HG       ARG 914 -12.703   4.047   3.925
  615   1HD   ARG 914          1HD       ARG 914 -12.596   5.635   5.514
  616   2HD   ARG 914          2HD       ARG 914 -11.317   6.490   4.625
  617    HE   ARG 914           HE       ARG 914 -13.676   7.122   3.292
  618   1HH1  ARG 914          2HH2      ARG 914 -12.400   7.418   6.576
  619   2HH1  ARG 914          1HH2      ARG 914 -13.311   8.865   6.946
  620   1HH2  ARG 914          2HH1      ARG 914 -14.879   9.033   3.781
  621   2HH2  ARG 914          1HH1      ARG 914 -14.724   9.786   5.352
  622    H    LYS 915           H        LYS 915  -9.027   6.718   0.955
  623    HA   LYS 915           HA       LYS 915 -10.913   9.005   0.966
  624   1HB   LYS 915          1HB       LYS 915  -7.904   8.733   1.232
  625   2HB   LYS 915          2HB       LYS 915  -8.693  10.302   0.942
  626   1HG   LYS 915          1HG       LYS 915  -9.551   8.450   3.192
  627   2HG   LYS 915          2HG       LYS 915  -8.266   9.663   3.401
  628   1HD   LYS 915          1HD       LYS 915  -9.763  11.471   2.921
  629   2HD   LYS 915          2HD       LYS 915 -11.018  10.363   2.315
  630   1HE   LYS 915          1HE       LYS 915 -11.885  10.442   4.401
  631   2HE   LYS 915          2HE       LYS 915 -10.519   9.408   4.877
  632   1HZ   LYS 915          1HZ       LYS 915 -11.003  11.708   5.988
  633   2HZ   LYS 915          2HZ       LYS 915  -9.472  11.119   5.819
  634   3HZ   LYS 915          3HZ       LYS 915 -10.043  12.247   4.760
  635    H    ARG 916           H        ARG 916  -9.278   6.871  -1.147
  636    HA   ARG 916           HA       ARG 916  -9.142   6.822  -3.434
  637   1HB   ARG 916          1HB       ARG 916 -11.383   8.427  -2.891
  638   2HB   ARG 916          2HB       ARG 916 -10.427   9.362  -4.066
  639   1HG   ARG 916          1HG       ARG 916 -10.780   6.415  -4.542
  640   2HG   ARG 916          2HG       ARG 916 -12.159   7.492  -4.868
  641   1HD   ARG 916          1HD       ARG 916  -9.346   7.826  -5.988
  642   2HD   ARG 916          2HD       ARG 916 -10.738   7.176  -6.880
  643    HE   ARG 916           HE       ARG 916 -10.172   9.969  -6.289
  644   1HH1  ARG 916          2HH2      ARG 916 -12.674   7.571  -6.992
  645   2HH1  ARG 916          1HH2      ARG 916 -13.804   8.740  -7.639
  646   1HH2  ARG 916          2HH1      ARG 916 -11.665  11.512  -7.143
  647   2HH2  ARG 916          1HH1      ARG 916 -13.229  10.986  -7.725
  648    H    ARG 917           H        ARG 917  -7.853   9.177  -1.437
  649    HA   ARG 917           HA       ARG 917  -5.954   9.986  -3.567
  650   1HB   ARG 917          1HB       ARG 917  -6.138  12.239  -1.970
  651   2HB   ARG 917          2HB       ARG 917  -6.902  12.039  -3.565
  652   1HG   ARG 917          1HG       ARG 917  -8.339  10.909  -1.187
  653   2HG   ARG 917          2HG       ARG 917  -8.328  12.679  -1.378
  654   1HD   ARG 917          1HD       ARG 917  -9.077  12.317  -3.779
  655   2HD   ARG 917          2HD       ARG 917  -9.309  10.603  -3.373
  656    HE   ARG 917           HE       ARG 917 -10.680  12.202  -1.458
  657   1HH1  ARG 917          2HH2      ARG 917 -10.796  11.266  -4.865
  658   2HH1  ARG 917          1HH2      ARG 917 -12.532  11.437  -4.995
  659   1HH2  ARG 917          2HH1      ARG 917 -12.974  12.428  -1.629
  660   2HH2  ARG 917          1HH1      ARG 917 -13.774  12.099  -3.149
  661    H    LEU 918           H        LEU 918  -4.026   9.244  -2.917
  662    HA   LEU 918           HA       LEU 918  -3.242   8.144  -0.594
  663   1HB   LEU 918          1HB       LEU 918  -1.783   9.953  -2.514
  664   2HB   LEU 918          2HB       LEU 918  -0.951   9.351  -1.060
  665    HG   LEU 918           HG       LEU 918  -0.562   7.425  -2.170
  666   1HD1  LEU 918          1HD1      LEU 918  -2.438   6.526  -0.980
  667   2HD1  LEU 918          2HD1      LEU 918  -3.599   7.323  -2.069
  668   3HD1  LEU 918          3HD1      LEU 918  -2.612   5.965  -2.660
  669   1HD2  LEU 918          1HD2      LEU 918  -0.753   8.598  -4.291
  670   2HD2  LEU 918          2HD2      LEU 918  -1.571   7.025  -4.447
  671   3HD2  LEU 918          3HD2      LEU 918  -2.529   8.509  -4.228
  672    H    VAL 919           H        VAL 919  -3.241   8.674   1.504
  673    HA   VAL 919           HA       VAL 919  -3.512  11.533   2.218
  674    HB   VAL 919           HB       VAL 919  -4.550  10.810   4.161
  675   1HG1  VAL 919          1HG1      VAL 919  -5.194   9.388   1.768
  676   2HG1  VAL 919          2HG1      VAL 919  -5.328   8.235   3.118
  677   3HG1  VAL 919          3HG1      VAL 919  -6.260   9.751   3.146
  678   1HG2  VAL 919          1HG2      VAL 919  -4.111   8.670   5.255
  679   2HG2  VAL 919          2HG2      VAL 919  -3.136   8.125   3.869
  680   3HG2  VAL 919          3HG2      VAL 919  -2.560   9.463   4.891
  681    H    ALA 920           H        ALA 920  -2.501  11.479   4.807
  682    HA   ALA 920           HA       ALA 920   0.297  11.821   4.305
  683   1HB   ALA 920          1HB       ALA 920   0.144  12.986   6.220
  684   2HB   ALA 920          2HB       ALA 920  -1.579  12.543   6.284
  685   3HB   ALA 920          3HB       ALA 920  -0.371  11.537   7.119
  686    HA   PRO 921           HA       PRO 921   1.249   7.473   4.815
  687   1HB   PRO 921          1HB       PRO 921   3.836   7.630   3.976
  688   2HB   PRO 921          2HB       PRO 921   2.461   7.796   2.836
  689   1HG   PRO 921          1HG       PRO 921   4.010  10.026   4.184
  690   2HG   PRO 921          2HG       PRO 921   3.669   9.842   2.432
  691   1HD   PRO 921          1HD       PRO 921   2.103  11.400   4.029
  692   2HD   PRO 921          2HD       PRO 921   1.368  10.378   2.757
  693    H    CYS 922           H        CYS 922   1.821   6.520   6.696
  694    HA   CYS 922           HA       CYS 922   4.130   7.271   8.208
  695   1HB   CYS 922          1HB       CYS 922   2.150   9.068   8.634
  696   2HB   CYS 922          2HB       CYS 922   1.681   7.825   9.821
  697    HG   CYS 922           HG       CYS 922   4.333   9.698   9.503
  Start of MODEL    7
    1    H    GLY 835           H        GLY 835 -12.340  -2.250  12.013
    2   1HA   GLY 835          1HA       GLY 835 -10.489  -3.996  10.726
    3   2HA   GLY 835          2HA       GLY 835 -12.025  -4.851  10.999
    4    H    SER 836           H        SER 836 -10.834  -1.640   9.846
    5    HA   SER 836           HA       SER 836 -13.107  -0.886   8.409
    6   1HB   SER 836          1HB       SER 836 -10.149  -0.355   8.044
    7   2HB   SER 836          2HB       SER 836 -11.365   0.357   6.957
    8    HG   SER 836           HG       SER 836 -11.370   0.566   9.790
    9    H    ALA 837           H        ALA 837 -10.296  -2.860   7.348
   10    HA   ALA 837           HA       ALA 837 -10.702  -3.205   4.700
   11   1HB   ALA 837          1HB       ALA 837  -9.544  -5.197   4.896
   12   2HB   ALA 837          2HB       ALA 837  -9.199  -4.482   6.489
   13   3HB   ALA 837          3HB       ALA 837 -10.468  -5.719   6.325
   14    H    ASP 838           H        ASP 838 -12.290  -5.465   7.025
   15    HA   ASP 838           HA       ASP 838 -14.040  -6.727   5.374
   16   1HB   ASP 838          1HB       ASP 838 -14.373  -5.676   8.189
   17   2HB   ASP 838          2HB       ASP 838 -15.672  -6.590   7.392
   18    H    GLU 839           H        GLU 839 -14.477  -3.440   6.756
   19    HA   GLU 839           HA       GLU 839 -17.029  -3.085   5.405
   20   1HB   GLU 839          1HB       GLU 839 -15.397  -1.710   7.395
   21   2HB   GLU 839          2HB       GLU 839 -16.035  -0.578   6.178
   22   1HG   GLU 839          1HG       GLU 839 -18.052  -2.536   6.945
   23   2HG   GLU 839          2HG       GLU 839 -17.427  -1.679   8.370
   24    H    THR 840           H        THR 840 -13.619  -2.457   4.756
   25    HA   THR 840           HA       THR 840 -14.315  -0.792   2.416
   26    HB   THR 840           HB       THR 840 -11.644  -1.586   3.643
   27    HG1  THR 840           1HG      THR 840 -11.866   0.182   4.754
   28   1HG2  THR 840          1HG2      THR 840 -10.629  -0.635   1.858
   29   2HG2  THR 840          2HG2      THR 840 -12.204  -0.727   1.034
   30   3HG2  THR 840          3HG2      THR 840 -11.732   0.761   1.890
   31    H    LEU 841           H        LEU 841 -11.965  -3.471   2.974
   32    HA   LEU 841           HA       LEU 841 -11.786  -4.282   0.307
   33   1HB   LEU 841          1HB       LEU 841 -10.333  -5.001   2.237
   34   2HB   LEU 841          2HB       LEU 841 -11.645  -6.090   2.748
   35    HG   LEU 841           HG       LEU 841 -10.331  -7.504   1.418
   36   1HD1  LEU 841          1HD1      LEU 841 -12.707  -7.395   0.627
   37   2HD1  LEU 841          2HD1      LEU 841 -12.212  -6.196  -0.593
   38   3HD1  LEU 841          3HD1      LEU 841 -11.568  -7.854  -0.662
   39   1HD2  LEU 841          1HD2      LEU 841  -9.747  -4.959  -0.059
   40   2HD2  LEU 841          2HD2      LEU 841  -8.638  -6.244   0.477
   41   3HD2  LEU 841          3HD2      LEU 841  -9.643  -6.484  -0.972
   42    H    CYS 842           H        CYS 842 -14.518  -4.320   2.284
   43    HA   CYS 842           HA       CYS 842 -15.811  -6.727   1.758
   44   1HB   CYS 842          1HB       CYS 842 -16.465  -4.258   2.875
   45   2HB   CYS 842          2HB       CYS 842 -17.574  -4.398   1.488
   46    HG   CYS 842           HG       CYS 842 -16.910  -6.917   3.487
   47    H    GLN 843           H        GLN 843 -14.718  -4.368  -0.477
   48    HA   GLN 843           HA       GLN 843 -16.602  -5.373  -2.551
   49   1HB   GLN 843          1HB       GLN 843 -14.781  -3.012  -2.947
   50   2HB   GLN 843          2HB       GLN 843 -16.393  -3.331  -3.632
   51   1HG   GLN 843          1HG       GLN 843 -16.645  -3.253  -0.778
   52   2HG   GLN 843          2HG       GLN 843 -15.712  -1.827  -1.280
   53   1HE2  GLN 843          1HE2      GLN 843 -18.334  -1.685  -0.168
   54   2HE2  GLN 843          2HE2      GLN 843 -19.418  -1.078  -1.401
   55    H    THR 844           H        THR 844 -14.457  -7.024  -1.631
   56    HA   THR 844           HA       THR 844 -12.564  -8.117  -2.358
   57    HB   THR 844           HB       THR 844 -14.535  -7.931  -4.481
   58    HG1  THR 844           1HG      THR 844 -13.779 -10.088  -4.742
   59   1HG2  THR 844          1HG2      THR 844 -13.011  -7.036  -6.007
   60   2HG2  THR 844          2HG2      THR 844 -11.611  -7.791  -5.208
   61   3HG2  THR 844          3HG2      THR 844 -12.708  -8.780  -6.201
   62    H    LYS 845           H        LYS 845 -10.901  -6.706  -1.760
   63    HA   LYS 845           HA       LYS 845  -9.172  -5.235  -2.069
   64   1HB   LYS 845          1HB       LYS 845  -9.384  -5.817  -5.031
   65   2HB   LYS 845          2HB       LYS 845  -7.928  -5.527  -4.049
   66   1HG   LYS 845          1HG       LYS 845  -9.777  -7.932  -3.749
   67   2HG   LYS 845          2HG       LYS 845  -8.234  -7.943  -4.636
   68   1HD   LYS 845          1HD       LYS 845  -7.211  -8.416  -2.679
   69   2HD   LYS 845          2HD       LYS 845  -7.641  -6.776  -2.136
   70   1HE   LYS 845          1HE       LYS 845  -8.699  -7.970  -0.480
   71   2HE   LYS 845          2HE       LYS 845 -10.003  -7.979  -1.687
   72   1HZ   LYS 845          1HZ       LYS 845  -7.992 -10.098  -1.543
   73   2HZ   LYS 845          2HZ       LYS 845  -9.389 -10.150  -0.668
   74   3HZ   LYS 845          3HZ       LYS 845  -9.448 -10.119  -2.316
   75    H    VAL 846           H        VAL 846 -12.218  -4.709  -3.408
   76    HA   VAL 846           HA       VAL 846 -13.133  -2.896  -4.588
   77    HB   VAL 846           HB       VAL 846 -13.582  -1.296  -2.990
   78   1HG1  VAL 846          1HG1      VAL 846 -12.309  -2.698  -0.800
   79   2HG1  VAL 846          2HG1      VAL 846 -14.027  -2.675  -1.263
   80   3HG1  VAL 846          3HG1      VAL 846 -12.928  -3.876  -1.982
   81   1HG2  VAL 846          1HG2      VAL 846 -10.638  -1.506  -2.241
   82   2HG2  VAL 846          2HG2      VAL 846 -11.454  -0.150  -3.056
   83   3HG2  VAL 846          3HG2      VAL 846 -11.813  -0.509  -1.350
   84    H    LEU 847           H        LEU 847  -9.849  -2.008  -3.385
   85    HA   LEU 847           HA       LEU 847  -8.102  -1.004  -4.485
   86   1HB   LEU 847          1HB       LEU 847  -9.753  -1.026  -7.027
   87   2HB   LEU 847          2HB       LEU 847  -7.982  -1.057  -6.852
   88    HG   LEU 847           HG       LEU 847  -8.738  -3.301  -7.412
   89   1HD1  LEU 847          1HD1      LEU 847  -8.351  -3.572  -4.451
   90   2HD1  LEU 847          2HD1      LEU 847  -7.523  -4.405  -5.788
   91   3HD1  LEU 847          3HD1      LEU 847  -7.080  -2.732  -5.372
   92   1HD2  LEU 847          1HD2      LEU 847 -10.471  -3.200  -4.913
   93   2HD2  LEU 847          2HD2      LEU 847 -11.099  -2.879  -6.547
   94   3HD2  LEU 847          3HD2      LEU 847 -10.420  -4.476  -6.153
   95    H    LEU 848           H        LEU 848  -9.277   0.679  -7.025
   96    HA   LEU 848           HA       LEU 848 -10.467   2.736  -7.181
   97   1HB   LEU 848          1HB       LEU 848 -10.831   2.205  -4.465
   98   2HB   LEU 848          2HB       LEU 848  -9.908   3.726  -4.482
   99    HG   LEU 848           HG       LEU 848 -12.274   3.340  -6.329
  100   1HD1  LEU 848          1HD1      LEU 848 -12.315   3.439  -3.416
  101   2HD1  LEU 848          2HD1      LEU 848 -13.117   4.868  -4.111
  102   3HD1  LEU 848          3HD1      LEU 848 -13.667   3.235  -4.556
  103   1HD2  LEU 848          1HD2      LEU 848 -12.138   5.954  -5.360
  104   2HD2  LEU 848          2HD2      LEU 848 -10.430   5.476  -5.512
  105   3HD2  LEU 848          3HD2      LEU 848 -11.509   5.386  -6.925
  106    H    ASP 849           H        ASP 849  -9.629   4.968  -7.306
  107    HA   ASP 849           HA       ASP 849  -6.805   4.954  -7.845
  108   1HB   ASP 849          1HB       ASP 849  -7.274   7.473  -8.143
  109   2HB   ASP 849          2HB       ASP 849  -8.126   6.343  -9.219
  110    H    ILE 850           H        ILE 850  -6.692   4.104  -5.365
  111    HA   ILE 850           HA       ILE 850  -6.506   6.353  -3.487
  112    HB   ILE 850           HB       ILE 850  -5.470   3.683  -2.720
  113   1HG1  ILE 850          1HG1      ILE 850  -7.777   3.791  -4.355
  114   2HG1  ILE 850          2HG1      ILE 850  -7.234   2.426  -3.350
  115   1HG2  ILE 850          1HG2      ILE 850  -6.710   4.157  -0.721
  116   2HG2  ILE 850          2HG2      ILE 850  -5.984   5.701  -1.230
  117   3HG2  ILE 850          3HG2      ILE 850  -7.705   5.379  -1.548
  118   1HD1  ILE 850          1HD1      ILE 850  -9.414   4.382  -2.883
  119   2HD1  ILE 850          2HD1      ILE 850  -9.224   2.718  -2.278
  120   3HD1  ILE 850          3HD1      ILE 850  -8.386   4.062  -1.465
  121    H    PHE 851           H        PHE 851  -4.175   3.745  -3.333
  122    HA   PHE 851           HA       PHE 851  -1.958   5.396  -2.978
  123   1HB   PHE 851          1HB       PHE 851  -1.890   2.682  -4.321
  124   2HB   PHE 851          2HB       PHE 851  -0.637   3.434  -3.319
  125    HD1  PHE 851           1HD      PHE 851  -3.876   1.677  -3.316
  126    HD2  PHE 851           2HD      PHE 851  -0.818   3.470  -0.890
  127    HE1  PHE 851           1HE      PHE 851  -4.819   0.569  -1.308
  128    HE2  PHE 851           2HE      PHE 851  -1.761   2.362   1.118
  129    HZ   PHE 851           HZ       PHE 851  -3.761   0.911   0.909
  130    H    THR 852           H        THR 852  -3.473   6.500  -5.143
  131    HA   THR 852           HA       THR 852  -2.758   6.030  -7.720
  132    HB   THR 852           HB       THR 852  -3.905   8.115  -6.382
  133    HG1  THR 852           1HG      THR 852  -4.407   7.671  -8.468
  134   1HG2  THR 852          1HG2      THR 852  -1.287   9.139  -7.564
  135   2HG2  THR 852          2HG2      THR 852  -2.602  10.142  -6.904
  136   3HG2  THR 852          3HG2      THR 852  -1.676   9.067  -5.829
  137    H    GLY 853           H        GLY 853  -0.881   5.553  -8.685
  138   1HA   GLY 853          1HA       GLY 853   1.393   5.407  -9.038
  139   2HA   GLY 853          2HA       GLY 853   1.346   7.174  -8.846
  140    H    VAL 854           H        VAL 854   0.350   5.114  -6.187
  141    HA   VAL 854           HA       VAL 854   2.622   6.118  -4.608
  142    HB   VAL 854           HB       VAL 854  -0.050   4.856  -4.041
  143   1HG1  VAL 854          1HG1      VAL 854   1.938   3.676  -2.795
  144   2HG1  VAL 854          2HG1      VAL 854   2.023   5.191  -1.866
  145   3HG1  VAL 854          3HG1      VAL 854   0.530   4.222  -1.855
  146   1HG2  VAL 854          1HG2      VAL 854   1.215   7.435  -3.850
  147   2HG2  VAL 854          2HG2      VAL 854  -0.468   6.996  -3.471
  148   3HG2  VAL 854          3HG2      VAL 854   0.784   6.894  -2.210
  149    H    ARG 855           H        ARG 855   4.465   4.973  -4.891
  150    HA   ARG 855           HA       ARG 855   4.270   2.028  -5.132
  151   1HB   ARG 855          1HB       ARG 855   6.335   2.107  -6.183
  152   2HB   ARG 855          2HB       ARG 855   5.672   3.692  -6.647
  153   1HG   ARG 855          1HG       ARG 855   6.798   4.602  -4.515
  154   2HG   ARG 855          2HG       ARG 855   7.684   3.059  -4.461
  155   1HD   ARG 855          1HD       ARG 855   8.898   4.928  -5.662
  156   2HD   ARG 855          2HD       ARG 855   8.659   3.457  -6.631
  157    HE   ARG 855           HE       ARG 855   6.454   5.053  -7.191
  158   1HH1  ARG 855          2HH2      ARG 855   9.972   5.355  -7.385
  159   2HH1  ARG 855          1HH2      ARG 855   9.939   6.447  -8.753
  160   1HH2  ARG 855          2HH1      ARG 855   6.412   6.495  -8.996
  161   2HH2  ARG 855          1HH1      ARG 855   7.909   7.096  -9.671
  162    H    LEU 856           H        LEU 856   3.841   1.397  -3.004
  163    HA   LEU 856           HA       LEU 856   5.939   2.134  -1.018
  164   1HB   LEU 856          1HB       LEU 856   4.320   2.268   0.568
  165   2HB   LEU 856          2HB       LEU 856   3.221   2.459  -0.820
  166    HG   LEU 856           HG       LEU 856   2.674   0.121  -0.821
  167   1HD1  LEU 856          1HD1      LEU 856   5.211  -0.047   0.718
  168   2HD1  LEU 856          2HD1      LEU 856   3.919  -1.141   1.268
  169   3HD1  LEU 856          3HD1      LEU 856   4.486  -1.210  -0.418
  170   1HD2  LEU 856          1HD2      LEU 856   1.522  -0.043   1.214
  171   2HD2  LEU 856          2HD2      LEU 856   2.857   0.682   2.142
  172   3HD2  LEU 856          3HD2      LEU 856   1.833   1.706   1.107
  173    H    TYR 857           H        TYR 857   7.082   0.527  -0.001
  174    HA   TYR 857           HA       TYR 857   7.049  -2.083  -1.268
  175   1HB   TYR 857          1HB       TYR 857   9.191  -1.707  -0.686
  176   2HB   TYR 857          2HB       TYR 857   8.745  -0.533   0.564
  177    HD1  TYR 857           1HD      TYR 857   7.967  -4.188   0.167
  178    HD2  TYR 857           2HD      TYR 857   9.814  -1.118   2.538
  179    HE1  TYR 857           1HE      TYR 857   8.490  -5.859   1.924
  180    HE2  TYR 857           2HE      TYR 857  10.337  -2.789   4.294
  181    HH   TYR 857           HH       TYR 857  10.330  -5.014   4.862
  182    H    LEU 858           H        LEU 858   5.187  -3.216  -0.823
  183    HA   LEU 858           HA       LEU 858   4.104  -3.303   1.878
  184   1HB   LEU 858          1HB       LEU 858   2.715  -3.393  -0.213
  185   2HB   LEU 858          2HB       LEU 858   3.417  -4.993  -0.556
  186    HG   LEU 858           HG       LEU 858   2.133  -6.015   1.016
  187   1HD1  LEU 858          1HD1      LEU 858   2.661  -3.552   2.727
  188   2HD1  LEU 858          2HD1      LEU 858   1.693  -4.943   3.273
  189   3HD1  LEU 858          3HD1      LEU 858   3.416  -5.157   2.879
  190   1HD2  LEU 858          1HD2      LEU 858  -0.005  -5.156   1.052
  191   2HD2  LEU 858          2HD2      LEU 858   0.544  -3.526   1.512
  192   3HD2  LEU 858          3HD2      LEU 858   0.691  -4.072  -0.176
  193    HA   PRO 859           HA       PRO 859   6.956  -6.583   2.964
  194   1HB   PRO 859          1HB       PRO 859   6.383  -6.610   5.627
  195   2HB   PRO 859          2HB       PRO 859   7.302  -5.268   4.871
  196   1HG   PRO 859          1HG       PRO 859   4.326  -5.365   5.442
  197   2HG   PRO 859          2HG       PRO 859   5.483  -4.078   5.914
  198   1HD   PRO 859          1HD       PRO 859   3.969  -3.870   3.657
  199   2HD   PRO 859          2HD       PRO 859   5.676  -3.332   3.657
  200    HA   PRO 860           HA       PRO 860   4.067  -9.926   2.751
  201   1HB   PRO 860          1HB       PRO 860   5.746 -12.002   3.294
  202   2HB   PRO 860          2HB       PRO 860   5.900 -11.029   1.794
  203   1HG   PRO 860          1HG       PRO 860   7.432 -10.666   4.385
  204   2HG   PRO 860          2HG       PRO 860   8.111 -10.819   2.732
  205   1HD   PRO 860          1HD       PRO 860   7.689  -8.381   3.875
  206   2HD   PRO 860          2HD       PRO 860   7.334  -8.643   2.140
  207    H    SER 861           H        SER 861   5.966  -9.077   5.575
  208    HA   SER 861           HA       SER 861   4.712 -10.984   7.358
  209   1HB   SER 861          1HB       SER 861   6.856  -9.079   7.423
  210   2HB   SER 861          2HB       SER 861   5.743  -8.716   8.764
  211    HG   SER 861           HG       SER 861   5.830 -11.038   9.199
  212    H    THR 862           H        THR 862   3.729  -8.067   5.856
  213    HA   THR 862           HA       THR 862   2.078  -7.028   7.971
  214    HB   THR 862           HB       THR 862   2.918  -6.223   5.416
  215    HG1  THR 862           1HG      THR 862   1.195  -4.503   6.163
  216   1HG2  THR 862          1HG2      THR 862   1.076  -7.278   4.299
  217   2HG2  THR 862          2HG2      THR 862  -0.074  -6.748   5.550
  218   3HG2  THR 862          3HG2      THR 862   0.645  -5.557   4.440
  219    HA   PRO 863           HA       PRO 863  -1.322  -9.806   7.715
  220   1HB   PRO 863          1HB       PRO 863  -3.270  -8.283   8.861
  221   2HB   PRO 863          2HB       PRO 863  -1.847  -8.856   9.791
  222   1HG   PRO 863          1HG       PRO 863  -2.197  -6.165   8.438
  223   2HG   PRO 863          2HG       PRO 863  -1.724  -6.473  10.140
  224   1HD   PRO 863          1HD       PRO 863   0.142  -6.014   8.208
  225   2HD   PRO 863          2HD       PRO 863   0.430  -7.248   9.471
  226    H    ASP 864           H        ASP 864  -2.957 -10.289   6.271
  227    HA   ASP 864           HA       ASP 864  -4.380 -10.047   4.491
  228   1HB   ASP 864          1HB       ASP 864  -4.596  -7.592   5.939
  229   2HB   ASP 864          2HB       ASP 864  -4.559  -7.198   4.206
  230    H    PHE 865           H        PHE 865  -1.235  -9.217   4.612
  231    HA   PHE 865           HA       PHE 865  -0.458  -7.644   2.557
  232   1HB   PHE 865          1HB       PHE 865   1.011  -9.076   3.968
  233   2HB   PHE 865          2HB       PHE 865   0.530 -10.481   3.001
  234    HD1  PHE 865           1HD      PHE 865   1.880  -7.007   2.480
  235    HD2  PHE 865           2HD      PHE 865   1.948 -11.136   1.297
  236    HE1  PHE 865           1HE      PHE 865   3.692  -6.513   0.861
  237    HE2  PHE 865           2HE      PHE 865   3.760 -10.641  -0.323
  238    HZ   PHE 865           HZ       PHE 865   4.632  -8.330  -0.541
  239    H    SER 866           H        SER 866  -1.576 -11.050   2.142
  240    HA   SER 866           HA       SER 866  -1.363 -11.572  -0.454
  241   1HB   SER 866          1HB       SER 866  -2.866 -12.666   1.395
  242   2HB   SER 866          2HB       SER 866  -4.159 -11.675   0.676
  243    HG   SER 866           HG       SER 866  -3.999 -12.766  -1.167
  244    H    ARG 867           H        ARG 867  -4.227  -9.661   0.638
  245    HA   ARG 867           HA       ARG 867  -4.771  -8.720  -2.021
  246   1HB   ARG 867          1HB       ARG 867  -5.722  -7.393   0.525
  247   2HB   ARG 867          2HB       ARG 867  -6.569  -7.570  -1.030
  248   1HG   ARG 867          1HG       ARG 867  -7.610  -9.309   0.029
  249   2HG   ARG 867          2HG       ARG 867  -6.124 -10.194  -0.394
  250   1HD   ARG 867          1HD       ARG 867  -5.453  -8.826   1.951
  251   2HD   ARG 867          2HD       ARG 867  -7.124  -9.359   2.234
  252    HE   ARG 867           HE       ARG 867  -4.785 -11.008   2.225
  253   1HH1  ARG 867          2HH2      ARG 867  -8.163 -10.931   1.186
  254   2HH1  ARG 867          1HH2      ARG 867  -8.375 -12.665   1.282
  255   1HH2  ARG 867          2HH1      ARG 867  -5.064 -13.298   2.352
  256   2HH2  ARG 867          1HH1      ARG 867  -6.608 -14.015   1.946
  257    H    LEU 868           H        LEU 868  -3.641  -6.986   0.944
  258    HA   LEU 868           HA       LEU 868  -3.152  -4.503   0.160
  259   1HB   LEU 868          1HB       LEU 868  -1.185  -6.390   1.499
  260   2HB   LEU 868          2HB       LEU 868  -0.899  -4.639   1.353
  261    HG   LEU 868           HG       LEU 868  -3.425  -5.826   2.567
  262   1HD1  LEU 868          1HD1      LEU 868  -0.937  -4.760   3.970
  263   2HD1  LEU 868          2HD1      LEU 868  -2.428  -5.329   4.757
  264   3HD1  LEU 868          3HD1      LEU 868  -1.398  -6.476   3.869
  265   1HD2  LEU 868          1HD2      LEU 868  -2.686  -3.227   3.533
  266   2HD2  LEU 868          2HD2      LEU 868  -2.601  -3.197   1.756
  267   3HD2  LEU 868          3HD2      LEU 868  -4.110  -3.680   2.566
  268    H    ARG 869           H        ARG 869  -1.056  -7.249  -0.858
  269    HA   ARG 869           HA       ARG 869   0.643  -5.661  -2.515
  270   1HB   ARG 869          1HB       ARG 869   1.166  -7.943  -1.615
  271   2HB   ARG 869          2HB       ARG 869  -0.029  -8.620  -2.748
  272   1HG   ARG 869          1HG       ARG 869   1.590  -8.675  -4.318
  273   2HG   ARG 869          2HG       ARG 869   1.603  -6.895  -4.292
  274   1HD   ARG 869          1HD       ARG 869   3.828  -7.397  -3.785
  275   2HD   ARG 869          2HD       ARG 869   3.117  -7.205  -2.168
  276    HE   ARG 869           HE       ARG 869   3.313  -9.514  -1.803
  277   1HH1  ARG 869          2HH2      ARG 869   4.177  -8.617  -5.112
  278   2HH1  ARG 869          1HH2      ARG 869   4.911 -10.160  -5.484
  279   1HH2  ARG 869          2HH1      ARG 869   4.282 -11.553  -2.295
  280   2HH2  ARG 869          1HH1      ARG 869   4.971 -11.834  -3.878
  281    H    ARG 870           H        ARG 870  -1.114  -8.335  -4.009
  282    HA   ARG 870           HA       ARG 870  -1.441  -7.384  -6.500
  283   1HB   ARG 870          1HB       ARG 870  -2.732  -9.333  -4.872
  284   2HB   ARG 870          2HB       ARG 870  -4.010  -8.438  -5.730
  285   1HG   ARG 870          1HG       ARG 870  -2.791  -8.793  -7.873
  286   2HG   ARG 870          2HG       ARG 870  -1.560  -9.737  -7.000
  287   1HD   ARG 870          1HD       ARG 870  -2.961 -11.441  -7.720
  288   2HD   ARG 870          2HD       ARG 870  -3.674 -11.085  -6.132
  289    HE   ARG 870           HE       ARG 870  -5.587 -10.351  -7.193
  290   1HH1  ARG 870          2HH2      ARG 870  -2.880 -10.373  -9.467
  291   2HH1  ARG 870          1HH2      ARG 870  -3.866  -9.973 -10.856
  292   1HH2  ARG 870          2HH1      ARG 870  -6.889  -9.824  -9.028
  293   2HH2  ARG 870          1HH1      ARG 870  -6.151  -9.660 -10.606
  294    H    TYR 871           H        TYR 871  -3.477  -6.449  -3.699
  295    HA   TYR 871           HA       TYR 871  -5.317  -4.841  -5.121
  296   1HB   TYR 871          1HB       TYR 871  -5.305  -5.668  -2.668
  297   2HB   TYR 871          2HB       TYR 871  -4.312  -4.238  -2.337
  298    HD1  TYR 871           1HD      TYR 871  -6.067  -2.919  -4.841
  299    HD2  TYR 871           2HD      TYR 871  -6.834  -4.528  -0.933
  300    HE1  TYR 871           1HE      TYR 871  -8.117  -1.534  -4.674
  301    HE2  TYR 871           2HE      TYR 871  -8.885  -3.143  -0.766
  302    HH   TYR 871           HH       TYR 871 -10.337  -1.756  -1.897
  303    H    PHE 872           H        PHE 872  -2.453  -3.771  -3.190
  304    HA   PHE 872           HA       PHE 872  -2.446  -1.102  -3.873
  305   1HB   PHE 872          1HB       PHE 872  -0.868  -2.506  -2.368
  306   2HB   PHE 872          2HB       PHE 872   0.096  -2.729  -3.838
  307    HD1  PHE 872           1HD      PHE 872   0.626  -0.480  -5.161
  308    HD2  PHE 872           2HD      PHE 872  -0.376  -0.710  -0.990
  309    HE1  PHE 872           1HE      PHE 872   1.721   1.712  -4.777
  310    HE2  PHE 872           2HE      PHE 872   0.720   1.481  -0.606
  311    HZ   PHE 872           HZ       PHE 872   1.768   2.692  -2.499
  312    H    VAL 873           H        VAL 873   0.206  -2.871  -5.379
  313    HA   VAL 873           HA       VAL 873   0.644  -1.448  -7.583
  314    HB   VAL 873           HB       VAL 873   1.974  -3.275  -7.721
  315   1HG1  VAL 873          1HG1      VAL 873  -0.381  -4.680  -6.436
  316   2HG1  VAL 873          2HG1      VAL 873   0.998  -5.611  -7.069
  317   3HG1  VAL 873          3HG1      VAL 873   1.252  -4.407  -5.783
  318   1HG2  VAL 873          1HG2      VAL 873   1.393  -4.724  -9.487
  319   2HG2  VAL 873          2HG2      VAL 873  -0.330  -4.731  -9.039
  320   3HG2  VAL 873          3HG2      VAL 873   0.386  -3.289  -9.799
  321    H    ALA 874           H        ALA 874  -2.190  -3.557  -7.121
  322    HA   ALA 874           HA       ALA 874  -3.202  -3.506  -9.746
  323   1HB   ALA 874          1HB       ALA 874  -4.347  -4.974  -8.385
  324   2HB   ALA 874          2HB       ALA 874  -4.332  -3.866  -6.992
  325   3HB   ALA 874          3HB       ALA 874  -5.469  -3.593  -8.333
  326    H    PHE 875           H        PHE 875  -4.512  -1.531  -7.026
  327    HA   PHE 875           HA       PHE 875  -6.097   0.237  -8.147
  328   1HB   PHE 875          1HB       PHE 875  -3.677   1.129  -6.546
  329   2HB   PHE 875          2HB       PHE 875  -5.204   2.011  -6.721
  330    HD1  PHE 875           1HD      PHE 875  -3.458  -0.713  -5.021
  331    HD2  PHE 875           2HD      PHE 875  -7.273   1.158  -5.652
  332    HE1  PHE 875           1HE      PHE 875  -4.367  -1.898  -3.040
  333    HE2  PHE 875           2HE      PHE 875  -8.182  -0.026  -3.671
  334    HZ   PHE 875           HZ       PHE 875  -6.729  -1.554  -2.366
  335    H    ASP 876           H        ASP 876  -2.522   0.537  -8.514
  336    HA   ASP 876           HA       ASP 876  -2.184   1.006 -11.104
  337   1HB   ASP 876          1HB       ASP 876  -3.870   3.177 -10.005
  338   2HB   ASP 876          2HB       ASP 876  -2.489   3.726 -10.980
  339    H    GLY 877           H        GLY 877  -1.102   0.907  -8.171
  340   1HA   GLY 877          1HA       GLY 877   1.048   2.934  -8.438
  341   2HA   GLY 877          2HA       GLY 877   0.641   2.012  -6.974
  342    H    ASP 878           H        ASP 878   2.605   1.043  -6.555
  343    HA   ASP 878           HA       ASP 878   3.316  -1.204  -8.260
  344   1HB   ASP 878          1HB       ASP 878   4.743   1.359  -8.433
  345   2HB   ASP 878          2HB       ASP 878   5.806  -0.005  -8.025
  346    H    LEU 879           H        LEU 879   4.994  -2.554  -7.241
  347    HA   LEU 879           HA       LEU 879   5.416  -1.920  -4.368
  348   1HB   LEU 879          1HB       LEU 879   3.871  -4.134  -5.569
  349   2HB   LEU 879          2HB       LEU 879   5.093  -4.655  -4.384
  350    HG   LEU 879           HG       LEU 879   4.136  -3.369  -2.651
  351   1HD1  LEU 879          1HD1      LEU 879   2.299  -1.670  -3.182
  352   2HD1  LEU 879          2HD1      LEU 879   3.936  -1.232  -3.726
  353   3HD1  LEU 879          3HD1      LEU 879   2.748  -1.857  -4.895
  354   1HD2  LEU 879          1HD2      LEU 879   2.280  -4.857  -4.400
  355   2HD2  LEU 879          2HD2      LEU 879   2.505  -4.951  -2.637
  356   3HD2  LEU 879          3HD2      LEU 879   1.471  -3.682  -3.336
  357    H    VAL 880           H        VAL 880   7.474  -2.237  -3.724
  358    HA   VAL 880           HA       VAL 880   9.239  -3.782  -5.565
  359    HB   VAL 880           HB       VAL 880  10.628  -1.950  -3.785
  360   1HG1  VAL 880          1HG1      VAL 880  10.317  -1.902  -6.812
  361   2HG1  VAL 880          2HG1      VAL 880  11.680  -1.285  -5.847
  362   3HG1  VAL 880          3HG1      VAL 880  11.390  -3.038  -5.960
  363   1HG2  VAL 880          1HG2      VAL 880   8.235  -0.955  -5.317
  364   2HG2  VAL 880          2HG2      VAL 880   8.886  -0.410  -3.752
  365   3HG2  VAL 880          3HG2      VAL 880   9.697   0.059  -5.266
  366    H    GLN 881           H        GLN 881  10.497  -5.385  -4.708
  367    HA   GLN 881           HA       GLN 881   9.772  -6.457  -2.163
  368   1HB   GLN 881          1HB       GLN 881  12.270  -7.062  -3.785
  369   2HB   GLN 881          2HB       GLN 881  11.434  -8.130  -2.632
  370   1HG   GLN 881          1HG       GLN 881   9.938  -8.794  -4.188
  371   2HG   GLN 881          2HG       GLN 881   9.632  -7.123  -4.710
  372   1HE2  GLN 881          1HE2      GLN 881  10.952  -6.178  -6.362
  373   2HE2  GLN 881          2HE2      GLN 881  11.894  -7.178  -7.447
  374    H    GLU 882           H        GLU 882  10.621  -6.183  -0.158
  375    HA   GLU 882           HA       GLU 882  11.837  -4.052   0.825
  376   1HB   GLU 882          1HB       GLU 882  11.305  -6.051   2.163
  377   2HB   GLU 882          2HB       GLU 882  12.721  -6.890   1.484
  378   1HG   GLU 882          1HG       GLU 882  13.919  -4.620   2.342
  379   2HG   GLU 882          2HG       GLU 882  12.580  -4.695   3.507
  380    H    PHE 883           H        PHE 883  13.983  -6.804  -0.100
  381    HA   PHE 883           HA       PHE 883  16.294  -5.107  -0.241
  382   1HB   PHE 883          1HB       PHE 883  17.403  -7.095  -1.100
  383   2HB   PHE 883          2HB       PHE 883  16.372  -7.517   0.278
  384    HD1  PHE 883           1HD      PHE 883  14.463  -8.959   0.023
  385    HD2  PHE 883           2HD      PHE 883  16.749  -7.730  -3.400
  386    HE1  PHE 883           1HE      PHE 883  13.328 -10.682  -1.354
  387    HE2  PHE 883           2HE      PHE 883  15.614  -9.452  -4.777
  388    HZ   PHE 883           HZ       PHE 883  13.903 -10.928  -3.754
  389    H    ASP 884           H        ASP 884  13.761  -4.621  -2.002
  390    HA   ASP 884           HA       ASP 884  15.324  -3.961  -4.416
  391   1HB   ASP 884          1HB       ASP 884  12.756  -5.588  -4.416
  392   2HB   ASP 884          2HB       ASP 884  13.496  -4.864  -5.860
  393    H    MET 885           H        MET 885  15.139  -1.790  -3.659
  394    HA   MET 885           HA       MET 885  12.496  -0.621  -4.271
  395   1HB   MET 885          1HB       MET 885  13.174   0.887  -2.117
  396   2HB   MET 885          2HB       MET 885  12.101  -0.531  -2.024
  397   1HG   MET 885          1HG       MET 885  14.195  -1.931  -1.654
  398   2HG   MET 885          2HG       MET 885  15.081  -0.409  -1.462
  399   1HE   MET 885          1HE       MET 885  12.423  -2.699  -0.504
  400   2HE   MET 885          2HE       MET 885  12.435  -2.727   1.275
  401   3HE   MET 885          3HE       MET 885  11.370  -1.593   0.410
  402    H    THR 886           H        THR 886  15.973  -0.231  -3.553
  403    HA   THR 886           HA       THR 886  16.949   2.059  -3.854
  404    HB   THR 886           HB       THR 886  18.447   1.467  -5.581
  405    HG1  THR 886           1HG      THR 886  17.858   0.256  -7.302
  406   1HG2  THR 886          1HG2      THR 886  19.002  -0.803  -5.093
  407   2HG2  THR 886          2HG2      THR 886  18.185  -0.197  -3.633
  408   3HG2  THR 886          3HG2      THR 886  17.303  -1.232  -4.782
  409    H    SER 887           H        SER 887  14.894   0.910  -6.584
  410    HA   SER 887           HA       SER 887  14.630   3.716  -7.486
  411   1HB   SER 887          1HB       SER 887  14.515   1.047  -8.718
  412   2HB   SER 887          2HB       SER 887  13.178   2.110  -9.221
  413    HG   SER 887           HG       SER 887  15.948   2.741  -9.274
  414    H    ALA 888           H        ALA 888  13.025   1.321  -5.609
  415    HA   ALA 888           HA       ALA 888  10.336   1.651  -6.093
  416   1HB   ALA 888          1HB       ALA 888  11.862   1.443  -3.476
  417   2HB   ALA 888          2HB       ALA 888  10.086   1.375  -3.568
  418   3HB   ALA 888          3HB       ALA 888  11.068   0.138  -4.390
  419    H    THR 889           H        THR 889   8.822   2.901  -4.404
  420    HA   THR 889           HA       THR 889   9.800   5.709  -4.237
  421    HB   THR 889           HB       THR 889   8.041   4.888  -6.145
  422    HG1  THR 889           1HG      THR 889   8.134   6.951  -6.438
  423   1HG2  THR 889          1HG2      THR 889   6.274   5.969  -3.928
  424   2HG2  THR 889          2HG2      THR 889   5.789   5.221  -5.468
  425   3HG2  THR 889          3HG2      THR 889   6.495   4.220  -4.176
  426    H    HIS 890           H        HIS 890   7.453   3.225  -3.148
  427    HA   HIS 890           HA       HIS 890   7.322   4.683  -0.549
  428   1HB   HIS 890          1HB       HIS 890   5.206   3.312  -2.197
  429   2HB   HIS 890          2HB       HIS 890   5.041   3.401  -0.433
  430    HD1  HIS 890           1HD      HIS 890   5.016   5.664  -3.528
  431    HD2  HIS 890           2HD      HIS 890   4.521   5.803   0.650
  432    HE1  HIS 890           1HE      HIS 890   4.049   7.966  -2.978
  433    H    VAL 891           H        VAL 891   7.093   3.330   1.348
  434    HA   VAL 891           HA       VAL 891   7.655   0.460   0.977
  435    HB   VAL 891           HB       VAL 891   9.538   0.719   2.711
  436   1HG1  VAL 891          1HG1      VAL 891   9.472   1.001  -0.156
  437   2HG1  VAL 891          2HG1      VAL 891  10.772   2.030   0.489
  438   3HG1  VAL 891          3HG1      VAL 891  10.749   0.290   0.860
  439   1HG2  VAL 891          1HG2      VAL 891   9.303   3.588   1.706
  440   2HG2  VAL 891          2HG2      VAL 891   9.044   3.031   3.377
  441   3HG2  VAL 891          3HG2      VAL 891  10.667   2.945   2.652
  442    H    LEU 892           H        LEU 892   6.396  -0.655   2.344
  443    HA   LEU 892           HA       LEU 892   4.888   0.744   4.387
  444   1HB   LEU 892          1HB       LEU 892   4.563  -1.562   2.850
  445   2HB   LEU 892          2HB       LEU 892   4.840  -2.182   4.496
  446    HG   LEU 892           HG       LEU 892   3.094   0.128   4.601
  447   1HD1  LEU 892          1HD1      LEU 892   1.698  -0.174   2.858
  448   2HD1  LEU 892          2HD1      LEU 892   2.761  -1.465   2.249
  449   3HD1  LEU 892          3HD1      LEU 892   1.423  -1.861   3.354
  450   1HD2  LEU 892          1HD2      LEU 892   1.605  -2.093   5.292
  451   2HD2  LEU 892          2HD2      LEU 892   3.270  -2.676   5.531
  452   3HD2  LEU 892          3HD2      LEU 892   2.704  -1.223   6.390
  453    H    GLY 893           H        GLY 893   5.609   1.182   6.381
  454   1HA   GLY 893          1HA       GLY 893   6.835   1.058   8.319
  455   2HA   GLY 893          2HA       GLY 893   6.725  -0.707   8.132
  456    H    SER 894           H        SER 894   8.857   1.840   8.413
  457    HA   SER 894           HA       SER 894  11.157   1.858   8.311
  458   1HB   SER 894          1HB       SER 894  10.545  -0.966   7.545
  459   2HB   SER 894          2HB       SER 894  12.150  -0.334   7.105
  460    HG   SER 894           HG       SER 894  10.982  -0.674   9.634
  461    H    ARG 895           H        ARG 895  12.951   1.894   6.591
  462    HA   ARG 895           HA       ARG 895  11.894   2.162   3.848
  463   1HB   ARG 895          1HB       ARG 895  12.996   4.420   3.670
  464   2HB   ARG 895          2HB       ARG 895  11.572   4.390   4.737
  465   1HG   ARG 895          1HG       ARG 895  12.900   4.439   6.701
  466   2HG   ARG 895          2HG       ARG 895  14.370   3.952   5.824
  467   1HD   ARG 895          1HD       ARG 895  13.529   6.291   4.527
  468   2HD   ARG 895          2HD       ARG 895  13.247   6.623   6.249
  469    HE   ARG 895           HE       ARG 895  15.830   5.436   5.877
  470   1HH1  ARG 895          2HH2      ARG 895  14.011   8.430   5.397
  471   2HH1  ARG 895          1HH2      ARG 895  15.417   9.465   5.522
  472   1HH2  ARG 895          2HH1      ARG 895  17.686   6.803   6.043
  473   2HH2  ARG 895          1HH1      ARG 895  17.512   8.537   5.891
  474    H    ASP 896           H        ASP 896  14.545   1.944   6.177
  475    HA   ASP 896           HA       ASP 896  16.890   2.094   5.140
  476   1HB   ASP 896          1HB       ASP 896  17.190  -0.535   5.569
  477   2HB   ASP 896          2HB       ASP 896  16.957   0.623   6.897
  478    H    LYS 897           H        LYS 897  15.315  -0.956   4.079
  479    HA   LYS 897           HA       LYS 897  16.748  -1.634   1.936
  480   1HB   LYS 897          1HB       LYS 897  14.081  -1.708   0.950
  481   2HB   LYS 897          2HB       LYS 897  14.993  -3.017   1.737
  482   1HG   LYS 897          1HG       LYS 897  13.095  -2.781   3.118
  483   2HG   LYS 897          2HG       LYS 897  14.334  -1.824   3.965
  484   1HD   LYS 897          1HD       LYS 897  13.443   0.179   2.566
  485   2HD   LYS 897          2HD       LYS 897  12.026  -0.852   2.257
  486   1HE   LYS 897          1HE       LYS 897  12.300  -1.178   4.952
  487   2HE   LYS 897          2HE       LYS 897  12.910   0.481   4.766
  488   1HZ   LYS 897          1HZ       LYS 897  10.462   0.164   5.115
  489   2HZ   LYS 897          2HZ       LYS 897  10.916   1.159   3.880
  490   3HZ   LYS 897          3HZ       LYS 897  10.392  -0.371   3.556
  491    H    ASN 898           H        ASN 898  14.612   1.203   2.085
  492    HA   ASN 898           HA       ASN 898  16.021   2.393  -0.160
  493   1HB   ASN 898          1HB       ASN 898  13.948   0.785  -0.891
  494   2HB   ASN 898          2HB       ASN 898  13.090   2.320  -0.633
  495   1HD2  ASN 898          1HD2      ASN 898  12.661   2.473  -2.913
  496   2HD2  ASN 898          2HD2      ASN 898  13.917   2.964  -4.029
  497    HA   PRO 899           HA       PRO 899  14.668   5.451   2.903
  498   1HB   PRO 899          1HB       PRO 899  16.779   7.139   2.563
  499   2HB   PRO 899          2HB       PRO 899  16.940   5.591   3.455
  500   1HG   PRO 899          1HG       PRO 899  17.586   6.107   0.538
  501   2HG   PRO 899          2HG       PRO 899  18.650   5.357   1.772
  502   1HD   PRO 899          1HD       PRO 899  17.152   3.839   0.075
  503   2HD   PRO 899          2HD       PRO 899  17.336   3.367   1.792
  504    H    ALA 900           H        ALA 900  15.134   5.402  -0.509
  505    HA   ALA 900           HA       ALA 900  14.297   8.185  -0.913
  506   1HB   ALA 900          1HB       ALA 900  14.176   6.771  -3.344
  507   2HB   ALA 900          2HB       ALA 900  15.503   7.812  -2.774
  508   3HB   ALA 900          3HB       ALA 900  15.548   6.060  -2.461
  509    H    ALA 901           H        ALA 901  12.773   5.358  -0.028
  510    HA   ALA 901           HA       ALA 901  10.374   5.803  -1.690
  511   1HB   ALA 901          1HB       ALA 901   9.586   3.719  -0.690
  512   2HB   ALA 901          2HB       ALA 901  11.244   3.499  -1.299
  513   3HB   ALA 901          3HB       ALA 901  10.957   3.713   0.445
  514    H    GLN 902           H        GLN 902   8.505   4.864   0.299
  515    HA   GLN 902           HA       GLN 902   8.518   7.190   2.166
  516   1HB   GLN 902          1HB       GLN 902   6.556   6.300   0.167
  517   2HB   GLN 902          2HB       GLN 902   5.857   6.490   1.793
  518   1HG   GLN 902          1HG       GLN 902   7.354   8.552   0.140
  519   2HG   GLN 902          2HG       GLN 902   5.685   8.634   0.745
  520   1HE2  GLN 902          1HE2      GLN 902   6.336   7.536   3.396
  521   2HE2  GLN 902          2HE2      GLN 902   7.176   8.803   4.264
  522    H    GLN 903           H        GLN 903   8.135   6.749   4.286
  523    HA   GLN 903           HA       GLN 903   7.938   3.908   5.021
  524   1HB   GLN 903          1HB       GLN 903   8.583   6.486   6.462
  525   2HB   GLN 903          2HB       GLN 903   8.194   5.005   7.370
  526   1HG   GLN 903          1HG       GLN 903  10.275   4.230   7.024
  527   2HG   GLN 903          2HG       GLN 903  10.024   4.318   5.267
  528   1HE2  GLN 903          1HE2      GLN 903  10.600   6.276   4.129
  529   2HE2  GLN 903          2HE2      GLN 903  11.772   7.384   4.808
  530    H    VAL 904           H        VAL 904   5.678   3.867   4.077
  531    HA   VAL 904           HA       VAL 904   3.651   5.217   5.729
  532    HB   VAL 904           HB       VAL 904   2.351   5.001   3.901
  533   1HG1  VAL 904          1HG1      VAL 904   4.653   3.634   2.483
  534   2HG1  VAL 904          2HG1      VAL 904   3.502   4.831   1.843
  535   3HG1  VAL 904          3HG1      VAL 904   4.769   5.337   2.986
  536   1HG2  VAL 904          1HG2      VAL 904   1.748   2.722   4.466
  537   2HG2  VAL 904          2HG2      VAL 904   2.096   2.776   2.722
  538   3HG2  VAL 904          3HG2      VAL 904   3.300   2.107   3.849
  539    H    SER 905           H        SER 905   1.675   3.719   6.275
  540    HA   SER 905           HA       SER 905   2.742   1.193   7.446
  541   1HB   SER 905          1HB       SER 905   1.952   1.746   9.501
  542   2HB   SER 905          2HB       SER 905   2.022   3.415   8.887
  543    HG   SER 905           HG       SER 905  -0.032   2.952   9.707
  544    HA   PRO 906           HA       PRO 906  -0.839  -0.908   5.979
  545   1HB   PRO 906          1HB       PRO 906  -2.095  -2.057   8.107
  546   2HB   PRO 906          2HB       PRO 906  -0.423  -2.509   7.638
  547   1HG   PRO 906          1HG       PRO 906  -1.262  -0.498   9.747
  548   2HG   PRO 906          2HG       PRO 906  -0.121  -1.869   9.943
  549   1HD   PRO 906          1HD       PRO 906   0.765   0.653   9.408
  550   2HD   PRO 906          2HD       PRO 906   1.536  -0.764   8.631
  551    H    GLU 907           H        GLU 907  -1.502   1.343   8.662
  552    HA   GLU 907           HA       GLU 907  -4.331   1.542   8.120
  553   1HB   GLU 907          1HB       GLU 907  -2.308   2.927   9.844
  554   2HB   GLU 907          2HB       GLU 907  -3.836   3.775   9.504
  555   1HG   GLU 907          1HG       GLU 907  -3.914   2.347  11.573
  556   2HG   GLU 907          2HG       GLU 907  -5.131   1.908  10.355
  557    H    TRP 908           H        TRP 908  -1.433   2.910   6.750
  558    HA   TRP 908           HA       TRP 908  -2.558   5.331   5.730
  559   1HB   TRP 908          1HB       TRP 908  -0.167   4.993   5.910
  560   2HB   TRP 908          2HB       TRP 908  -0.241   3.600   4.823
  561    HD1  TRP 908           HD       TRP 908  -0.540   7.420   4.806
  562    HE1  TRP 908           1HE      TRP 908  -0.061   8.312   2.468
  563    HE3  TRP 908           3HE      TRP 908  -0.195   2.970   2.300
  564    HZ2  TRP 908           2HZ      TRP 908   0.414   7.234  -0.175
  565    HZ3  TRP 908           3HZ      TRP 908   0.271   2.943  -0.123
  566    HH2  TRP 908           HH       TRP 908   0.577   5.060  -1.372
  567    H    ILE 909           H        ILE 909  -2.471   1.967   4.591
  568    HA   ILE 909           HA       ILE 909  -3.376   2.526   1.928
  569    HB   ILE 909           HB       ILE 909  -3.117   0.124   3.707
  570   1HG1  ILE 909          1HG1      ILE 909  -2.349  -0.067   0.892
  571   2HG1  ILE 909          2HG1      ILE 909  -1.631   1.364   1.669
  572   1HG2  ILE 909          1HG2      ILE 909  -4.852   0.344   1.224
  573   2HG2  ILE 909          2HG2      ILE 909  -4.137  -1.201   1.746
  574   3HG2  ILE 909          3HG2      ILE 909  -5.278  -0.343   2.810
  575   1HD1  ILE 909          1HD1      ILE 909  -0.089  -0.420   2.065
  576   2HD1  ILE 909          2HD1      ILE 909  -0.971  -0.204   3.596
  577   3HD1  ILE 909          3HD1      ILE 909  -1.393  -1.547   2.507
  578    H    TRP 910           H        TRP 910  -5.044   1.508   4.955
  579    HA   TRP 910           HA       TRP 910  -7.641   1.342   3.872
  580   1HB   TRP 910          1HB       TRP 910  -6.839   2.248   6.652
  581   2HB   TRP 910          2HB       TRP 910  -8.395   1.560   6.169
  582    HD1  TRP 910           HD       TRP 910  -5.676   0.559   8.104
  583    HE1  TRP 910           1HE      TRP 910  -5.193  -1.941   8.062
  584    HE3  TRP 910           3HE      TRP 910  -8.293  -0.698   3.889
  585    HZ2  TRP 910           2HZ      TRP 910  -5.856  -4.220   6.405
  586    HZ3  TRP 910           3HZ      TRP 910  -8.344  -3.039   3.111
  587    HH2  TRP 910           HH       TRP 910  -7.134  -4.808   4.354
  588    H    ALA 911           H        ALA 911  -6.091   4.087   5.634
  589    HA   ALA 911           HA       ALA 911  -8.227   5.904   5.186
  590   1HB   ALA 911          1HB       ALA 911  -6.232   6.025   6.833
  591   2HB   ALA 911          2HB       ALA 911  -5.318   6.697   5.461
  592   3HB   ALA 911          3HB       ALA 911  -6.766   7.539   6.064
  593    H    CYS 912           H        CYS 912  -5.157   5.315   3.413
  594    HA   CYS 912           HA       CYS 912  -5.459   7.349   1.484
  595   1HB   CYS 912          1HB       CYS 912  -3.350   6.274   1.642
  596   2HB   CYS 912          2HB       CYS 912  -4.071   4.653   1.490
  597    HG   CYS 912           HG       CYS 912  -4.429   4.555  -0.887
  598    H    ILE 913           H        ILE 913  -6.445   3.881   1.383
  599    HA   ILE 913           HA       ILE 913  -7.543   3.792  -1.159
  600    HB   ILE 913           HB       ILE 913  -8.694   2.526   1.357
  601   1HG1  ILE 913          1HG1      ILE 913  -6.635   1.365  -0.552
  602   2HG1  ILE 913          2HG1      ILE 913  -6.175   2.244   0.926
  603   1HG2  ILE 913          1HG2      ILE 913 -10.235   1.955  -0.260
  604   2HG2  ILE 913          2HG2      ILE 913  -9.079   2.187  -1.594
  605   3HG2  ILE 913          3HG2      ILE 913  -9.016   0.706  -0.608
  606   1HD1  ILE 913          1HD1      ILE 913  -6.862   0.551   2.301
  607   2HD1  ILE 913          2HD1      ILE 913  -8.266   0.157   1.280
  608   3HD1  ILE 913          3HD1      ILE 913  -6.649  -0.447   0.843
  609    H    ARG 914           H        ARG 914  -9.662   4.103   1.731
  610    HA   ARG 914           HA       ARG 914 -11.906   5.051   0.417
  611   1HB   ARG 914          1HB       ARG 914 -11.114   4.630   3.055
  612   2HB   ARG 914          2HB       ARG 914 -11.482   6.371   3.001
  613   1HG   ARG 914          1HG       ARG 914 -13.344   4.276   1.827
  614   2HG   ARG 914          2HG       ARG 914 -13.453   4.805   3.523
  615   1HD   ARG 914          1HD       ARG 914 -13.245   7.034   1.604
  616   2HD   ARG 914          2HD       ARG 914 -14.694   6.034   1.368
  617    HE   ARG 914           HE       ARG 914 -14.388   6.595   4.145
  618   1HH1  ARG 914          2HH2      ARG 914 -15.176   8.160   1.074
  619   2HH1  ARG 914          1HH2      ARG 914 -16.190   9.386   1.802
  620   1HH2  ARG 914          2HH1      ARG 914 -15.727   8.215   5.107
  621   2HH2  ARG 914          1HH1      ARG 914 -16.503   9.417   4.101
  622    H    LYS 915           H        LYS 915  -9.115   6.919   1.680
  623    HA   LYS 915           HA       LYS 915 -10.128   9.499   1.180
  624   1HB   LYS 915          1HB       LYS 915  -7.341   8.315   1.254
  625   2HB   LYS 915          2HB       LYS 915  -7.614  10.046   0.939
  626   1HG   LYS 915          1HG       LYS 915  -8.857   8.623   3.317
  627   2HG   LYS 915          2HG       LYS 915  -7.238   9.358   3.396
  628   1HD   LYS 915          1HD       LYS 915  -8.116  11.542   2.881
  629   2HD   LYS 915          2HD       LYS 915  -9.713  10.869   2.473
  630   1HE   LYS 915          1HE       LYS 915 -10.280  10.503   4.691
  631   2HE   LYS 915          2HE       LYS 915  -8.589  10.326   5.206
  632   1HZ   LYS 915          1HZ       LYS 915  -8.612  12.416   5.778
  633   2HZ   LYS 915          2HZ       LYS 915  -8.957  12.888   4.235
  634   3HZ   LYS 915          3HZ       LYS 915 -10.181  12.581   5.296
  635    H    ARG 916           H        ARG 916  -9.100   6.988  -0.996
  636    HA   ARG 916           HA       ARG 916  -8.999   6.896  -3.280
  637   1HB   ARG 916          1HB       ARG 916 -10.936   9.012  -2.659
  638   2HB   ARG 916          2HB       ARG 916 -10.146   9.244  -4.237
  639   1HG   ARG 916          1HG       ARG 916 -11.772   7.788  -4.939
  640   2HG   ARG 916          2HG       ARG 916 -10.622   6.568  -4.342
  641   1HD   ARG 916          1HD       ARG 916 -12.267   5.863  -2.968
  642   2HD   ARG 916          2HD       ARG 916 -12.012   7.363  -2.050
  643    HE   ARG 916           HE       ARG 916 -14.147   6.840  -4.041
  644   1HH1  ARG 916          2HH2      ARG 916 -12.562   8.991  -1.725
  645   2HH1  ARG 916          1HH2      ARG 916 -13.914  10.096  -1.619
  646   1HH2  ARG 916          2HH1      ARG 916 -15.932   8.300  -3.901
  647   2HH2  ARG 916          1HH1      ARG 916 -15.835   9.702  -2.860
  648    H    ARG 917           H        ARG 917  -7.326   9.009  -1.415
  649    HA   ARG 917           HA       ARG 917  -5.533   9.692  -3.649
  650   1HB   ARG 917          1HB       ARG 917  -5.496  12.056  -2.271
  651   2HB   ARG 917          2HB       ARG 917  -6.442  11.774  -3.752
  652   1HG   ARG 917          1HG       ARG 917  -7.704  10.896  -1.193
  653   2HG   ARG 917          2HG       ARG 917  -7.549  12.653  -1.433
  654   1HD   ARG 917          1HD       ARG 917  -8.551  12.285  -3.758
  655   2HD   ARG 917          2HD       ARG 917  -8.942  10.635  -3.228
  656    HE   ARG 917           HE       ARG 917  -9.923  12.434  -1.275
  657   1HH1  ARG 917          2HH2      ARG 917 -10.453  11.536  -4.654
  658   2HH1  ARG 917          1HH2      ARG 917 -12.151  11.960  -4.642
  659   1HH2  ARG 917          2HH1      ARG 917 -12.165  12.993  -1.260
  660   2HH2  ARG 917          1HH1      ARG 917 -13.126  12.790  -2.707
  661    H    LEU 918           H        LEU 918  -3.557   9.061  -3.033
  662    HA   LEU 918           HA       LEU 918  -2.744   7.963  -0.714
  663   1HB   LEU 918          1HB       LEU 918  -1.218   9.894  -2.496
  664   2HB   LEU 918          2HB       LEU 918  -0.450   8.938  -1.206
  665    HG   LEU 918           HG       LEU 918  -0.221   7.704  -3.280
  666   1HD1  LEU 918          1HD1      LEU 918  -1.496   6.724  -0.983
  667   2HD1  LEU 918          2HD1      LEU 918  -2.492   6.118  -2.327
  668   3HD1  LEU 918          3HD1      LEU 918  -0.752   5.749  -2.273
  669   1HD2  LEU 918          1HD2      LEU 918  -2.329   8.981  -4.228
  670   2HD2  LEU 918          2HD2      LEU 918  -1.944   7.348  -4.821
  671   3HD2  LEU 918          3HD2      LEU 918  -3.219   7.574  -3.599
  672    H    VAL 919           H        VAL 919  -2.678   8.502   1.382
  673    HA   VAL 919           HA       VAL 919  -2.920  11.374   2.078
  674    HB   VAL 919           HB       VAL 919  -4.217  10.688   3.796
  675   1HG1  VAL 919          1HG1      VAL 919  -4.810   9.159   1.769
  676   2HG1  VAL 919          2HG1      VAL 919  -4.024   7.867   2.707
  677   3HG1  VAL 919          3HG1      VAL 919  -5.442   8.712   3.371
  678   1HG2  VAL 919          1HG2      VAL 919  -3.359   8.275   4.855
  679   2HG2  VAL 919          2HG2      VAL 919  -1.841   8.999   4.271
  680   3HG2  VAL 919          3HG2      VAL 919  -2.861   9.884   5.432
  681    H    ALA 920           H        ALA 920  -1.916  11.370   4.642
  682    HA   ALA 920           HA       ALA 920   0.896  11.581   4.154
  683   1HB   ALA 920          1HB       ALA 920   0.778  11.721   6.818
  684   2HB   ALA 920          2HB       ALA 920   0.195  13.052   5.789
  685   3HB   ALA 920          3HB       ALA 920  -0.963  11.894   6.487
  686    HA   PRO 921           HA       PRO 921   1.737   7.243   4.817
  687   1HB   PRO 921          1HB       PRO 921   4.376   7.330   4.144
  688   2HB   PRO 921          2HB       PRO 921   3.081   7.516   2.917
  689   1HG   PRO 921          1HG       PRO 921   4.594   9.724   4.341
  690   2HG   PRO 921          2HG       PRO 921   4.362   9.528   2.572
  691   1HD   PRO 921          1HD       PRO 921   2.735  11.140   4.051
  692   2HD   PRO 921          2HD       PRO 921   2.059  10.122   2.743
  693    H    CYS 922           H        CYS 922   2.149   6.308   6.746
  694    HA   CYS 922           HA       CYS 922   4.324   7.270   8.439
  695   1HB   CYS 922          1HB       CYS 922   2.725   7.536  10.408
  696   2HB   CYS 922          2HB       CYS 922   2.652   8.825   9.180
  697    HG   CYS 922           HG       CYS 922   0.561   6.603  10.158
  Start of MODEL    8
    1    H    GLY 835           H        GLY 835  -7.618  -2.567  12.485
    2   1HA   GLY 835          1HA       GLY 835  -8.670  -4.589  11.334
    3   2HA   GLY 835          2HA       GLY 835  -9.743  -3.730  12.462
    4    H    SER 836           H        SER 836  -9.041  -1.716   9.848
    5    HA   SER 836           HA       SER 836 -11.699  -1.678   8.889
    6   1HB   SER 836          1HB       SER 836  -9.041  -0.666   7.879
    7   2HB   SER 836          2HB       SER 836 -10.498  -0.527   6.865
    8    HG   SER 836           HG       SER 836 -10.135   1.291   8.257
    9    H    ALA 837           H        ALA 837  -9.316  -2.131   6.375
   10    HA   ALA 837           HA       ALA 837  -9.611  -3.470   4.482
   11   1HB   ALA 837          1HB       ALA 837  -9.371  -5.798   6.355
   12   2HB   ALA 837          2HB       ALA 837  -8.451  -5.423   4.878
   13   3HB   ALA 837          3HB       ALA 837  -8.091  -4.560   6.393
   14    H    ASP 838           H        ASP 838 -10.966  -5.802   6.827
   15    HA   ASP 838           HA       ASP 838 -12.885  -6.939   5.282
   16   1HB   ASP 838          1HB       ASP 838 -12.801  -6.222   8.204
   17   2HB   ASP 838          2HB       ASP 838 -14.275  -6.949   7.527
   18    H    GLU 839           H        GLU 839 -13.129  -3.768   6.924
   19    HA   GLU 839           HA       GLU 839 -15.864  -3.358   6.019
   20   1HB   GLU 839          1HB       GLU 839 -13.934  -2.082   7.799
   21   2HB   GLU 839          2HB       GLU 839 -14.767  -0.891   6.770
   22   1HG   GLU 839          1HG       GLU 839 -16.630  -2.911   7.730
   23   2HG   GLU 839          2HG       GLU 839 -15.778  -2.148   9.090
   24    H    THR 840           H        THR 840 -12.589  -2.612   4.909
   25    HA   THR 840           HA       THR 840 -13.606  -0.793   2.834
   26    HB   THR 840           HB       THR 840 -10.779  -1.831   3.223
   27    HG1  THR 840           1HG      THR 840 -10.579   0.182   4.416
   28   1HG2  THR 840          1HG2      THR 840 -10.177   0.219   2.057
   29   2HG2  THR 840          2HG2      THR 840 -11.403  -0.638   1.093
   30   3HG2  THR 840          3HG2      THR 840 -11.869   0.772   2.074
   31    H    LEU 841           H        LEU 841 -12.097  -4.030   3.155
   32    HA   LEU 841           HA       LEU 841 -12.111  -4.518   0.305
   33   1HB   LEU 841          1HB       LEU 841 -10.845  -5.621   2.486
   34   2HB   LEU 841          2HB       LEU 841 -12.090  -6.843   2.131
   35    HG   LEU 841           HG       LEU 841 -10.507  -7.576   0.636
   36   1HD1  LEU 841          1HD1      LEU 841 -12.336  -5.636  -0.547
   37   2HD1  LEU 841          2HD1      LEU 841 -10.815  -5.722  -1.467
   38   3HD1  LEU 841          3HD1      LEU 841 -11.774  -7.196  -1.194
   39   1HD2  LEU 841          1HD2      LEU 841  -9.504  -4.783   0.037
   40   2HD2  LEU 841          2HD2      LEU 841  -8.981  -5.640   1.507
   41   3HD2  LEU 841          3HD2      LEU 841  -8.642  -6.334  -0.097
   42    H    CYS 842           H        CYS 842 -14.611  -4.092   2.390
   43    HA   CYS 842           HA       CYS 842 -16.289  -6.341   1.958
   44   1HB   CYS 842          1HB       CYS 842 -16.486  -3.622   3.035
   45   2HB   CYS 842          2HB       CYS 842 -17.968  -4.122   2.181
   46    HG   CYS 842           HG       CYS 842 -17.047  -4.722   5.026
   47    H    GLN 843           H        GLN 843 -14.959  -4.262  -0.293
   48    HA   GLN 843           HA       GLN 843 -17.286  -4.605  -2.127
   49   1HB   GLN 843          1HB       GLN 843 -15.066  -2.598  -2.533
   50   2HB   GLN 843          2HB       GLN 843 -16.731  -2.577  -3.161
   51   1HG   GLN 843          1HG       GLN 843 -16.830  -2.669  -0.286
   52   2HG   GLN 843          2HG       GLN 843 -15.724  -1.366  -0.773
   53   1HE2  GLN 843          1HE2      GLN 843 -17.911  -0.497   0.480
   54   2HE2  GLN 843          2HE2      GLN 843 -19.083   0.177  -0.632
   55    H    THR 844           H        THR 844 -16.494  -6.800  -2.549
   56    HA   THR 844           HA       THR 844 -15.318  -8.334  -3.777
   57    HB   THR 844           HB       THR 844 -15.724  -6.022  -5.398
   58    HG1  THR 844           1HG      THR 844 -16.446  -8.202  -5.702
   59   1HG2  THR 844          1HG2      THR 844 -12.929  -7.137  -5.416
   60   2HG2  THR 844          2HG2      THR 844 -13.676  -6.694  -6.970
   61   3HG2  THR 844          3HG2      THR 844 -13.487  -5.469  -5.692
   62    H    LYS 845           H        LYS 845 -13.130  -5.594  -4.489
   63    HA   LYS 845           HA       LYS 845 -11.125  -6.730  -2.636
   64   1HB   LYS 845          1HB       LYS 845 -11.107  -7.390  -5.331
   65   2HB   LYS 845          2HB       LYS 845  -9.995  -6.001  -5.252
   66   1HG   LYS 845          1HG       LYS 845  -8.865  -8.218  -4.861
   67   2HG   LYS 845          2HG       LYS 845  -8.688  -7.081  -3.503
   68   1HD   LYS 845          1HD       LYS 845 -11.129  -8.647  -3.229
   69   2HD   LYS 845          2HD       LYS 845  -9.712  -9.710  -3.395
   70   1HE   LYS 845          1HE       LYS 845  -9.448  -7.333  -1.593
   71   2HE   LYS 845          2HE       LYS 845 -10.468  -8.674  -1.027
   72   1HZ   LYS 845          1HZ       LYS 845  -8.632  -9.682  -0.465
   73   2HZ   LYS 845          2HZ       LYS 845  -8.188  -9.784  -2.050
   74   3HZ   LYS 845          3HZ       LYS 845  -7.684  -8.509  -1.133
   75    H    VAL 846           H        VAL 846 -12.864  -4.152  -3.752
   76    HA   VAL 846           HA       VAL 846 -12.508  -1.867  -3.858
   77    HB   VAL 846           HB       VAL 846 -11.022  -1.307  -1.630
   78   1HG1  VAL 846          1HG1      VAL 846 -13.073  -0.796  -0.700
   79   2HG1  VAL 846          2HG1      VAL 846 -13.590  -1.042  -2.386
   80   3HG1  VAL 846          3HG1      VAL 846 -13.801  -2.345  -1.191
   81   1HG2  VAL 846          1HG2      VAL 846 -12.441  -3.768  -0.724
   82   2HG2  VAL 846          2HG2      VAL 846 -10.929  -4.028  -1.627
   83   3HG2  VAL 846          3HG2      VAL 846 -10.921  -3.047  -0.142
   84    H    LEU 847           H        LEU 847 -11.284  -0.814  -5.298
   85    HA   LEU 847           HA       LEU 847  -8.394  -0.634  -4.868
   86   1HB   LEU 847          1HB       LEU 847  -9.399  -1.630  -7.548
   87   2HB   LEU 847          2HB       LEU 847  -7.727  -1.573  -6.941
   88    HG   LEU 847           HG       LEU 847  -8.685  -3.879  -6.870
   89   1HD1  LEU 847          1HD1      LEU 847  -7.812  -2.364  -4.434
   90   2HD1  LEU 847          2HD1      LEU 847  -8.427  -4.017  -4.196
   91   3HD1  LEU 847          3HD1      LEU 847  -7.032  -3.732  -5.264
   92   1HD2  LEU 847          1HD2      LEU 847 -10.383  -3.518  -4.561
   93   2HD2  LEU 847          2HD2      LEU 847 -10.954  -2.465  -5.878
   94   3HD2  LEU 847          3HD2      LEU 847 -10.791  -4.217  -6.146
   95    H    LEU 848           H        LEU 848  -8.993   1.579  -4.486
   96    HA   LEU 848           HA       LEU 848 -10.061   3.034  -6.835
   97   1HB   LEU 848          1HB       LEU 848 -10.039   3.407  -3.902
   98   2HB   LEU 848          2HB       LEU 848  -9.710   4.888  -4.834
   99    HG   LEU 848           HG       LEU 848 -11.941   3.123  -5.783
  100   1HD1  LEU 848          1HD1      LEU 848 -11.782   4.269  -3.089
  101   2HD1  LEU 848          2HD1      LEU 848 -13.160   4.916  -4.010
  102   3HD1  LEU 848          3HD1      LEU 848 -12.991   3.159  -3.779
  103   1HD2  LEU 848          1HD2      LEU 848 -12.050   4.968  -7.094
  104   2HD2  LEU 848          2HD2      LEU 848 -12.730   5.796  -5.672
  105   3HD2  LEU 848          3HD2      LEU 848 -10.985   5.894  -6.010
  106    H    ASP 849           H        ASP 849  -8.993   5.394  -6.909
  107    HA   ASP 849           HA       ASP 849  -6.236   4.912  -7.679
  108   1HB   ASP 849          1HB       ASP 849  -8.093   7.304  -7.704
  109   2HB   ASP 849          2HB       ASP 849  -6.381   7.437  -8.160
  110    H    ILE 850           H        ILE 850  -6.429   4.320  -4.992
  111    HA   ILE 850           HA       ILE 850  -5.810   6.575  -3.315
  112    HB   ILE 850           HB       ILE 850  -4.779   3.998  -2.397
  113   1HG1  ILE 850          1HG1      ILE 850  -6.589   3.388  -4.172
  114   2HG1  ILE 850          2HG1      ILE 850  -6.732   2.674  -2.548
  115   1HG2  ILE 850          1HG2      ILE 850  -7.269   5.227  -1.304
  116   2HG2  ILE 850          2HG2      ILE 850  -5.801   4.678  -0.459
  117   3HG2  ILE 850          3HG2      ILE 850  -5.814   6.253  -1.288
  118   1HD1  ILE 850          1HD1      ILE 850  -8.338   4.901  -3.804
  119   2HD1  ILE 850          2HD1      ILE 850  -8.903   3.470  -2.909
  120   3HD1  ILE 850          3HD1      ILE 850  -8.160   4.831  -2.035
  121    H    PHE 851           H        PHE 851  -3.605   3.809  -3.433
  122    HA   PHE 851           HA       PHE 851  -1.293   5.431  -3.227
  123   1HB   PHE 851          1HB       PHE 851  -1.298   2.664  -4.425
  124   2HB   PHE 851          2HB       PHE 851  -0.091   3.422  -3.373
  125    HD1  PHE 851           1HD      PHE 851  -2.435   0.919  -3.439
  126    HD2  PHE 851           2HD      PHE 851  -1.312   4.292  -1.029
  127    HE1  PHE 851           1HE      PHE 851  -3.499  -0.138  -1.463
  128    HE2  PHE 851           2HE      PHE 851  -2.375   3.235   0.947
  129    HZ   PHE 851           HZ       PHE 851  -3.468   1.020   0.729
  130    H    THR 852           H        THR 852  -3.221   5.970  -5.554
  131    HA   THR 852           HA       THR 852  -2.342   5.322  -8.038
  132    HB   THR 852           HB       THR 852  -3.985   7.234  -7.037
  133    HG1  THR 852           1HG      THR 852  -4.427   7.570  -9.126
  134   1HG2  THR 852          1HG2      THR 852  -3.129   9.438  -7.800
  135   2HG2  THR 852          2HG2      THR 852  -2.115   8.755  -6.507
  136   3HG2  THR 852          3HG2      THR 852  -1.566   8.684  -8.199
  137    H    GLY 853           H        GLY 853  -0.251   4.910  -8.563
  138   1HA   GLY 853          1HA       GLY 853   1.888   5.454  -9.240
  139   2HA   GLY 853          2HA       GLY 853   1.555   7.155  -8.840
  140    H    VAL 854           H        VAL 854   0.718   5.150  -6.240
  141    HA   VAL 854           HA       VAL 854   3.106   6.030  -4.762
  142    HB   VAL 854           HB       VAL 854   0.444   4.793  -3.997
  143   1HG1  VAL 854          1HG1      VAL 854   1.152   4.492  -1.801
  144   2HG1  VAL 854          2HG1      VAL 854   2.629   4.037  -2.683
  145   3HG1  VAL 854          3HG1      VAL 854   2.487   5.658  -1.961
  146   1HG2  VAL 854          1HG2      VAL 854   0.590   7.004  -2.556
  147   2HG2  VAL 854          2HG2      VAL 854   1.809   7.474  -3.765
  148   3HG2  VAL 854          3HG2      VAL 854   0.147   7.095  -4.278
  149    H    ARG 855           H        ARG 855   4.856   4.754  -5.086
  150    HA   ARG 855           HA       ARG 855   4.469   1.831  -5.280
  151   1HB   ARG 855          1HB       ARG 855   6.605   1.765  -6.242
  152   2HB   ARG 855          2HB       ARG 855   5.964   3.320  -6.826
  153   1HG   ARG 855          1HG       ARG 855   7.055   4.330  -4.690
  154   2HG   ARG 855          2HG       ARG 855   7.971   2.805  -4.613
  155   1HD   ARG 855          1HD       ARG 855   9.126   4.681  -5.871
  156   2HD   ARG 855          2HD       ARG 855   8.925   3.174  -6.791
  157    HE   ARG 855           HE       ARG 855   7.008   4.237  -7.936
  158   1HH1  ARG 855          2HH2      ARG 855   9.285   6.277  -6.158
  159   2HH1  ARG 855          1HH2      ARG 855   8.910   7.724  -7.067
  160   1HH2  ARG 855          2HH1      ARG 855   6.513   6.149  -9.136
  161   2HH2  ARG 855          1HH1      ARG 855   7.330   7.651  -8.765
  162    H    LEU 856           H        LEU 856   3.889   1.407  -3.087
  163    HA   LEU 856           HA       LEU 856   6.001   1.994  -1.084
  164   1HB   LEU 856          1HB       LEU 856   4.338   2.113   0.457
  165   2HB   LEU 856          2HB       LEU 856   3.281   2.324  -0.959
  166    HG   LEU 856           HG       LEU 856   2.782  -0.046  -1.024
  167   1HD1  LEU 856          1HD1      LEU 856   5.195  -0.158   0.694
  168   2HD1  LEU 856          2HD1      LEU 856   3.872  -1.231   1.211
  169   3HD1  LEU 856          3HD1      LEU 856   4.540  -1.370  -0.433
  170   1HD2  LEU 856          1HD2      LEU 856   1.337  -0.008   0.745
  171   2HD2  LEU 856          2HD2      LEU 856   2.633   0.303   1.925
  172   3HD2  LEU 856          3HD2      LEU 856   1.960   1.644   0.968
  173    H    TYR 857           H        TYR 857   7.153   0.383  -0.105
  174    HA   TYR 857           HA       TYR 857   7.121  -2.221  -1.379
  175   1HB   TYR 857          1HB       TYR 857   9.257  -1.855  -0.770
  176   2HB   TYR 857          2HB       TYR 857   8.800  -0.685   0.480
  177    HD1  TYR 857           1HD      TYR 857   8.089  -4.350   0.024
  178    HD2  TYR 857           2HD      TYR 857   9.772  -1.268   2.498
  179    HE1  TYR 857           1HE      TYR 857   8.588  -6.031   1.779
  180    HE2  TYR 857           2HE      TYR 857  10.270  -2.948   4.252
  181    HH   TYR 857           HH       TYR 857   9.566  -6.423   3.809
  182    H    LEU 858           H        LEU 858   5.304  -3.411  -0.963
  183    HA   LEU 858           HA       LEU 858   4.177  -3.499   1.730
  184   1HB   LEU 858          1HB       LEU 858   2.784  -3.554  -0.346
  185   2HB   LEU 858          2HB       LEU 858   3.504  -5.132  -0.748
  186    HG   LEU 858           HG       LEU 858   2.253  -6.229   0.805
  187   1HD1  LEU 858          1HD1      LEU 858   3.460  -5.423   2.715
  188   2HD1  LEU 858          2HD1      LEU 858   2.757  -3.796   2.557
  189   3HD1  LEU 858          3HD1      LEU 858   1.736  -5.159   3.073
  190   1HD2  LEU 858          1HD2      LEU 858   0.080  -5.363   1.005
  191   2HD2  LEU 858          2HD2      LEU 858   0.659  -3.691   1.201
  192   3HD2  LEU 858          3HD2      LEU 858   0.715  -4.470  -0.398
  193    HA   PRO 859           HA       PRO 859   7.015  -6.803   2.786
  194   1HB   PRO 859          1HB       PRO 859   6.436  -6.855   5.448
  195   2HB   PRO 859          2HB       PRO 859   7.363  -5.510   4.709
  196   1HG   PRO 859          1HG       PRO 859   4.386  -5.598   5.272
  197   2HG   PRO 859          2HG       PRO 859   5.548  -4.322   5.760
  198   1HD   PRO 859          1HD       PRO 859   4.039  -4.082   3.503
  199   2HD   PRO 859          2HD       PRO 859   5.749  -3.553   3.512
  200    HA   PRO 860           HA       PRO 860   4.141 -10.152   2.559
  201   1HB   PRO 860          1HB       PRO 860   5.791 -12.224   3.197
  202   2HB   PRO 860          2HB       PRO 860   6.003 -11.276   1.689
  203   1HG   PRO 860          1HG       PRO 860   7.440 -10.876   4.329
  204   2HG   PRO 860          2HG       PRO 860   8.179 -11.058   2.704
  205   1HD   PRO 860          1HD       PRO 860   7.725  -8.600   3.792
  206   2HD   PRO 860          2HD       PRO 860   7.433  -8.889   2.050
  207    H    SER 861           H        SER 861   5.930  -9.254   5.438
  208    HA   SER 861           HA       SER 861   4.490 -11.109   7.176
  209   1HB   SER 861          1HB       SER 861   6.830  -9.437   7.310
  210   2HB   SER 861          2HB       SER 861   5.740  -9.017   8.653
  211    HG   SER 861           HG       SER 861   7.319 -10.925   8.779
  212    H    THR 862           H        THR 862   3.840  -8.126   5.658
  213    HA   THR 862           HA       THR 862   2.353  -6.825   7.726
  214    HB   THR 862           HB       THR 862   2.977  -6.452   4.917
  215    HG1  THR 862           1HG      THR 862   1.922  -4.754   6.936
  216   1HG2  THR 862          1HG2      THR 862   0.113  -5.917   5.811
  217   2HG2  THR 862          2HG2      THR 862   0.852  -5.260   4.331
  218   3HG2  THR 862          3HG2      THR 862   0.631  -7.017   4.512
  219    HA   PRO 863           HA       PRO 863  -1.298  -9.280   7.799
  220   1HB   PRO 863          1HB       PRO 863  -3.029  -7.514   8.942
  221   2HB   PRO 863          2HB       PRO 863  -1.621  -8.172   9.838
  222   1HG   PRO 863          1HG       PRO 863  -1.782  -5.537   8.345
  223   2HG   PRO 863          2HG       PRO 863  -1.253  -5.798  10.039
  224   1HD   PRO 863          1HD       PRO 863   0.545  -5.629   7.998
  225   2HD   PRO 863          2HD       PRO 863   0.779  -6.815   9.317
  226    H    ASP 864           H        ASP 864  -3.055  -9.673   6.472
  227    HA   ASP 864           HA       ASP 864  -4.519  -9.402   4.732
  228   1HB   ASP 864          1HB       ASP 864  -4.326  -6.755   5.960
  229   2HB   ASP 864          2HB       ASP 864  -4.663  -6.659   4.218
  230    H    PHE 865           H        PHE 865  -1.418  -9.260   4.549
  231    HA   PHE 865           HA       PHE 865  -0.595  -7.688   2.403
  232   1HB   PHE 865          1HB       PHE 865   0.815  -9.154   3.872
  233   2HB   PHE 865          2HB       PHE 865   0.226 -10.556   2.963
  234    HD1  PHE 865           1HD      PHE 865   1.912  -7.242   2.444
  235    HD2  PHE 865           2HD      PHE 865   1.410 -11.291   1.100
  236    HE1  PHE 865           1HE      PHE 865   3.706  -6.907   0.765
  237    HE2  PHE 865           2HE      PHE 865   3.204 -10.956  -0.579
  238    HZ   PHE 865           HZ       PHE 865   4.352  -8.764  -0.747
  239    H    SER 866           H        SER 866  -1.855 -11.071   2.265
  240    HA   SER 866           HA       SER 866  -1.836 -11.706  -0.322
  241   1HB   SER 866          1HB       SER 866  -3.250 -12.620   1.758
  242   2HB   SER 866          2HB       SER 866  -4.569 -11.783   0.904
  243    HG   SER 866           HG       SER 866  -3.313 -13.014  -0.968
  244    H    ARG 867           H        ARG 867  -3.985  -9.199   1.071
  245    HA   ARG 867           HA       ARG 867  -4.994  -8.543  -1.618
  246   1HB   ARG 867          1HB       ARG 867  -5.612  -7.135   0.996
  247   2HB   ARG 867          2HB       ARG 867  -6.592  -7.193  -0.489
  248   1HG   ARG 867          1HG       ARG 867  -7.682  -8.798   0.792
  249   2HG   ARG 867          2HG       ARG 867  -6.491  -9.818  -0.051
  250   1HD   ARG 867          1HD       ARG 867  -5.279 -10.200   1.845
  251   2HD   ARG 867          2HD       ARG 867  -5.531  -8.552   2.459
  252    HE   ARG 867           HE       ARG 867  -6.994 -10.875   3.216
  253   1HH1  ARG 867          2HH2      ARG 867  -7.457  -7.480   2.343
  254   2HH1  ARG 867          1HH2      ARG 867  -8.905  -7.288   3.305
  255   1HH2  ARG 867          2HH1      ARG 867  -8.907 -10.621   4.486
  256   2HH2  ARG 867          1HH1      ARG 867  -9.732  -9.079   4.527
  257    H    LEU 868           H        LEU 868  -3.500  -6.754   1.146
  258    HA   LEU 868           HA       LEU 868  -2.967  -4.334   0.220
  259   1HB   LEU 868          1HB       LEU 868  -0.923  -6.260   1.384
  260   2HB   LEU 868          2HB       LEU 868  -0.641  -4.512   1.203
  261    HG   LEU 868           HG       LEU 868  -2.647  -5.945   2.959
  262   1HD1  LEU 868          1HD1      LEU 868  -1.235  -5.232   4.563
  263   2HD1  LEU 868          2HD1      LEU 868  -0.176  -4.546   3.307
  264   3HD1  LEU 868          3HD1      LEU 868  -1.460  -3.548   4.032
  265   1HD2  LEU 868          1HD2      LEU 868  -3.915  -4.286   1.630
  266   2HD2  LEU 868          2HD2      LEU 868  -3.762  -3.764   3.325
  267   3HD2  LEU 868          3HD2      LEU 868  -2.735  -3.029   2.071
  268    H    ARG 869           H        ARG 869  -1.195  -7.239  -0.944
  269    HA   ARG 869           HA       ARG 869   0.374  -5.753  -2.848
  270   1HB   ARG 869          1HB       ARG 869   0.124  -8.469  -1.880
  271   2HB   ARG 869          2HB       ARG 869   0.160  -8.460  -3.659
  272   1HG   ARG 869          1HG       ARG 869   2.136  -6.753  -3.344
  273   2HG   ARG 869          2HG       ARG 869   2.226  -7.440  -1.704
  274   1HD   ARG 869          1HD       ARG 869   2.659  -8.795  -4.368
  275   2HD   ARG 869          2HD       ARG 869   3.685  -8.821  -2.918
  276    HE   ARG 869           HE       ARG 869   1.263 -10.022  -2.185
  277   1HH1  ARG 869          2HH2      ARG 869   3.871 -10.551  -4.513
  278   2HH1  ARG 869          1HH2      ARG 869   3.685 -12.290  -4.533
  279   1HH2  ARG 869          2HH1      ARG 869   1.018 -12.320  -2.211
  280   2HH2  ARG 869          1HH1      ARG 869   2.059 -13.299  -3.220
  281    H    ARG 870           H        ARG 870  -1.654  -8.499  -3.837
  282    HA   ARG 870           HA       ARG 870  -2.229  -7.685  -6.378
  283   1HB   ARG 870          1HB       ARG 870  -2.961  -9.790  -4.925
  284   2HB   ARG 870          2HB       ARG 870  -4.476  -8.868  -4.773
  285   1HG   ARG 870          1HG       ARG 870  -5.064  -9.370  -6.892
  286   2HG   ARG 870          2HG       ARG 870  -3.501  -8.790  -7.514
  287   1HD   ARG 870          1HD       ARG 870  -2.706 -10.891  -7.724
  288   2HD   ARG 870          2HD       ARG 870  -3.223 -11.322  -6.080
  289    HE   ARG 870           HE       ARG 870  -5.565 -11.285  -7.560
  290   1HH1  ARG 870          2HH2      ARG 870  -2.440 -12.925  -7.763
  291   2HH1  ARG 870          1HH2      ARG 870  -3.087 -14.357  -8.531
  292   1HH2  ARG 870          2HH1      ARG 870  -6.420 -13.177  -8.574
  293   2HH2  ARG 870          1HH1      ARG 870  -5.357 -14.501  -8.993
  294    H    TYR 871           H        TYR 871  -3.426  -6.286  -3.406
  295    HA   TYR 871           HA       TYR 871  -5.642  -4.895  -4.705
  296   1HB   TYR 871          1HB       TYR 871  -5.632  -5.689  -2.315
  297   2HB   TYR 871          2HB       TYR 871  -4.403  -4.461  -1.970
  298    HD1  TYR 871           1HD      TYR 871  -5.348  -2.769  -0.700
  299    HD2  TYR 871           2HD      TYR 871  -7.562  -4.386  -4.007
  300    HE1  TYR 871           1HE      TYR 871  -7.133  -1.088  -0.327
  301    HE2  TYR 871           2HE      TYR 871  -9.347  -2.704  -3.635
  302    HH   TYR 871           HH       TYR 871  -9.893  -1.067  -0.997
  303    H    PHE 872           H        PHE 872  -2.797  -3.695  -2.833
  304    HA   PHE 872           HA       PHE 872  -2.870  -1.069  -3.739
  305   1HB   PHE 872          1HB       PHE 872  -1.428  -1.959  -1.930
  306   2HB   PHE 872          2HB       PHE 872  -0.420  -2.763  -3.144
  307    HD1  PHE 872           1HD      PHE 872   0.243  -0.991  -5.163
  308    HD2  PHE 872           2HD      PHE 872  -0.512  -0.038  -1.043
  309    HE1  PHE 872           1HE      PHE 872   1.614   1.064  -5.387
  310    HE2  PHE 872           2HE      PHE 872   0.859   2.017  -1.267
  311    HZ   PHE 872           HZ       PHE 872   1.921   2.568  -3.439
  312    H    VAL 873           H        VAL 873  -0.143  -3.060  -4.866
  313    HA   VAL 873           HA       VAL 873   0.537  -1.799  -7.127
  314    HB   VAL 873           HB       VAL 873   1.743  -3.752  -6.637
  315   1HG1  VAL 873          1HG1      VAL 873   0.250  -5.000  -5.290
  316   2HG1  VAL 873          2HG1      VAL 873  -0.991  -5.060  -6.565
  317   3HG1  VAL 873          3HG1      VAL 873   0.492  -6.032  -6.720
  318   1HG2  VAL 873          1HG2      VAL 873   1.862  -4.835  -8.697
  319   2HG2  VAL 873          2HG2      VAL 873   0.093  -4.889  -8.888
  320   3HG2  VAL 873          3HG2      VAL 873   0.970  -3.362  -9.148
  321    H    ALA 874           H        ALA 874  -2.412  -3.736  -6.709
  322    HA   ALA 874           HA       ALA 874  -3.179  -3.827  -9.446
  323   1HB   ALA 874          1HB       ALA 874  -5.542  -3.793  -8.012
  324   2HB   ALA 874          2HB       ALA 874  -4.556  -5.238  -8.337
  325   3HB   ALA 874          3HB       ALA 874  -4.367  -4.358  -6.801
  326    H    PHE 875           H        PHE 875  -4.335  -1.667  -6.787
  327    HA   PHE 875           HA       PHE 875  -6.019   0.024  -7.942
  328   1HB   PHE 875          1HB       PHE 875  -3.506   0.958  -6.517
  329   2HB   PHE 875          2HB       PHE 875  -5.006   1.882  -6.697
  330    HD1  PHE 875           1HD      PHE 875  -4.446   1.891  -4.071
  331    HD2  PHE 875           2HD      PHE 875  -5.902  -1.484  -6.294
  332    HE1  PHE 875           1HE      PHE 875  -5.312   0.885  -1.976
  333    HE2  PHE 875           2HE      PHE 875  -6.768  -2.491  -4.199
  334    HZ   PHE 875           HZ       PHE 875  -6.473  -1.306  -2.040
  335    H    ASP 876           H        ASP 876  -2.488   0.086  -8.615
  336    HA   ASP 876           HA       ASP 876  -2.276   0.431 -11.202
  337   1HB   ASP 876          1HB       ASP 876  -3.826   2.752 -10.162
  338   2HB   ASP 876          2HB       ASP 876  -2.553   3.123 -11.344
  339    H    GLY 877           H        GLY 877  -1.119   0.698  -8.241
  340   1HA   GLY 877          1HA       GLY 877   1.064   2.607  -8.827
  341   2HA   GLY 877          2HA       GLY 877   0.708   1.843  -7.261
  342    H    ASP 878           H        ASP 878   2.749   0.975  -6.879
  343    HA   ASP 878           HA       ASP 878   3.357  -1.451  -8.404
  344   1HB   ASP 878          1HB       ASP 878   4.972   1.064  -8.545
  345   2HB   ASP 878          2HB       ASP 878   5.852  -0.475  -8.417
  346    H    LEU 879           H        LEU 879   4.972  -2.786  -7.304
  347    HA   LEU 879           HA       LEU 879   5.447  -1.971  -4.484
  348   1HB   LEU 879          1HB       LEU 879   3.880  -4.255  -5.541
  349   2HB   LEU 879          2HB       LEU 879   5.068  -4.674  -4.283
  350    HG   LEU 879           HG       LEU 879   4.070  -3.259  -2.690
  351   1HD1  LEU 879          1HD1      LEU 879   2.260  -1.580  -3.453
  352   2HD1  LEU 879          2HD1      LEU 879   3.949  -1.191  -3.862
  353   3HD1  LEU 879          3HD1      LEU 879   2.865  -1.865  -5.103
  354   1HD2  LEU 879          1HD2      LEU 879   2.451  -4.883  -2.700
  355   2HD2  LEU 879          2HD2      LEU 879   1.438  -3.555  -3.313
  356   3HD2  LEU 879          3HD2      LEU 879   2.156  -4.724  -4.448
  357    H    VAL 880           H        VAL 880   7.499  -2.306  -3.822
  358    HA   VAL 880           HA       VAL 880   9.233  -3.947  -5.608
  359    HB   VAL 880           HB       VAL 880  10.617  -2.109  -3.809
  360   1HG1  VAL 880          1HG1      VAL 880  11.985  -1.929  -5.633
  361   2HG1  VAL 880          2HG1      VAL 880  11.079  -3.353  -6.199
  362   3HG1  VAL 880          3HG1      VAL 880  10.622  -1.727  -6.760
  363   1HG2  VAL 880          1HG2      VAL 880   8.966  -0.495  -3.916
  364   2HG2  VAL 880          2HG2      VAL 880   9.788  -0.156  -5.458
  365   3HG2  VAL 880          3HG2      VAL 880   8.297  -1.129  -5.439
  366    H    GLN 881           H        GLN 881  10.589  -5.478  -4.693
  367    HA   GLN 881           HA       GLN 881   9.759  -6.567  -2.171
  368   1HB   GLN 881          1HB       GLN 881  12.286  -7.175  -3.747
  369   2HB   GLN 881          2HB       GLN 881  11.450  -8.234  -2.586
  370   1HG   GLN 881          1HG       GLN 881   9.994  -8.946  -4.157
  371   2HG   GLN 881          2HG       GLN 881   9.640  -7.283  -4.674
  372   1HE2  GLN 881          1HE2      GLN 881  10.613  -6.443  -6.503
  373   2HE2  GLN 881          2HE2      GLN 881  11.704  -7.356  -7.523
  374    H    GLU 882           H        GLU 882  10.555  -6.279  -0.148
  375    HA   GLU 882           HA       GLU 882  11.750  -4.144   0.852
  376   1HB   GLU 882          1HB       GLU 882  11.173  -6.202   2.140
  377   2HB   GLU 882          2HB       GLU 882  12.686  -6.948   1.574
  378   1HG   GLU 882          1HG       GLU 882  13.729  -4.670   2.502
  379   2HG   GLU 882          2HG       GLU 882  12.268  -4.693   3.513
  380    H    PHE 883           H        PHE 883  13.934  -6.903   0.060
  381    HA   PHE 883           HA       PHE 883  16.253  -5.244  -0.028
  382   1HB   PHE 883          1HB       PHE 883  17.376  -7.210  -0.825
  383   2HB   PHE 883          2HB       PHE 883  16.196  -7.707   0.400
  384    HD1  PHE 883           1HD      PHE 883  17.155  -7.881  -3.129
  385    HD2  PHE 883           2HD      PHE 883  14.129  -8.892  -0.253
  386    HE1  PHE 883           1HE      PHE 883  16.159  -9.483  -4.739
  387    HE2  PHE 883           2HE      PHE 883  13.133 -10.493  -1.863
  388    HZ   PHE 883           HZ       PHE 883  14.149 -10.789  -4.107
  389    H    ASP 884           H        ASP 884  13.736  -4.767  -1.878
  390    HA   ASP 884           HA       ASP 884  15.384  -4.001  -4.208
  391   1HB   ASP 884          1HB       ASP 884  12.862  -5.692  -4.318
  392   2HB   ASP 884          2HB       ASP 884  13.571  -4.869  -5.724
  393    H    MET 885           H        MET 885  15.160  -1.841  -3.508
  394    HA   MET 885           HA       MET 885  12.511  -0.698  -4.123
  395   1HB   MET 885          1HB       MET 885  13.098   0.796  -1.953
  396   2HB   MET 885          2HB       MET 885  12.096  -0.673  -1.870
  397   1HG   MET 885          1HG       MET 885  14.291  -1.954  -1.519
  398   2HG   MET 885          2HG       MET 885  15.049  -0.375  -1.252
  399   1HE   MET 885          1HE       MET 885  12.246  -2.821   1.298
  400   2HE   MET 885          2HE       MET 885  11.300  -1.618   0.390
  401   3HE   MET 885          3HE       MET 885  12.359  -2.755  -0.477
  402    H    THR 886           H        THR 886  15.985  -0.339  -3.443
  403    HA   THR 886           HA       THR 886  16.918   2.006  -3.676
  404    HB   THR 886           HB       THR 886  18.494   1.414  -5.316
  405    HG1  THR 886           1HG      THR 886  16.616  -0.369  -6.464
  406   1HG2  THR 886          1HG2      THR 886  18.181  -0.278  -3.423
  407   2HG2  THR 886          2HG2      THR 886  17.288  -1.282  -4.590
  408   3HG2  THR 886          3HG2      THR 886  19.000  -0.893  -4.879
  409    H    SER 887           H        SER 887  14.994   0.795  -6.477
  410    HA   SER 887           HA       SER 887  14.691   3.589  -7.399
  411   1HB   SER 887          1HB       SER 887  14.653   0.903  -8.617
  412   2HB   SER 887          2HB       SER 887  13.350   1.972  -9.191
  413    HG   SER 887           HG       SER 887  15.827   3.160  -8.947
  414    H    ALA 888           H        ALA 888  13.093   1.204  -5.527
  415    HA   ALA 888           HA       ALA 888  10.415   1.415  -6.106
  416   1HB   ALA 888          1HB       ALA 888  11.948   1.252  -3.511
  417   2HB   ALA 888          2HB       ALA 888  10.172   1.368  -3.498
  418   3HB   ALA 888          3HB       ALA 888  10.969   0.006  -4.322
  419    H    THR 889           H        THR 889   8.814   2.675  -4.483
  420    HA   THR 889           HA       THR 889   9.665   5.529  -4.468
  421    HB   THR 889           HB       THR 889   7.941   4.526  -6.313
  422    HG1  THR 889           1HG      THR 889   7.848   6.576  -6.712
  423   1HG2  THR 889          1HG2      THR 889   6.491   4.016  -4.112
  424   2HG2  THR 889          2HG2      THR 889   6.025   5.719  -4.335
  425   3HG2  THR 889          3HG2      THR 889   5.730   4.538  -5.634
  426    H    HIS 890           H        HIS 890   7.483   2.988  -3.200
  427    HA   HIS 890           HA       HIS 890   7.357   4.548  -0.665
  428   1HB   HIS 890          1HB       HIS 890   5.171   3.151  -2.212
  429   2HB   HIS 890          2HB       HIS 890   5.043   3.394  -0.460
  430    HD1  HIS 890           1HD      HIS 890   6.300   5.935  -3.121
  431    HD2  HIS 890           2HD      HIS 890   3.323   5.332  -0.207
  432    HE1  HIS 890           1HE      HIS 890   4.962   8.110  -2.975
  433    H    VAL 891           H        VAL 891   6.879   3.155   1.246
  434    HA   VAL 891           HA       VAL 891   7.494   0.301   0.909
  435    HB   VAL 891           HB       VAL 891   9.306   0.540   2.708
  436   1HG1  VAL 891          1HG1      VAL 891  10.715   0.265   0.966
  437   2HG1  VAL 891          2HG1      VAL 891   9.370   0.708  -0.111
  438   3HG1  VAL 891          3HG1      VAL 891  10.501   1.958   0.461
  439   1HG2  VAL 891          1HG2      VAL 891   9.093   3.429   1.759
  440   2HG2  VAL 891          2HG2      VAL 891   8.791   2.831   3.408
  441   3HG2  VAL 891          3HG2      VAL 891  10.435   2.774   2.728
  442    H    LEU 892           H        LEU 892   6.290  -0.859   2.303
  443    HA   LEU 892           HA       LEU 892   4.661   0.569   4.257
  444   1HB   LEU 892          1HB       LEU 892   4.351  -1.707   2.693
  445   2HB   LEU 892          2HB       LEU 892   4.611  -2.368   4.325
  446    HG   LEU 892           HG       LEU 892   2.860  -0.056   4.453
  447   1HD1  LEU 892          1HD1      LEU 892   1.914  -0.373   2.367
  448   2HD1  LEU 892          2HD1      LEU 892   2.350  -2.098   2.314
  449   3HD1  LEU 892          3HD1      LEU 892   0.963  -1.560   3.291
  450   1HD2  LEU 892          1HD2      LEU 892   2.654  -1.501   6.245
  451   2HD2  LEU 892          2HD2      LEU 892   1.332  -2.123   5.229
  452   3HD2  LEU 892          3HD2      LEU 892   2.909  -2.950   5.243
  453    H    GLY 893           H        GLY 893   5.291   0.979   6.287
  454   1HA   GLY 893          1HA       GLY 893   6.428   0.828   8.277
  455   2HA   GLY 893          2HA       GLY 893   6.360  -0.934   8.050
  456    H    SER 894           H        SER 894   8.416   1.694   8.402
  457    HA   SER 894           HA       SER 894  10.718   1.767   8.396
  458   1HB   SER 894          1HB       SER 894  10.267  -1.077   7.512
  459   2HB   SER 894          2HB       SER 894  11.890  -0.360   7.371
  460    HG   SER 894           HG       SER 894  10.410  -1.017   9.622
  461    H    ARG 895           H        ARG 895  12.562   1.903   6.772
  462    HA   ARG 895           HA       ARG 895  11.607   2.096   3.978
  463   1HB   ARG 895          1HB       ARG 895  12.708   4.372   3.840
  464   2HB   ARG 895          2HB       ARG 895  11.216   4.323   4.809
  465   1HG   ARG 895          1HG       ARG 895  12.392   4.439   6.851
  466   2HG   ARG 895          2HG       ARG 895  13.921   3.912   6.107
  467   1HD   ARG 895          1HD       ARG 895  14.456   6.013   5.427
  468   2HD   ARG 895          2HD       ARG 895  12.789   6.381   4.937
  469    HE   ARG 895           HE       ARG 895  12.436   7.385   6.986
  470   1HH1  ARG 895          2HH2      ARG 895  15.285   5.296   7.132
  471   2HH1  ARG 895          1HH2      ARG 895  15.746   5.808   8.740
  472   1HH2  ARG 895          2HH1      ARG 895  13.046   8.060   9.110
  473   2HH2  ARG 895          1HH1      ARG 895  14.470   7.384   9.868
  474    H    ASP 896           H        ASP 896  14.187   1.965   6.399
  475    HA   ASP 896           HA       ASP 896  16.560   2.137   5.450
  476   1HB   ASP 896          1HB       ASP 896  16.319   0.672   7.291
  477   2HB   ASP 896          2HB       ASP 896  15.318  -0.467   6.365
  478    H    LYS 897           H        LYS 897  15.118  -0.960   4.349
  479    HA   LYS 897           HA       LYS 897  16.644  -1.580   2.247
  480   1HB   LYS 897          1HB       LYS 897  14.029  -1.806   1.179
  481   2HB   LYS 897          2HB       LYS 897  14.960  -3.051   2.047
  482   1HG   LYS 897          1HG       LYS 897  12.998  -2.864   3.339
  483   2HG   LYS 897          2HG       LYS 897  14.146  -1.812   4.204
  484   1HD   LYS 897          1HD       LYS 897  13.218   0.089   2.690
  485   2HD   LYS 897          2HD       LYS 897  11.872  -1.027   2.360
  486   1HE   LYS 897          1HE       LYS 897  11.991  -1.254   5.056
  487   2HE   LYS 897          2HE       LYS 897  12.603   0.405   4.877
  488   1HZ   LYS 897          1HZ       LYS 897  10.135   0.062   5.088
  489   2HZ   LYS 897          2HZ       LYS 897  10.659   1.063   3.886
  490   3HZ   LYS 897          3HZ       LYS 897  10.168  -0.470   3.527
  491    H    ASN 898           H        ASN 898  14.378   1.156   2.335
  492    HA   ASN 898           HA       ASN 898  15.775   2.381   0.093
  493   1HB   ASN 898          1HB       ASN 898  13.502   0.770  -0.437
  494   2HB   ASN 898          2HB       ASN 898  12.960   2.458  -0.560
  495   1HD2  ASN 898          1HD2      ASN 898  12.854   2.839  -2.727
  496   2HD2  ASN 898          2HD2      ASN 898  14.182   2.603  -3.843
  497    HA   PRO 899           HA       PRO 899  14.327   5.411   3.145
  498   1HB   PRO 899          1HB       PRO 899  16.406   7.143   2.825
  499   2HB   PRO 899          2HB       PRO 899  16.590   5.601   3.723
  500   1HG   PRO 899          1HG       PRO 899  17.259   6.124   0.813
  501   2HG   PRO 899          2HG       PRO 899  18.324   5.399   2.061
  502   1HD   PRO 899          1HD       PRO 899  16.878   3.846   0.350
  503   2HD   PRO 899          2HD       PRO 899  17.051   3.382   2.069
  504    H    ALA 900           H        ALA 900  14.824   5.360  -0.259
  505    HA   ALA 900           HA       ALA 900  13.918   8.125  -0.672
  506   1HB   ALA 900          1HB       ALA 900  15.548   7.445  -2.235
  507   2HB   ALA 900          2HB       ALA 900  14.800   5.844  -2.456
  508   3HB   ALA 900          3HB       ALA 900  14.014   7.294  -3.126
  509    H    ALA 901           H        ALA 901  12.473   5.247   0.171
  510    HA   ALA 901           HA       ALA 901  10.103   5.605  -1.550
  511   1HB   ALA 901          1HB       ALA 901   9.356   3.502  -0.530
  512   2HB   ALA 901          2HB       ALA 901  11.018   3.332  -1.145
  513   3HB   ALA 901          3HB       ALA 901  10.731   3.542   0.600
  514    H    GLN 902           H        GLN 902   8.264   4.560   0.466
  515    HA   GLN 902           HA       GLN 902   8.152   6.883   2.328
  516   1HB   GLN 902          1HB       GLN 902   6.074   5.776   0.444
  517   2HB   GLN 902          2HB       GLN 902   5.571   6.547   1.967
  518   1HG   GLN 902          1HG       GLN 902   7.335   7.789  -0.184
  519   2HG   GLN 902          2HG       GLN 902   5.639   8.202   0.148
  520   1HE2  GLN 902          1HE2      GLN 902   5.954   7.914   3.084
  521   2HE2  GLN 902          2HE2      GLN 902   6.835   9.330   3.615
  522    H    GLN 903           H        GLN 903   7.759   6.370   4.421
  523    HA   GLN 903           HA       GLN 903   7.492   3.514   5.066
  524   1HB   GLN 903          1HB       GLN 903   7.998   6.016   6.716
  525   2HB   GLN 903          2HB       GLN 903   7.831   4.388   7.417
  526   1HG   GLN 903          1HG       GLN 903  10.005   4.020   6.974
  527   2HG   GLN 903          2HG       GLN 903   9.635   4.138   5.240
  528   1HE2  GLN 903          1HE2      GLN 903  10.004   6.105   4.120
  529   2HE2  GLN 903          2HE2      GLN 903  10.988   7.382   4.801
  530    H    VAL 904           H        VAL 904   5.227   3.818   3.936
  531    HA   VAL 904           HA       VAL 904   3.210   5.038   5.664
  532    HB   VAL 904           HB       VAL 904   1.920   4.954   3.809
  533   1HG1  VAL 904          1HG1      VAL 904   4.217   3.733   2.277
  534   2HG1  VAL 904          2HG1      VAL 904   3.134   5.067   1.812
  535   3HG1  VAL 904          3HG1      VAL 904   4.410   5.337   3.023
  536   1HG2  VAL 904          1HG2      VAL 904   1.307   2.641   4.119
  537   2HG2  VAL 904          2HG2      VAL 904   1.754   2.837   2.407
  538   3HG2  VAL 904          3HG2      VAL 904   2.897   2.083   3.545
  539    H    SER 905           H        SER 905   1.207   3.643   6.175
  540    HA   SER 905           HA       SER 905   2.086   0.934   7.049
  541   1HB   SER 905          1HB       SER 905   1.410   1.307   9.202
  542   2HB   SER 905          2HB       SER 905   1.791   2.994   8.780
  543    HG   SER 905           HG       SER 905  -0.272   3.456   8.703
  544    HA   PRO 906           HA       PRO 906  -1.863  -0.611   5.807
  545   1HB   PRO 906          1HB       PRO 906  -3.244  -1.520   7.972
  546   2HB   PRO 906          2HB       PRO 906  -1.677  -2.241   7.479
  547   1HG   PRO 906          1HG       PRO 906  -2.136  -0.100   9.576
  548   2HG   PRO 906          2HG       PRO 906  -1.228  -1.635   9.769
  549   1HD   PRO 906          1HD       PRO 906   0.043   0.704   9.184
  550   2HD   PRO 906          2HD       PRO 906   0.558  -0.826   8.412
  551    H    GLU 907           H        GLU 907  -2.038   1.812   8.394
  552    HA   GLU 907           HA       GLU 907  -4.823   2.429   8.051
  553   1HB   GLU 907          1HB       GLU 907  -2.453   3.843   9.302
  554   2HB   GLU 907          2HB       GLU 907  -4.067   4.591   9.235
  555   1HG   GLU 907          1HG       GLU 907  -4.637   3.415  11.065
  556   2HG   GLU 907          2HG       GLU 907  -4.470   1.925  10.112
  557    H    TRP 908           H        TRP 908  -1.818   3.438   6.477
  558    HA   TRP 908           HA       TRP 908  -2.870   5.773   5.204
  559   1HB   TRP 908          1HB       TRP 908  -0.474   5.311   5.482
  560   2HB   TRP 908          2HB       TRP 908  -0.612   3.906   4.415
  561    HD1  TRP 908           HD       TRP 908  -0.821   7.741   4.324
  562    HE1  TRP 908           1HE      TRP 908  -0.271   8.574   1.981
  563    HE3  TRP 908           3HE      TRP 908  -0.472   3.232   1.926
  564    HZ2  TRP 908           2HZ      TRP 908   0.258   7.431  -0.625
  565    HZ3  TRP 908           3HZ      TRP 908   0.055   3.145  -0.482
  566    HH2  TRP 908           HH       TRP 908   0.422   5.229  -1.770
  567    H    ILE 909           H        ILE 909  -2.232   2.456   3.922
  568    HA   ILE 909           HA       ILE 909  -3.264   2.700   1.394
  569    HB   ILE 909           HB       ILE 909  -3.120   0.507   3.412
  570   1HG1  ILE 909          1HG1      ILE 909  -2.439  -0.140   0.672
  571   2HG1  ILE 909          2HG1      ILE 909  -1.715   1.424   1.117
  572   1HG2  ILE 909          1HG2      ILE 909  -4.654   0.176   0.804
  573   2HG2  ILE 909          2HG2      ILE 909  -4.410  -1.038   2.083
  574   3HG2  ILE 909          3HG2      ILE 909  -5.445   0.378   2.386
  575   1HD1  ILE 909          1HD1      ILE 909  -1.506  -1.123   2.778
  576   2HD1  ILE 909          2HD1      ILE 909  -0.241  -0.522   1.680
  577   3HD1  ILE 909          3HD1      ILE 909  -0.703   0.430   3.111
  578    H    TRP 910           H        TRP 910  -5.159   1.967   4.376
  579    HA   TRP 910           HA       TRP 910  -7.686   1.898   3.101
  580   1HB   TRP 910          1HB       TRP 910  -7.115   2.836   5.921
  581   2HB   TRP 910          2HB       TRP 910  -8.593   2.082   5.308
  582    HD1  TRP 910           HD       TRP 910  -5.994   1.236   7.496
  583    HE1  TRP 910           1HE      TRP 910  -5.444  -1.249   7.580
  584    HE3  TRP 910           3HE      TRP 910  -8.265  -0.240   3.153
  585    HZ2  TRP 910           2HZ      TRP 910  -5.925  -3.601   5.965
  586    HZ3  TRP 910           3HZ      TRP 910  -8.198  -2.608   2.460
  587    HH2  TRP 910           HH       TRP 910  -7.035  -4.297   3.850
  588    H    ALA 911           H        ALA 911  -6.525   4.523   5.281
  589    HA   ALA 911           HA       ALA 911  -8.370   6.450   4.612
  590   1HB   ALA 911          1HB       ALA 911  -5.401   6.929   5.075
  591   2HB   ALA 911          2HB       ALA 911  -6.725   8.086   5.352
  592   3HB   ALA 911          3HB       ALA 911  -6.593   6.627   6.362
  593    H    CYS 912           H        CYS 912  -5.616   5.313   2.715
  594    HA   CYS 912           HA       CYS 912  -5.668   7.499   0.825
  595   1HB   CYS 912          1HB       CYS 912  -4.498   4.692   0.648
  596   2HB   CYS 912          2HB       CYS 912  -4.157   6.031  -0.477
  597    HG   CYS 912           HG       CYS 912  -4.003   6.964   2.547
  598    H    ILE 913           H        ILE 913  -6.141   4.037   0.024
  599    HA   ILE 913           HA       ILE 913  -7.589   4.324  -2.272
  600    HB   ILE 913           HB       ILE 913  -6.919   2.147  -1.497
  601   1HG1  ILE 913          1HG1      ILE 913  -9.961   2.334  -1.410
  602   2HG1  ILE 913          2HG1      ILE 913  -8.981   2.264  -2.894
  603   1HG2  ILE 913          1HG2      ILE 913  -8.016   3.102   0.982
  604   2HG2  ILE 913          2HG2      ILE 913  -8.849   1.590   0.549
  605   3HG2  ILE 913          3HG2      ILE 913  -7.075   1.620   0.687
  606   1HD1  ILE 913          1HD1      ILE 913  -8.296   0.146  -0.969
  607   2HD1  ILE 913          2HD1      ILE 913  -9.990   0.069  -1.509
  608   3HD1  ILE 913          3HD1      ILE 913  -8.672   0.027  -2.705
  609    H    ARG 914           H        ARG 914  -8.802   4.627   1.071
  610    HA   ARG 914           HA       ARG 914 -11.569   4.854   0.305
  611   1HB   ARG 914          1HB       ARG 914 -10.447   4.271   2.609
  612   2HB   ARG 914          2HB       ARG 914 -10.408   6.037   2.824
  613   1HG   ARG 914          1HG       ARG 914 -12.984   5.037   1.791
  614   2HG   ARG 914          2HG       ARG 914 -12.572   4.400   3.401
  615   1HD   ARG 914          1HD       ARG 914 -11.854   7.102   3.531
  616   2HD   ARG 914          2HD       ARG 914 -13.372   7.106   2.609
  617    HE   ARG 914           HE       ARG 914 -13.019   6.444   5.426
  618   1HH1  ARG 914          2HH2      ARG 914 -15.014   6.039   2.535
  619   2HH1  ARG 914          1HH2      ARG 914 -16.478   5.691   3.428
  620   1HH2  ARG 914          2HH1      ARG 914 -14.952   5.984   6.605
  621   2HH2  ARG 914          1HH1      ARG 914 -16.442   5.660   5.748
  622    H    LYS 915           H        LYS 915  -8.827   7.055   0.521
  623    HA   LYS 915           HA       LYS 915 -10.590   9.408   0.289
  624   1HB   LYS 915          1HB       LYS 915  -7.612   8.985   0.665
  625   2HB   LYS 915          2HB       LYS 915  -8.298  10.582   0.282
  626   1HG   LYS 915          1HG       LYS 915  -9.324   8.876   2.579
  627   2HG   LYS 915          2HG       LYS 915  -7.994  10.043   2.777
  628   1HD   LYS 915          1HD       LYS 915  -9.394  11.887   2.165
  629   2HD   LYS 915          2HD       LYS 915 -10.676  10.807   1.566
  630   1HE   LYS 915          1HE       LYS 915 -11.612  10.934   3.611
  631   2HE   LYS 915          2HE       LYS 915 -10.234   9.988   4.216
  632   1HZ   LYS 915          1HZ       LYS 915  -9.679  11.735   5.374
  633   2HZ   LYS 915          2HZ       LYS 915  -9.397  12.587   3.990
  634   3HZ   LYS 915          3HZ       LYS 915 -10.879  12.652   4.712
  635    H    ARG 916           H        ARG 916  -9.413   7.072  -1.753
  636    HA   ARG 916           HA       ARG 916  -9.062   6.956  -4.012
  637   1HB   ARG 916          1HB       ARG 916 -10.857   9.364  -3.711
  638   2HB   ARG 916          2HB       ARG 916 -10.236   8.902  -5.314
  639   1HG   ARG 916          1HG       ARG 916 -12.390   7.814  -4.969
  640   2HG   ARG 916          2HG       ARG 916 -11.111   6.577  -4.917
  641   1HD   ARG 916          1HD       ARG 916 -12.677   6.212  -3.074
  642   2HD   ARG 916          2HD       ARG 916 -11.104   6.729  -2.429
  643    HE   ARG 916           HE       ARG 916 -12.333   9.097  -2.564
  644   1HH1  ARG 916          2HH2      ARG 916 -13.553   5.952  -1.504
  645   2HH1  ARG 916          1HH2      ARG 916 -14.692   6.627  -0.360
  646   1HH2  ARG 916          2HH1      ARG 916 -13.838   9.988  -1.054
  647   2HH2  ARG 916          1HH1      ARG 916 -14.854   8.928  -0.104
  648    H    ARG 917           H        ARG 917  -7.526   9.072  -2.073
  649    HA   ARG 917           HA       ARG 917  -5.638   9.813  -4.208
  650   1HB   ARG 917          1HB       ARG 917  -5.754  12.112  -3.898
  651   2HB   ARG 917          2HB       ARG 917  -7.467  11.661  -3.720
  652   1HG   ARG 917          1HG       ARG 917  -7.081  13.029  -1.840
  653   2HG   ARG 917          2HG       ARG 917  -6.886  11.385  -1.185
  654   1HD   ARG 917          1HD       ARG 917  -4.795  11.908  -0.548
  655   2HD   ARG 917          2HD       ARG 917  -4.360  12.166  -2.251
  656    HE   ARG 917           HE       ARG 917  -5.038  14.221  -0.255
  657   1HH1  ARG 917          2HH2      ARG 917  -4.473  13.370  -3.640
  658   2HH1  ARG 917          1HH2      ARG 917  -4.138  15.013  -4.139
  659   1HH2  ARG 917          2HH1      ARG 917  -4.596  16.391  -0.915
  660   2HH2  ARG 917          1HH1      ARG 917  -4.208  16.735  -2.586
  661    H    LEU 918           H        LEU 918  -3.669   9.246  -3.513
  662    HA   LEU 918           HA       LEU 918  -2.988   8.132  -1.128
  663   1HB   LEU 918          1HB       LEU 918  -1.439   9.863  -3.056
  664   2HB   LEU 918          2HB       LEU 918  -0.661   9.247  -1.578
  665    HG   LEU 918           HG       LEU 918  -0.279   7.337  -2.731
  666   1HD1  LEU 918          1HD1      LEU 918  -3.316   7.196  -2.548
  667   2HD1  LEU 918          2HD1      LEU 918  -2.286   5.825  -3.027
  668   3HD1  LEU 918          3HD1      LEU 918  -2.134   6.526  -1.398
  669   1HD2  LEU 918          1HD2      LEU 918  -1.478   6.884  -4.935
  670   2HD2  LEU 918          2HD2      LEU 918  -2.321   8.434  -4.701
  671   3HD2  LEU 918          3HD2      LEU 918  -0.550   8.402  -4.873
  672    H    VAL 919           H        VAL 919  -2.929   8.728   0.956
  673    HA   VAL 919           HA       VAL 919  -3.164  11.622   1.562
  674    HB   VAL 919           HB       VAL 919  -4.305  11.011   3.479
  675   1HG1  VAL 919          1HG1      VAL 919  -5.999   9.978   2.412
  676   2HG1  VAL 919          2HG1      VAL 919  -4.876   9.456   1.134
  677   3HG1  VAL 919          3HG1      VAL 919  -5.143   8.424   2.560
  678   1HG2  VAL 919          1HG2      VAL 919  -2.409   9.664   4.380
  679   2HG2  VAL 919          2HG2      VAL 919  -3.982   8.881   4.662
  680   3HG2  VAL 919          3HG2      VAL 919  -2.919   8.298   3.359
  681    H    ALA 920           H        ALA 920  -2.235  11.633   4.175
  682    HA   ALA 920           HA       ALA 920   0.583  11.859   3.763
  683   1HB   ALA 920          1HB       ALA 920   0.489  12.976   5.724
  684   2HB   ALA 920          2HB       ALA 920  -1.276  12.776   5.607
  685   3HB   ALA 920          3HB       ALA 920  -0.310  11.620   6.555
  686    HA   PRO 921           HA       PRO 921   1.370   7.487   4.369
  687   1HB   PRO 921          1HB       PRO 921   3.973   7.538   3.568
  688   2HB   PRO 921          2HB       PRO 921   2.622   7.726   2.403
  689   1HG   PRO 921          1HG       PRO 921   4.226   9.931   3.728
  690   2HG   PRO 921          2HG       PRO 921   3.906   9.721   1.975
  691   1HD   PRO 921          1HD       PRO 921   2.370  11.365   3.513
  692   2HD   PRO 921          2HD       PRO 921   1.620  10.341   2.251
  693    H    CYS 922           H        CYS 922   1.861   6.570   6.287
  694    HA   CYS 922           HA       CYS 922   4.177   7.275   7.819
  695   1HB   CYS 922          1HB       CYS 922   2.706   8.035   9.841
  696   2HB   CYS 922          2HB       CYS 922   3.098   9.224   8.574
  697    HG   CYS 922           HG       CYS 922   0.587   7.293   7.981
  Start of MODEL    9
    1    H    GLY 835           H        GLY 835  -9.407  -6.859   9.950
    2   1HA   GLY 835          1HA       GLY 835 -11.134  -6.538  11.635
    3   2HA   GLY 835          2HA       GLY 835 -10.133  -5.259  12.360
    4    H    SER 836           H        SER 836  -9.462  -4.518   9.382
    5    HA   SER 836           HA       SER 836 -11.987  -3.007   8.897
    6   1HB   SER 836          1HB       SER 836 -10.467  -1.218   7.968
    7   2HB   SER 836          2HB       SER 836 -10.317  -1.473   9.723
    8    HG   SER 836           HG       SER 836  -8.271  -1.515   9.028
    9    H    ALA 837           H        ALA 837  -8.993  -4.368   7.441
   10    HA   ALA 837           HA       ALA 837  -9.466  -4.028   4.766
   11   1HB   ALA 837          1HB       ALA 837  -7.579  -5.298   6.010
   12   2HB   ALA 837          2HB       ALA 837  -8.632  -6.725   5.859
   13   3HB   ALA 837          3HB       ALA 837  -8.057  -5.885   4.399
   14    H    ASP 838           H        ASP 838 -10.572  -6.949   6.587
   15    HA   ASP 838           HA       ASP 838 -12.134  -8.109   4.641
   16   1HB   ASP 838          1HB       ASP 838 -11.953  -8.148   7.546
   17   2HB   ASP 838          2HB       ASP 838 -13.633  -8.361   7.007
   18    H    GLU 839           H        GLU 839 -12.945  -5.327   6.733
   19    HA   GLU 839           HA       GLU 839 -15.667  -5.167   5.730
   20   1HB   GLU 839          1HB       GLU 839 -13.991  -3.876   7.755
   21   2HB   GLU 839          2HB       GLU 839 -14.999  -2.707   6.868
   22   1HG   GLU 839          1HG       GLU 839 -16.502  -5.126   7.480
   23   2HG   GLU 839          2HG       GLU 839 -15.815  -4.419   8.959
   24    H    THR 840           H        THR 840 -12.503  -3.960   4.810
   25    HA   THR 840           HA       THR 840 -13.575  -1.842   3.115
   26    HB   THR 840           HB       THR 840 -10.786  -2.948   2.877
   27    HG1  THR 840           1HG      THR 840 -10.412  -1.433   4.723
   28   1HG2  THR 840          1HG2      THR 840 -11.933  -0.126   3.004
   29   2HG2  THR 840          2HG2      THR 840 -10.265  -0.575   2.577
   30   3HG2  THR 840          3HG2      THR 840 -11.610  -1.023   1.501
   31    H    LEU 841           H        LEU 841 -12.028  -5.061   2.653
   32    HA   LEU 841           HA       LEU 841 -12.299  -5.018  -0.202
   33   1HB   LEU 841          1HB       LEU 841 -11.684  -7.084   1.904
   34   2HB   LEU 841          2HB       LEU 841 -12.028  -7.602   0.237
   35    HG   LEU 841           HG       LEU 841  -9.547  -6.900   1.082
   36   1HD1  LEU 841          1HD1      LEU 841  -9.122  -7.381  -1.082
   37   2HD1  LEU 841          2HD1      LEU 841 -10.879  -7.372  -1.366
   38   3HD1  LEU 841          3HD1      LEU 841  -9.929  -5.888  -1.621
   39   1HD2  LEU 841          1HD2      LEU 841  -9.505  -4.666   1.488
   40   2HD2  LEU 841          2HD2      LEU 841  -9.572  -4.484  -0.281
   41   3HD2  LEU 841          3HD2      LEU 841 -11.068  -4.404   0.679
   42    H    CYS 842           H        CYS 842 -14.629  -5.057   2.170
   43    HA   CYS 842           HA       CYS 842 -16.424  -7.085   1.443
   44   1HB   CYS 842          1HB       CYS 842 -18.040  -5.839   2.635
   45   2HB   CYS 842          2HB       CYS 842 -16.496  -5.354   3.378
   46    HG   CYS 842           HG       CYS 842 -17.775  -3.192   3.224
   47    H    GLN 843           H        GLN 843 -15.167  -4.654  -0.513
   48    HA   GLN 843           HA       GLN 843 -17.570  -4.729  -2.278
   49   1HB   GLN 843          1HB       GLN 843 -15.389  -2.645  -2.441
   50   2HB   GLN 843          2HB       GLN 843 -17.080  -2.550  -2.990
   51   1HG   GLN 843          1HG       GLN 843 -17.017  -3.112  -0.155
   52   2HG   GLN 843          2HG       GLN 843 -15.999  -1.696  -0.497
   53   1HE2  GLN 843          1HE2      GLN 843 -18.992  -2.467   0.488
   54   2HE2  GLN 843          2HE2      GLN 843 -19.930  -1.181  -0.243
   55    H    THR 844           H        THR 844 -16.492  -6.922  -2.795
   56    HA   THR 844           HA       THR 844 -15.442  -8.182  -4.393
   57    HB   THR 844           HB       THR 844 -16.032  -5.727  -5.659
   58    HG1  THR 844           1HG      THR 844 -15.771  -7.102  -7.520
   59   1HG2  THR 844          1HG2      THR 844 -13.838  -4.927  -5.805
   60   2HG2  THR 844          2HG2      THR 844 -13.141  -6.562  -5.905
   61   3HG2  THR 844          3HG2      THR 844 -13.978  -5.863  -7.313
   62    H    LYS 845           H        LYS 845 -13.447  -5.175  -4.389
   63    HA   LYS 845           HA       LYS 845 -11.334  -6.502  -2.884
   64   1HB   LYS 845          1HB       LYS 845 -11.366  -6.790  -5.699
   65   2HB   LYS 845          2HB       LYS 845 -10.136  -5.553  -5.346
   66   1HG   LYS 845          1HG       LYS 845  -8.923  -7.560  -5.148
   67   2HG   LYS 845          2HG       LYS 845  -9.372  -7.207  -3.462
   68   1HD   LYS 845          1HD       LYS 845 -11.465  -8.707  -4.859
   69   2HD   LYS 845          2HD       LYS 845  -9.911  -9.574  -4.865
   70   1HE   LYS 845          1HE       LYS 845  -9.849  -8.836  -2.321
   71   2HE   LYS 845          2HE       LYS 845 -11.607  -8.698  -2.534
   72   1HZ   LYS 845          1HZ       LYS 845 -10.097 -10.983  -2.156
   73   2HZ   LYS 845          2HZ       LYS 845 -11.731 -10.852  -2.335
   74   3HZ   LYS 845          3HZ       LYS 845 -10.772 -11.079  -3.657
   75    H    VAL 846           H        VAL 846 -13.142  -3.877  -3.741
   76    HA   VAL 846           HA       VAL 846 -12.836  -1.585  -3.654
   77    HB   VAL 846           HB       VAL 846 -11.429  -1.079  -1.435
   78   1HG1  VAL 846          1HG1      VAL 846 -13.477  -1.096  -0.316
   79   2HG1  VAL 846          2HG1      VAL 846 -14.016  -1.124  -2.012
   80   3HG1  VAL 846          3HG1      VAL 846 -13.988  -2.629  -1.062
   81   1HG2  VAL 846          1HG2      VAL 846 -12.336  -3.712  -0.509
   82   2HG2  VAL 846          2HG2      VAL 846 -11.037  -3.834  -1.720
   83   3HG2  VAL 846          3HG2      VAL 846 -10.783  -2.886  -0.235
   84    H    LEU 847           H        LEU 847 -11.654  -0.261  -4.891
   85    HA   LEU 847           HA       LEU 847  -8.752  -0.151  -4.568
   86   1HB   LEU 847          1HB       LEU 847  -9.856  -0.769  -7.322
   87   2HB   LEU 847          2HB       LEU 847  -8.163  -0.795  -6.772
   88    HG   LEU 847           HG       LEU 847  -9.110  -3.090  -6.984
   89   1HD1  LEU 847          1HD1      LEU 847  -8.497  -2.091  -4.173
   90   2HD1  LEU 847          2HD1      LEU 847  -8.581  -3.813  -4.614
   91   3HD1  LEU 847          3HD1      LEU 847  -7.348  -2.764  -5.355
   92   1HD2  LEU 847          1HD2      LEU 847 -11.337  -1.813  -5.667
   93   2HD2  LEU 847          2HD2      LEU 847 -11.237  -3.459  -6.338
   94   3HD2  LEU 847          3HD2      LEU 847 -10.758  -3.156  -4.651
   95    H    LEU 848           H        LEU 848  -9.470   1.973  -3.827
   96    HA   LEU 848           HA       LEU 848 -10.636   3.737  -5.873
   97   1HB   LEU 848          1HB       LEU 848 -10.197   3.781  -2.928
   98   2HB   LEU 848          2HB       LEU 848 -10.104   5.352  -3.760
   99    HG   LEU 848           HG       LEU 848 -12.372   3.453  -4.376
  100   1HD1  LEU 848          1HD1      LEU 848 -13.247   5.391  -2.478
  101   2HD1  LEU 848          2HD1      LEU 848 -13.199   3.622  -2.287
  102   3HD1  LEU 848          3HD1      LEU 848 -11.805   4.609  -1.788
  103   1HD2  LEU 848          1HD2      LEU 848 -13.229   5.260  -5.453
  104   2HD2  LEU 848          2HD2      LEU 848 -12.806   6.363  -4.121
  105   3HD2  LEU 848          3HD2      LEU 848 -11.583   5.928  -5.339
  106    H    ASP 849           H        ASP 849  -9.473   6.134  -5.491
  107    HA   ASP 849           HA       ASP 849  -6.791   5.687  -6.627
  108   1HB   ASP 849          1HB       ASP 849  -6.943   7.981  -7.345
  109   2HB   ASP 849          2HB       ASP 849  -8.498   7.197  -7.700
  110    H    ILE 850           H        ILE 850  -6.638   4.909  -4.071
  111    HA   ILE 850           HA       ILE 850  -6.008   7.125  -2.294
  112    HB   ILE 850           HB       ILE 850  -4.930   4.691  -1.312
  113   1HG1  ILE 850          1HG1      ILE 850  -6.282   3.723  -3.280
  114   2HG1  ILE 850          2HG1      ILE 850  -6.643   3.068  -1.665
  115   1HG2  ILE 850          1HG2      ILE 850  -6.023   5.664   0.405
  116   2HG2  ILE 850          2HG2      ILE 850  -6.973   6.675  -0.710
  117   3HG2  ILE 850          3HG2      ILE 850  -7.541   5.042  -0.287
  118   1HD1  ILE 850          1HD1      ILE 850  -8.260   4.982  -3.354
  119   2HD1  ILE 850          2HD1      ILE 850  -8.788   3.510  -2.503
  120   3HD1  ILE 850          3HD1      ILE 850  -8.436   4.993  -1.583
  121    H    PHE 851           H        PHE 851  -3.870   4.322  -2.692
  122    HA   PHE 851           HA       PHE 851  -1.504   5.825  -2.462
  123   1HB   PHE 851          1HB       PHE 851  -1.665   3.254  -4.026
  124   2HB   PHE 851          2HB       PHE 851  -0.385   3.823  -2.940
  125    HD1  PHE 851           1HD      PHE 851  -2.639   1.326  -3.207
  126    HD2  PHE 851           2HD      PHE 851  -1.642   4.481  -0.469
  127    HE1  PHE 851           1HE      PHE 851  -3.646   0.030  -1.347
  128    HE2  PHE 851           2HE      PHE 851  -2.649   3.186   1.391
  129    HZ   PHE 851           HZ       PHE 851  -3.651   0.960   0.952
  130    H    THR 852           H        THR 852  -3.607   6.580  -4.655
  131    HA   THR 852           HA       THR 852  -2.869   6.307  -7.217
  132    HB   THR 852           HB       THR 852  -4.352   8.141  -5.853
  133    HG1  THR 852           1HG      THR 852  -4.826   8.903  -7.896
  134   1HG2  THR 852          1HG2      THR 852  -2.387   9.529  -5.323
  135   2HG2  THR 852          2HG2      THR 852  -1.966   9.614  -7.050
  136   3HG2  THR 852          3HG2      THR 852  -3.459  10.383  -6.459
  137    H    GLY 853           H        GLY 853  -0.849   5.934  -7.971
  138   1HA   GLY 853          1HA       GLY 853   1.311   6.390  -8.606
  139   2HA   GLY 853          2HA       GLY 853   1.013   8.090  -8.177
  140    H    VAL 854           H        VAL 854   0.567   5.444  -5.873
  141    HA   VAL 854           HA       VAL 854   2.882   6.513  -4.336
  142    HB   VAL 854           HB       VAL 854   0.243   5.258  -3.558
  143   1HG1  VAL 854          1HG1      VAL 854   2.263   4.129  -2.420
  144   2HG1  VAL 854          2HG1      VAL 854   2.564   5.705  -1.651
  145   3HG1  VAL 854          3HG1      VAL 854   1.036   4.844  -1.347
  146   1HG2  VAL 854          1HG2      VAL 854   1.744   7.831  -3.112
  147   2HG2  VAL 854          2HG2      VAL 854   0.030   7.575  -3.520
  148   3HG2  VAL 854          3HG2      VAL 854   0.604   7.275  -1.862
  149    H    ARG 855           H        ARG 855   4.621   5.293  -4.910
  150    HA   ARG 855           HA       ARG 855   4.281   2.383  -5.240
  151   1HB   ARG 855          1HB       ARG 855   6.345   2.426  -6.326
  152   2HB   ARG 855          2HB       ARG 855   5.695   4.035  -6.722
  153   1HG   ARG 855          1HG       ARG 855   6.902   4.864  -4.601
  154   2HG   ARG 855          2HG       ARG 855   7.762   3.306  -4.620
  155   1HD   ARG 855          1HD       ARG 855   8.961   5.203  -5.806
  156   2HD   ARG 855          2HD       ARG 855   8.690   3.751  -6.794
  157    HE   ARG 855           HE       ARG 855   6.487   5.470  -7.192
  158   1HH1  ARG 855          2HH2      ARG 855   9.976   5.384  -7.756
  159   2HH1  ARG 855          1HH2      ARG 855   9.910   6.407  -9.174
  160   1HH2  ARG 855          2HH1      ARG 855   6.400   6.822  -9.063
  161   2HH2  ARG 855          1HH1      ARG 855   7.871   7.227  -9.919
  162    H    LEU 856           H        LEU 856   3.904   1.623  -3.147
  163    HA   LEU 856           HA       LEU 856   6.066   2.168  -1.173
  164   1HB   LEU 856          1HB       LEU 856   4.488   2.111   0.470
  165   2HB   LEU 856          2HB       LEU 856   3.376   2.490  -0.867
  166    HG   LEU 856           HG       LEU 856   2.872   0.122  -1.180
  167   1HD1  LEU 856          1HD1      LEU 856   5.275  -0.152   0.535
  168   2HD1  LEU 856          2HD1      LEU 856   3.942  -1.255   0.950
  169   3HD1  LEU 856          3HD1      LEU 856   4.620  -1.259  -0.696
  170   1HD2  LEU 856          1HD2      LEU 856   1.932   1.616   0.828
  171   2HD2  LEU 856          2HD2      LEU 856   1.493  -0.101   0.670
  172   3HD2  LEU 856          3HD2      LEU 856   2.767   0.390   1.812
  173    H    TYR 857           H        TYR 857   7.210   0.479  -0.276
  174    HA   TYR 857           HA       TYR 857   7.170  -2.014  -1.772
  175   1HB   TYR 857          1HB       TYR 857   9.325  -1.694  -1.213
  176   2HB   TYR 857          2HB       TYR 857   8.911  -0.601   0.119
  177    HD1  TYR 857           1HD      TYR 857   9.969  -1.299   2.057
  178    HD2  TYR 857           2HD      TYR 857   8.179  -4.234  -0.520
  179    HE1  TYR 857           1HE      TYR 857  10.530  -3.078   3.692
  180    HE2  TYR 857           2HE      TYR 857   8.740  -6.012   1.115
  181    HH   TYR 857           HH       TYR 857  10.605  -6.280   3.064
  182    H    LEU 858           H        LEU 858   5.389  -3.261  -1.382
  183    HA   LEU 858           HA       LEU 858   4.307  -3.532   1.306
  184   1HB   LEU 858          1HB       LEU 858   2.933  -3.572  -0.800
  185   2HB   LEU 858          2HB       LEU 858   3.694  -5.128  -1.210
  186    HG   LEU 858           HG       LEU 858   2.430  -6.265   0.294
  187   1HD1  LEU 858          1HD1      LEU 858   3.674  -5.504   2.210
  188   2HD1  LEU 858          2HD1      LEU 858   2.926  -3.891   2.132
  189   3HD1  LEU 858          3HD1      LEU 858   1.951  -5.302   2.607
  190   1HD2  LEU 858          1HD2      LEU 858   0.682  -4.027   1.065
  191   2HD2  LEU 858          2HD2      LEU 858   0.993  -4.088  -0.687
  192   3HD2  LEU 858          3HD2      LEU 858   0.301  -5.502   0.144
  193    HA   PRO 859           HA       PRO 859   7.289  -6.748   2.233
  194   1HB   PRO 859          1HB       PRO 859   6.725  -6.920   4.893
  195   2HB   PRO 859          2HB       PRO 859   7.592  -5.510   4.199
  196   1HG   PRO 859          1HG       PRO 859   4.623  -5.745   4.769
  197   2HG   PRO 859          2HG       PRO 859   5.733  -4.439   5.299
  198   1HD   PRO 859          1HD       PRO 859   4.205  -4.182   3.056
  199   2HD   PRO 859          2HD       PRO 859   5.891  -3.582   3.079
  200    HA   PRO 860           HA       PRO 860   4.558 -10.206   1.898
  201   1HB   PRO 860          1HB       PRO 860   6.296 -12.227   2.463
  202   2HB   PRO 860          2HB       PRO 860   6.464 -11.221   0.988
  203   1HG   PRO 860          1HG       PRO 860   7.890 -10.850   3.638
  204   2HG   PRO 860          2HG       PRO 860   8.631 -10.946   2.007
  205   1HD   PRO 860          1HD       PRO 860   8.077  -8.548   3.178
  206   2HD   PRO 860          2HD       PRO 860   7.793  -8.790   1.428
  207    H    SER 861           H        SER 861   6.365  -9.389   4.805
  208    HA   SER 861           HA       SER 861   4.997 -11.342   6.479
  209   1HB   SER 861          1HB       SER 861   7.250  -9.553   6.669
  210   2HB   SER 861          2HB       SER 861   6.147  -9.254   8.033
  211    HG   SER 861           HG       SER 861   7.776 -11.010   8.230
  212    H    THR 862           H        THR 862   4.230  -8.311   5.092
  213    HA   THR 862           HA       THR 862   2.673  -7.179   7.204
  214    HB   THR 862           HB       THR 862   3.315  -6.631   4.440
  215    HG1  THR 862           1HG      THR 862   2.015  -5.051   6.407
  216   1HG2  THR 862          1HG2      THR 862   1.059  -7.311   3.873
  217   2HG2  THR 862          2HG2      THR 862   0.389  -6.416   5.258
  218   3HG2  THR 862          3HG2      THR 862   1.102  -5.532   3.887
  219    HA   PRO 863           HA       PRO 863  -0.843  -9.829   7.147
  220   1HB   PRO 863          1HB       PRO 863  -2.632  -8.237   8.445
  221   2HB   PRO 863          2HB       PRO 863  -1.181  -8.895   9.269
  222   1HG   PRO 863          1HG       PRO 863  -1.486  -6.165   7.986
  223   2HG   PRO 863          2HG       PRO 863  -0.917  -6.529   9.648
  224   1HD   PRO 863          1HD       PRO 863   0.837  -6.122   7.602
  225   2HD   PRO 863          2HD       PRO 863   1.146  -7.394   8.822
  226    H    ASP 864           H        ASP 864  -2.508 -10.229   5.737
  227    HA   ASP 864           HA       ASP 864  -4.062  -9.875   4.084
  228   1HB   ASP 864          1HB       ASP 864  -4.031  -7.409   5.558
  229   2HB   ASP 864          2HB       ASP 864  -4.146  -7.033   3.825
  230    H    PHE 865           H        PHE 865  -0.956  -9.601   3.885
  231    HA   PHE 865           HA       PHE 865  -0.150  -7.905   1.870
  232   1HB   PHE 865          1HB       PHE 865   1.199  -9.621   3.167
  233   2HB   PHE 865          2HB       PHE 865   0.603 -10.838   2.025
  234    HD1  PHE 865           1HD      PHE 865   2.062 -11.403   0.331
  235    HD2  PHE 865           2HD      PHE 865   2.104  -7.387   1.854
  236    HE1  PHE 865           1HE      PHE 865   3.897 -10.829  -1.234
  237    HE2  PHE 865           2HE      PHE 865   3.940  -6.813   0.289
  238    HZ   PHE 865           HZ       PHE 865   4.836  -8.534  -1.256
  239    H    SER 866           H        SER 866  -1.766 -11.099   1.493
  240    HA   SER 866           HA       SER 866  -1.782 -11.657  -1.096
  241   1HB   SER 866          1HB       SER 866  -3.290 -12.763   0.459
  242   2HB   SER 866          2HB       SER 866  -4.286 -11.294   0.594
  243    HG   SER 866           HG       SER 866  -4.743 -11.493  -1.626
  244    H    ARG 867           H        ARG 867  -4.673  -9.748  -0.346
  245    HA   ARG 867           HA       ARG 867  -4.739  -8.522  -2.897
  246   1HB   ARG 867          1HB       ARG 867  -6.270  -6.860  -1.442
  247   2HB   ARG 867          2HB       ARG 867  -6.808  -8.495  -1.897
  248   1HG   ARG 867          1HG       ARG 867  -5.183  -8.225   0.607
  249   2HG   ARG 867          2HG       ARG 867  -6.860  -7.631   0.652
  250   1HD   ARG 867          1HD       ARG 867  -7.756  -9.728   0.392
  251   2HD   ARG 867          2HD       ARG 867  -6.418 -10.289  -0.634
  252    HE   ARG 867           HE       ARG 867  -5.394  -9.894   1.970
  253   1HH1  ARG 867          2HH2      ARG 867  -7.715 -11.940   0.259
  254   2HH1  ARG 867          1HH2      ARG 867  -7.507 -13.307   1.330
  255   1HH2  ARG 867          2HH1      ARG 867  -5.120 -11.700   3.385
  256   2HH2  ARG 867          1HH1      ARG 867  -6.027 -13.171   3.112
  257    H    LEU 868           H        LEU 868  -3.442  -7.437   0.257
  258    HA   LEU 868           HA       LEU 868  -2.947  -4.815  -0.009
  259   1HB   LEU 868          1HB       LEU 868  -1.378  -7.097   1.054
  260   2HB   LEU 868          2HB       LEU 868  -0.444  -5.613   0.747
  261    HG   LEU 868           HG       LEU 868  -2.669  -6.110   2.693
  262   1HD1  LEU 868          1HD1      LEU 868   0.062  -4.993   2.585
  263   2HD1  LEU 868          2HD1      LEU 868  -1.068  -4.017   3.553
  264   3HD1  LEU 868          3HD1      LEU 868  -0.813  -5.733   3.947
  265   1HD2  LEU 868          1HD2      LEU 868  -3.054  -3.586   2.737
  266   2HD2  LEU 868          2HD2      LEU 868  -2.229  -3.518   1.161
  267   3HD2  LEU 868          3HD2      LEU 868  -3.741  -4.441   1.335
  268    H    ARG 869           H        ARG 869  -0.960  -7.343  -1.642
  269    HA   ARG 869           HA       ARG 869   0.679  -5.489  -3.058
  270   1HB   ARG 869          1HB       ARG 869   1.149  -7.937  -2.629
  271   2HB   ARG 869          2HB       ARG 869  -0.064  -8.322  -3.873
  272   1HG   ARG 869          1HG       ARG 869   1.560  -8.080  -5.421
  273   2HG   ARG 869          2HG       ARG 869   1.594  -6.345  -5.026
  274   1HD   ARG 869          1HD       ARG 869   3.684  -6.619  -4.241
  275   2HD   ARG 869          2HD       ARG 869   3.018  -7.643  -2.951
  276    HE   ARG 869           HE       ARG 869   4.422  -8.520  -5.365
  277   1HH1  ARG 869          2HH2      ARG 869   2.242  -9.376  -2.716
  278   2HH1  ARG 869          1HH2      ARG 869   2.588 -11.088  -2.803
  279   1HH2  ARG 869          2HH1      ARG 869   4.879 -10.782  -5.479
  280   2HH2  ARG 869          1HH1      ARG 869   4.092 -11.890  -4.378
  281    H    ARG 870           H        ARG 870  -1.318  -7.802  -4.865
  282    HA   ARG 870           HA       ARG 870  -1.712  -6.383  -7.138
  283   1HB   ARG 870          1HB       ARG 870  -2.577  -8.678  -6.659
  284   2HB   ARG 870          2HB       ARG 870  -3.899  -7.949  -5.714
  285   1HG   ARG 870          1HG       ARG 870  -4.982  -8.049  -7.739
  286   2HG   ARG 870          2HG       ARG 870  -4.135  -6.504  -7.995
  287   1HD   ARG 870          1HD       ARG 870  -2.189  -7.960  -8.906
  288   2HD   ARG 870          2HD       ARG 870  -3.392  -9.263  -9.003
  289    HE   ARG 870           HE       ARG 870  -4.255  -8.258 -10.885
  290   1HH1  ARG 870          2HH2      ARG 870  -2.474  -5.876  -8.974
  291   2HH1  ARG 870          1HH2      ARG 870  -2.665  -4.591 -10.146
  292   1HH2  ARG 870          2HH1      ARG 870  -4.507  -6.561 -12.433
  293   2HH2  ARG 870          1HH1      ARG 870  -3.823  -4.981 -12.118
  294    H    TYR 871           H        TYR 871  -3.913  -6.177  -4.280
  295    HA   TYR 871           HA       TYR 871  -5.696  -4.289  -5.152
  296   1HB   TYR 871          1HB       TYR 871  -5.586  -5.419  -2.902
  297   2HB   TYR 871          2HB       TYR 871  -4.345  -4.243  -2.435
  298    HD1  TYR 871           1HD      TYR 871  -7.598  -3.922  -4.295
  299    HD2  TYR 871           2HD      TYR 871  -5.227  -2.736  -0.915
  300    HE1  TYR 871           1HE      TYR 871  -9.369  -2.326  -3.612
  301    HE2  TYR 871           2HE      TYR 871  -6.998  -1.140  -0.233
  302    HH   TYR 871           HH       TYR 871  -9.781  -1.057  -0.748
  303    H    PHE 872           H        PHE 872  -2.703  -3.410  -3.325
  304    HA   PHE 872           HA       PHE 872  -2.797  -0.673  -3.726
  305   1HB   PHE 872          1HB       PHE 872  -1.162  -2.061  -2.356
  306   2HB   PHE 872          2HB       PHE 872  -0.265  -2.333  -3.859
  307    HD1  PHE 872           1HD      PHE 872  -0.622  -0.235  -1.026
  308    HD2  PHE 872           2HD      PHE 872   0.380  -0.157  -5.202
  309    HE1  PHE 872           1HE      PHE 872   0.571   1.915  -0.700
  310    HE2  PHE 872           2HE      PHE 872   1.573   1.993  -4.876
  311    HZ   PHE 872           HZ       PHE 872   1.668   3.029  -2.625
  312    H    VAL 873           H        VAL 873  -0.164  -2.246  -5.473
  313    HA   VAL 873           HA       VAL 873   0.136  -0.578  -7.551
  314    HB   VAL 873           HB       VAL 873   1.583  -2.283  -7.889
  315   1HG1  VAL 873          1HG1      VAL 873   1.023  -3.584  -5.998
  316   2HG1  VAL 873          2HG1      VAL 873  -0.603  -3.955  -6.622
  317   3HG1  VAL 873          3HG1      VAL 873   0.828  -4.721  -7.354
  318   1HG2  VAL 873          1HG2      VAL 873   0.963  -3.796  -9.658
  319   2HG2  VAL 873          2HG2      VAL 873  -0.762  -3.683  -9.232
  320   3HG2  VAL 873          3HG2      VAL 873   0.073  -2.281  -9.943
  321    H    ALA 874           H        ALA 874  -2.569  -2.839  -7.142
  322    HA   ALA 874           HA       ALA 874  -3.649  -2.693  -9.746
  323   1HB   ALA 874          1HB       ALA 874  -4.673  -4.315  -8.471
  324   2HB   ALA 874          2HB       ALA 874  -4.665  -3.316  -6.997
  325   3HB   ALA 874          3HB       ALA 874  -5.864  -3.006  -8.276
  326    H    PHE 875           H        PHE 875  -4.426  -0.737  -6.812
  327    HA   PHE 875           HA       PHE 875  -6.348   0.944  -7.747
  328   1HB   PHE 875          1HB       PHE 875  -3.865   1.837  -6.246
  329   2HB   PHE 875          2HB       PHE 875  -5.437   2.654  -6.266
  330    HD1  PHE 875           1HD      PHE 875  -6.178  -0.740  -6.306
  331    HD2  PHE 875           2HD      PHE 875  -4.678   2.303  -3.671
  332    HE1  PHE 875           1HE      PHE 875  -6.902  -2.079  -4.347
  333    HE2  PHE 875           2HE      PHE 875  -5.402   0.964  -1.713
  334    HZ   PHE 875           HZ       PHE 875  -6.514  -1.227  -2.051
  335    H    ASP 876           H        ASP 876  -2.819   1.297  -8.368
  336    HA   ASP 876           HA       ASP 876  -2.683   1.962 -10.928
  337   1HB   ASP 876          1HB       ASP 876  -4.278   4.043  -9.548
  338   2HB   ASP 876          2HB       ASP 876  -2.984   4.662 -10.597
  339    H    GLY 877           H        GLY 877  -1.491   1.873  -7.941
  340   1HA   GLY 877          1HA       GLY 877   0.670   3.852  -8.302
  341   2HA   GLY 877          2HA       GLY 877   0.364   2.852  -6.864
  342    H    ASP 878           H        ASP 878   2.382   1.912  -6.640
  343    HA   ASP 878           HA       ASP 878   3.004  -0.202  -8.568
  344   1HB   ASP 878          1HB       ASP 878   4.604   2.309  -8.266
  345   2HB   ASP 878          2HB       ASP 878   5.493   0.777  -8.412
  346    H    LEU 879           H        LEU 879   4.755  -1.627  -7.733
  347    HA   LEU 879           HA       LEU 879   5.207  -1.334  -4.816
  348   1HB   LEU 879          1HB       LEU 879   3.519  -3.318  -6.165
  349   2HB   LEU 879          2HB       LEU 879   4.805  -4.064  -5.186
  350    HG   LEU 879           HG       LEU 879   4.098  -2.915  -3.209
  351   1HD1  LEU 879          1HD1      LEU 879   3.695  -0.702  -4.023
  352   2HD1  LEU 879          2HD1      LEU 879   2.428  -1.265  -5.138
  353   3HD1  LEU 879          3HD1      LEU 879   2.134  -1.269  -3.383
  354   1HD2  LEU 879          1HD2      LEU 879   2.084  -4.304  -4.875
  355   2HD2  LEU 879          2HD2      LEU 879   2.547  -4.580  -3.178
  356   3HD2  LEU 879          3HD2      LEU 879   1.390  -3.290  -3.587
  357    H    VAL 880           H        VAL 880   7.221  -1.958  -4.173
  358    HA   VAL 880           HA       VAL 880   8.941  -3.197  -6.272
  359    HB   VAL 880           HB       VAL 880  10.365  -1.785  -4.153
  360   1HG1  VAL 880          1HG1      VAL 880  10.177  -1.168  -7.124
  361   2HG1  VAL 880          2HG1      VAL 880  11.543  -0.863  -6.024
  362   3HG1  VAL 880          3HG1      VAL 880  11.127  -2.531  -6.485
  363   1HG2  VAL 880          1HG2      VAL 880   8.027  -0.466  -5.473
  364   2HG2  VAL 880          2HG2      VAL 880   8.784  -0.133  -3.896
  365   3HG2  VAL 880          3HG2      VAL 880   9.537   0.472  -5.391
  366    H    GLN 881           H        GLN 881  11.027  -4.134  -5.055
  367    HA   GLN 881           HA       GLN 881   9.929  -5.952  -2.972
  368   1HB   GLN 881          1HB       GLN 881  12.447  -6.344  -4.617
  369   2HB   GLN 881          2HB       GLN 881  11.514  -7.563  -3.716
  370   1HG   GLN 881          1HG       GLN 881   9.624  -7.298  -5.247
  371   2HG   GLN 881          2HG       GLN 881  10.468  -5.990  -6.105
  372   1HE2  GLN 881          1HE2      GLN 881  11.286  -9.322  -4.955
  373   2HE2  GLN 881          2HE2      GLN 881  11.975  -9.857  -6.473
  374    H    GLU 882           H        GLU 882  10.792  -5.978  -0.954
  375    HA   GLU 882           HA       GLU 882  12.017  -4.018   0.326
  376   1HB   GLU 882          1HB       GLU 882  11.486  -6.272   1.279
  377   2HB   GLU 882          2HB       GLU 882  13.002  -6.885   0.578
  378   1HG   GLU 882          1HG       GLU 882  14.035  -4.777   1.832
  379   2HG   GLU 882          2HG       GLU 882  12.582  -4.947   2.840
  380    H    PHE 883           H        PHE 883  14.140  -6.595  -1.050
  381    HA   PHE 883           HA       PHE 883  16.457  -4.898  -0.942
  382   1HB   PHE 883          1HB       PHE 883  17.562  -6.731  -2.081
  383   2HB   PHE 883          2HB       PHE 883  16.517  -7.367  -0.801
  384    HD1  PHE 883           1HD      PHE 883  17.053  -7.107  -4.431
  385    HD2  PHE 883           2HD      PHE 883  14.487  -8.620  -1.336
  386    HE1  PHE 883           1HE      PHE 883  15.928  -8.577  -6.082
  387    HE2  PHE 883           2HE      PHE 883  13.362 -10.090  -2.987
  388    HZ   PHE 883           HZ       PHE 883  14.083 -10.068  -5.360
  389    H    ASP 884           H        ASP 884  13.809  -4.441  -2.732
  390    HA   ASP 884           HA       ASP 884  15.382  -3.309  -4.982
  391   1HB   ASP 884          1HB       ASP 884  12.826  -4.943  -5.204
  392   2HB   ASP 884          2HB       ASP 884  13.580  -4.038  -6.535
  393    H    MET 885           H        MET 885  15.163  -1.283  -3.873
  394    HA   MET 885           HA       MET 885  12.481  -0.095  -4.286
  395   1HB   MET 885          1HB       MET 885  13.175   1.160  -2.003
  396   2HB   MET 885          2HB       MET 885  12.205  -0.332  -2.022
  397   1HG   MET 885          1HG       MET 885  14.461  -1.579  -1.963
  398   2HG   MET 885          2HG       MET 885  15.175  -0.019  -1.522
  399   1HE   MET 885          1HE       MET 885  12.540  -2.548  -0.935
  400   2HE   MET 885          2HE       MET 885  12.436  -2.777   0.827
  401   3HE   MET 885          3HE       MET 885  11.519  -1.468   0.044
  402    H    THR 886           H        THR 886  15.985   0.247  -3.747
  403    HA   THR 886           HA       THR 886  16.839   2.649  -3.779
  404    HB   THR 886           HB       THR 886  18.370   2.263  -5.554
  405    HG1  THR 886           1HG      THR 886  17.500   1.740  -7.377
  406   1HG2  THR 886          1HG2      THR 886  19.091   0.031  -5.141
  407   2HG2  THR 886          2HG2      THR 886  18.217   0.508  -3.666
  408   3HG2  THR 886          3HG2      THR 886  17.428  -0.541  -4.868
  409    H    SER 887           H        SER 887  14.863   1.589  -6.601
  410    HA   SER 887           HA       SER 887  14.484   4.432  -7.329
  411   1HB   SER 887          1HB       SER 887  14.416   1.819  -8.719
  412   2HB   SER 887          2HB       SER 887  13.132   2.954  -9.203
  413    HG   SER 887           HG       SER 887  15.928   3.241  -9.345
  414    H    ALA 888           H        ALA 888  12.971   1.858  -5.620
  415    HA   ALA 888           HA       ALA 888  10.275   2.094  -6.106
  416   1HB   ALA 888          1HB       ALA 888  11.855   1.731  -3.552
  417   2HB   ALA 888          2HB       ALA 888  10.075   1.750  -3.539
  418   3HB   ALA 888          3HB       ALA 888  10.946   0.520  -4.487
  419    H    THR 889           H        THR 889   8.705   3.173  -4.335
  420    HA   THR 889           HA       THR 889   9.528   6.027  -4.089
  421    HB   THR 889           HB       THR 889   7.719   5.157  -5.917
  422    HG1  THR 889           1HG      THR 889   7.040   7.279  -5.899
  423   1HG2  THR 889          1HG2      THR 889   5.878   6.130  -3.765
  424   2HG2  THR 889          2HG2      THR 889   5.560   5.021  -5.120
  425   3HG2  THR 889          3HG2      THR 889   6.412   4.435  -3.671
  426    H    HIS 890           H        HIS 890   7.438   3.354  -2.933
  427    HA   HIS 890           HA       HIS 890   7.458   4.675  -0.262
  428   1HB   HIS 890          1HB       HIS 890   5.180   3.393  -1.784
  429   2HB   HIS 890          2HB       HIS 890   5.157   3.533  -0.016
  430    HD1  HIS 890           1HD      HIS 890   6.292   6.238  -2.562
  431    HD2  HIS 890           2HD      HIS 890   3.433   5.440   0.421
  432    HE1  HIS 890           1HE      HIS 890   4.963   8.396  -2.221
  433    H    VAL 891           H        VAL 891   7.011   3.080   1.526
  434    HA   VAL 891           HA       VAL 891   7.659   0.287   0.880
  435    HB   VAL 891           HB       VAL 891   9.509   0.377   2.661
  436   1HG1  VAL 891          1HG1      VAL 891  10.579   2.023   0.484
  437   2HG1  VAL 891          2HG1      VAL 891  10.921   0.326   0.895
  438   3HG1  VAL 891          3HG1      VAL 891   9.514   0.730  -0.116
  439   1HG2  VAL 891          1HG2      VAL 891   9.157   2.511   3.662
  440   2HG2  VAL 891          2HG2      VAL 891  10.624   2.704   2.671
  441   3HG2  VAL 891          3HG2      VAL 891   9.063   3.324   2.081
  442    H    LEU 892           H        LEU 892   6.365  -0.961   2.088
  443    HA   LEU 892           HA       LEU 892   4.810   0.205   4.236
  444   1HB   LEU 892          1HB       LEU 892   4.567  -1.958   2.472
  445   2HB   LEU 892          2HB       LEU 892   4.775  -2.711   4.072
  446    HG   LEU 892           HG       LEU 892   3.008  -0.410   4.259
  447   1HD1  LEU 892          1HD1      LEU 892   2.065  -0.620   2.176
  448   2HD1  LEU 892          2HD1      LEU 892   2.620  -2.300   1.981
  449   3HD1  LEU 892          3HD1      LEU 892   1.180  -1.947   2.967
  450   1HD2  LEU 892          1HD2      LEU 892   1.490  -2.587   4.845
  451   2HD2  LEU 892          2HD2      LEU 892   3.113  -3.306   4.973
  452   3HD2  LEU 892          3HD2      LEU 892   2.682  -1.898   5.974
  453    H    GLY 893           H        GLY 893   5.088   0.021   6.417
  454   1HA   GLY 893          1HA       GLY 893   6.456  -0.116   8.298
  455   2HA   GLY 893          2HA       GLY 893   6.273  -1.851   7.954
  456    H    SER 894           H        SER 894   8.440   0.838   8.082
  457    HA   SER 894           HA       SER 894  10.780   0.590   8.234
  458   1HB   SER 894          1HB       SER 894  10.412  -1.873   6.485
  459   2HB   SER 894          2HB       SER 894  11.917  -1.345   7.276
  460    HG   SER 894           HG       SER 894   9.807  -2.719   8.294
  461    H    ARG 895           H        ARG 895  12.521   1.143   6.711
  462    HA   ARG 895           HA       ARG 895  11.619   1.712   3.954
  463   1HB   ARG 895          1HB       ARG 895  12.501   4.047   4.165
  464   2HB   ARG 895          2HB       ARG 895  11.060   3.745   5.166
  465   1HG   ARG 895          1HG       ARG 895  12.282   4.542   6.900
  466   2HG   ARG 895          2HG       ARG 895  13.169   3.001   6.831
  467   1HD   ARG 895          1HD       ARG 895  14.668   4.087   5.075
  468   2HD   ARG 895          2HD       ARG 895  13.891   5.630   5.487
  469    HE   ARG 895           HE       ARG 895  15.933   4.271   6.990
  470   1HH1  ARG 895          2HH2      ARG 895  13.011   6.238   7.299
  471   2HH1  ARG 895          1HH2      ARG 895  13.471   6.923   8.842
  472   1HH2  ARG 895          2HH1      ARG 895  16.540   5.176   9.028
  473   2HH2  ARG 895          1HH1      ARG 895  15.483   6.317   9.827
  474    H    ASP 896           H        ASP 896  14.139   1.366   6.414
  475    HA   ASP 896           HA       ASP 896  16.516   1.858   5.528
  476   1HB   ASP 896          1HB       ASP 896  16.450   0.221   7.199
  477   2HB   ASP 896          2HB       ASP 896  15.426  -0.865   6.235
  478    H    LYS 897           H        LYS 897  15.294  -1.206   4.106
  479    HA   LYS 897           HA       LYS 897  16.870  -1.553   1.993
  480   1HB   LYS 897          1HB       LYS 897  14.285  -1.736   0.834
  481   2HB   LYS 897          2HB       LYS 897  15.241  -3.040   1.580
  482   1HG   LYS 897          1HG       LYS 897  13.239  -3.052   2.832
  483   2HG   LYS 897          2HG       LYS 897  14.346  -2.091   3.842
  484   1HD   LYS 897          1HD       LYS 897  13.412  -0.033   2.578
  485   2HD   LYS 897          2HD       LYS 897  12.110  -1.119   2.035
  486   1HE   LYS 897          1HE       LYS 897  12.146  -1.711   4.689
  487   2HE   LYS 897          2HE       LYS 897  12.677  -0.016   4.746
  488   1HZ   LYS 897          1HZ       LYS 897  10.730   0.685   3.863
  489   2HZ   LYS 897          2HZ       LYS 897  10.374  -0.750   3.134
  490   3HZ   LYS 897          3HZ       LYS 897  10.201  -0.589   4.766
  491    H    ASN 898           H        ASN 898  14.503   1.085   2.276
  492    HA   ASN 898           HA       ASN 898  15.927   2.574   0.216
  493   1HB   ASN 898          1HB       ASN 898  13.838   0.936  -0.626
  494   2HB   ASN 898          2HB       ASN 898  13.070   2.526  -0.433
  495   1HD2  ASN 898          1HD2      ASN 898  12.824   3.065  -2.593
  496   2HD2  ASN 898          2HD2      ASN 898  14.171   3.314  -3.683
  497    HA   PRO 899           HA       PRO 899  14.307   5.239   3.511
  498   1HB   PRO 899          1HB       PRO 899  16.338   7.053   3.426
  499   2HB   PRO 899          2HB       PRO 899  16.547   5.434   4.170
  500   1HG   PRO 899          1HG       PRO 899  17.274   6.267   1.347
  501   2HG   PRO 899          2HG       PRO 899  18.329   5.451   2.547
  502   1HD   PRO 899          1HD       PRO 899  16.977   4.038   0.648
  503   2HD   PRO 899          2HD       PRO 899  17.120   3.408   2.317
  504    H    ALA 900           H        ALA 900  14.943   5.575   0.134
  505    HA   ALA 900           HA       ALA 900  13.969   8.333  -0.036
  506   1HB   ALA 900          1HB       ALA 900  14.131   7.786  -2.540
  507   2HB   ALA 900          2HB       ALA 900  15.652   7.759  -1.615
  508   3HB   ALA 900          3HB       ALA 900  14.843   6.232  -2.042
  509    H    ALA 901           H        ALA 901  12.570   5.325   0.449
  510    HA   ALA 901           HA       ALA 901  10.165   5.954  -1.164
  511   1HB   ALA 901          1HB       ALA 901  10.810   3.709  -1.478
  512   2HB   ALA 901          2HB       ALA 901  11.215   3.489   0.241
  513   3HB   ALA 901          3HB       ALA 901   9.513   3.609  -0.263
  514    H    GLN 902           H        GLN 902   8.103   6.146  -0.208
  515    HA   GLN 902           HA       GLN 902   8.086   7.446   2.344
  516   1HB   GLN 902          1HB       GLN 902   6.326   7.057   0.130
  517   2HB   GLN 902          2HB       GLN 902   5.473   6.510   1.594
  518   1HG   GLN 902          1HG       GLN 902   6.454   9.234   0.850
  519   2HG   GLN 902          2HG       GLN 902   4.996   8.754   1.745
  520   1HE2  GLN 902          1HE2      GLN 902   5.953   7.236   3.815
  521   2HE2  GLN 902          2HE2      GLN 902   7.000   8.192   4.843
  522    H    GLN 903           H        GLN 903   7.993   6.597   4.338
  523    HA   GLN 903           HA       GLN 903   7.682   3.695   4.615
  524   1HB   GLN 903          1HB       GLN 903   9.221   5.592   5.885
  525   2HB   GLN 903          2HB       GLN 903   7.892   5.362   7.046
  526   1HG   GLN 903          1HG       GLN 903   8.251   2.904   6.939
  527   2HG   GLN 903          2HG       GLN 903   9.609   3.163   5.822
  528   1HE2  GLN 903          1HE2      GLN 903  11.452   2.731   6.912
  529   2HE2  GLN 903          2HE2      GLN 903  11.856   3.353   8.498
  530    H    VAL 904           H        VAL 904   5.477   3.368   4.088
  531    HA   VAL 904           HA       VAL 904   3.521   4.671   5.905
  532    HB   VAL 904           HB       VAL 904   2.135   4.701   4.133
  533   1HG1  VAL 904          1HG1      VAL 904   4.236   5.273   2.972
  534   2HG1  VAL 904          2HG1      VAL 904   4.550   3.547   2.671
  535   3HG1  VAL 904          3HG1      VAL 904   3.161   4.347   1.897
  536   1HG2  VAL 904          1HG2      VAL 904   2.942   1.786   3.888
  537   2HG2  VAL 904          2HG2      VAL 904   1.384   2.465   4.418
  538   3HG2  VAL 904          3HG2      VAL 904   1.859   2.557   2.705
  539    H    SER 905           H        SER 905   1.543   3.043   6.266
  540    HA   SER 905           HA       SER 905   2.677   0.406   7.057
  541   1HB   SER 905          1HB       SER 905   2.008   2.483   8.815
  542   2HB   SER 905          2HB       SER 905   0.600   1.393   8.859
  543    HG   SER 905           HG       SER 905   3.263   0.923   9.568
  544    HA   PRO 906           HA       PRO 906  -1.107  -1.427   5.725
  545   1HB   PRO 906          1HB       PRO 906  -2.285  -2.695   7.829
  546   2HB   PRO 906          2HB       PRO 906  -0.670  -3.179   7.218
  547   1HG   PRO 906          1HG       PRO 906  -1.276  -1.318   9.533
  548   2HG   PRO 906          2HG       PRO 906  -0.195  -2.750   9.542
  549   1HD   PRO 906          1HD       PRO 906   0.781  -0.234   9.158
  550   2HD   PRO 906          2HD       PRO 906   1.431  -1.613   8.219
  551    H    GLU 907           H        GLU 907  -1.504   0.595   8.638
  552    HA   GLU 907           HA       GLU 907  -4.340   0.965   8.319
  553   1HB   GLU 907          1HB       GLU 907  -2.631   1.377  10.348
  554   2HB   GLU 907          2HB       GLU 907  -2.646   3.025   9.674
  555   1HG   GLU 907          1HG       GLU 907  -5.261   2.663   9.625
  556   2HG   GLU 907          2HG       GLU 907  -4.914   1.414  10.840
  557    H    TRP 908           H        TRP 908  -1.463   2.405   6.913
  558    HA   TRP 908           HA       TRP 908  -2.624   4.880   6.091
  559   1HB   TRP 908          1HB       TRP 908  -0.213   4.462   6.175
  560   2HB   TRP 908          2HB       TRP 908  -0.366   3.230   4.915
  561    HD1  TRP 908           HD       TRP 908  -0.705   7.028   5.407
  562    HE1  TRP 908           1HE      TRP 908  -0.274   8.218   3.197
  563    HE3  TRP 908           3HE      TRP 908  -0.282   2.939   2.357
  564    HZ2  TRP 908           2HZ      TRP 908   0.196   7.495   0.435
  565    HZ3  TRP 908           3HZ      TRP 908   0.156   3.229  -0.054
  566    HH2  TRP 908           HH       TRP 908   0.397   5.494  -1.028
  567    H    ILE 909           H        ILE 909  -2.040   1.809   4.284
  568    HA   ILE 909           HA       ILE 909  -3.174   2.453   1.862
  569    HB   ILE 909           HB       ILE 909  -2.940  -0.041   3.492
  570   1HG1  ILE 909          1HG1      ILE 909  -2.297  -0.257   0.691
  571   2HG1  ILE 909          2HG1      ILE 909  -1.626   1.269   1.316
  572   1HG2  ILE 909          1HG2      ILE 909  -5.296   0.037   2.449
  573   2HG2  ILE 909          2HG2      ILE 909  -4.474  -0.019   0.871
  574   3HG2  ILE 909          3HG2      ILE 909  -4.279  -1.361   2.024
  575   1HD1  ILE 909          1HD1      ILE 909  -1.279  -1.423   2.697
  576   2HD1  ILE 909          2HD1      ILE 909  -0.090  -0.731   1.568
  577   3HD1  ILE 909          3HD1      ILE 909  -0.462   0.108   3.093
  578    H    TRP 910           H        TRP 910  -4.965   1.005   4.650
  579    HA   TRP 910           HA       TRP 910  -7.525   1.195   3.514
  580   1HB   TRP 910          1HB       TRP 910  -6.931   1.622   6.444
  581   2HB   TRP 910          2HB       TRP 910  -8.345   0.856   5.707
  582    HD1  TRP 910           HD       TRP 910  -5.612  -0.107   7.694
  583    HE1  TRP 910           1HE      TRP 910  -4.853  -2.513   7.346
  584    HE3  TRP 910           3HE      TRP 910  -7.891  -1.033   3.205
  585    HZ2  TRP 910           2HZ      TRP 910  -5.187  -4.596   5.364
  586    HZ3  TRP 910           3HZ      TRP 910  -7.648  -3.235   2.120
  587    HH2  TRP 910           HH       TRP 910  -6.302  -5.023   3.183
  588    H    ALA 911           H        ALA 911  -6.040   3.453   5.913
  589    HA   ALA 911           HA       ALA 911  -8.010   5.418   5.833
  590   1HB   ALA 911          1HB       ALA 911  -6.386   6.866   6.799
  591   2HB   ALA 911          2HB       ALA 911  -5.939   5.227   7.334
  592   3HB   ALA 911          3HB       ALA 911  -5.040   6.008   6.011
  593    H    CYS 912           H        CYS 912  -5.401   4.722   3.537
  594    HA   CYS 912           HA       CYS 912  -5.694   7.181   2.054
  595   1HB   CYS 912          1HB       CYS 912  -4.492   4.502   1.241
  596   2HB   CYS 912          2HB       CYS 912  -4.238   6.065   0.425
  597    HG   CYS 912           HG       CYS 912  -2.600   4.734   2.608
  598    H    ILE 913           H        ILE 913  -6.139   3.889   0.708
  599    HA   ILE 913           HA       ILE 913  -7.782   4.470  -1.377
  600    HB   ILE 913           HB       ILE 913  -7.041   2.219  -1.011
  601   1HG1  ILE 913          1HG1      ILE 913 -10.055   2.262  -0.563
  602   2HG1  ILE 913          2HG1      ILE 913  -9.270   2.540  -2.136
  603   1HG2  ILE 913          1HG2      ILE 913  -8.724   1.286   1.097
  604   2HG2  ILE 913          2HG2      ILE 913  -6.948   1.405   1.087
  605   3HG2  ILE 913          3HG2      ILE 913  -7.928   2.768   1.680
  606   1HD1  ILE 913          1HD1      ILE 913  -8.841   0.331  -2.433
  607   2HD1  ILE 913          2HD1      ILE 913  -8.288   0.128  -0.753
  608   3HD1  ILE 913          3HD1      ILE 913 -10.027   0.065  -1.132
  609    H    ARG 914           H        ARG 914  -8.807   4.054   2.039
  610    HA   ARG 914           HA       ARG 914 -11.596   4.391   1.532
  611   1HB   ARG 914          1HB       ARG 914 -10.435   3.435   3.609
  612   2HB   ARG 914          2HB       ARG 914 -10.131   5.123   4.086
  613   1HG   ARG 914          1HG       ARG 914 -12.299   3.968   4.960
  614   2HG   ARG 914          2HG       ARG 914 -12.436   5.609   4.283
  615   1HD   ARG 914          1HD       ARG 914 -12.686   3.317   2.376
  616   2HD   ARG 914          2HD       ARG 914 -14.032   3.576   3.506
  617    HE   ARG 914           HE       ARG 914 -13.250   5.275   1.262
  618   1HH1  ARG 914          2HH2      ARG 914 -14.945   5.058   4.357
  619   2HH1  ARG 914          1HH2      ARG 914 -16.000   6.415   4.030
  620   1HH2  ARG 914          2HH1      ARG 914 -14.644   7.067   0.830
  621   2HH2  ARG 914          1HH1      ARG 914 -15.828   7.561   2.020
  622    H    LYS 915           H        LYS 915  -8.890   6.620   1.891
  623    HA   LYS 915           HA       LYS 915 -10.719   8.923   2.135
  624   1HB   LYS 915          1HB       LYS 915  -7.708   8.566   2.243
  625   2HB   LYS 915          2HB       LYS 915  -8.481  10.169   2.201
  626   1HG   LYS 915          1HG       LYS 915  -9.292   8.047   4.216
  627   2HG   LYS 915          2HG       LYS 915  -7.958   9.182   4.530
  628   1HD   LYS 915          1HD       LYS 915  -9.406  11.078   4.388
  629   2HD   LYS 915          2HD       LYS 915 -10.718  10.115   3.667
  630   1HE   LYS 915          1HE       LYS 915 -11.426  10.244   5.880
  631   2HE   LYS 915          2HE       LYS 915 -10.515   8.718   5.899
  632   1HZ   LYS 915          1HZ       LYS 915  -9.502   9.691   7.589
  633   2HZ   LYS 915          2HZ       LYS 915  -8.626  10.478   6.434
  634   3HZ   LYS 915          3HZ       LYS 915  -9.916  11.224   7.142
  635    H    ARG 916           H        ARG 916  -9.207   7.020  -0.271
  636    HA   ARG 916           HA       ARG 916  -9.154   7.239  -2.552
  637   1HB   ARG 916          1HB       ARG 916 -11.313   8.858  -1.732
  638   2HB   ARG 916          2HB       ARG 916 -10.372   9.859  -2.863
  639   1HG   ARG 916          1HG       ARG 916 -10.825   6.995  -3.615
  640   2HG   ARG 916          2HG       ARG 916 -12.222   8.094  -3.710
  641   1HD   ARG 916          1HD       ARG 916  -9.657   9.126  -4.824
  642   2HD   ARG 916          2HD       ARG 916 -10.414   7.791  -5.719
  643    HE   ARG 916           HE       ARG 916 -12.159  10.054  -4.991
  644   1HH1  ARG 916          2HH2      ARG 916 -10.155   8.426  -7.407
  645   2HH1  ARG 916          1HH2      ARG 916 -10.892   9.242  -8.768
  646   1HH2  ARG 916          2HH1      ARG 916 -13.133  11.131  -6.789
  647   2HH2  ARG 916          1HH1      ARG 916 -12.590  10.784  -8.415
  648    H    ARG 917           H        ARG 917  -7.817   9.423  -0.341
  649    HA   ARG 917           HA       ARG 917  -5.933  10.390  -2.427
  650   1HB   ARG 917          1HB       ARG 917  -6.003  12.441  -0.574
  651   2HB   ARG 917          2HB       ARG 917  -6.836  12.445  -2.147
  652   1HG   ARG 917          1HG       ARG 917  -8.187  11.090   0.172
  653   2HG   ARG 917          2HG       ARG 917  -8.170  12.869   0.131
  654   1HD   ARG 917          1HD       ARG 917  -9.024  12.716  -2.258
  655   2HD   ARG 917          2HD       ARG 917  -9.253  10.975  -1.987
  656    HE   ARG 917           HE       ARG 917 -11.132  11.436  -0.717
  657   1HH1  ARG 917          2HH2      ARG 917  -9.193  14.360  -1.151
  658   2HH1  ARG 917          1HH2      ARG 917 -10.389  15.423  -0.444
  659   1HH2  ARG 917          2HH1      ARG 917 -12.712  12.840   0.217
  660   2HH2  ARG 917          1HH1      ARG 917 -12.395  14.557   0.336
  661    H    LEU 918           H        LEU 918  -3.982   9.589  -1.942
  662    HA   LEU 918           HA       LEU 918  -3.142   8.180   0.191
  663   1HB   LEU 918          1HB       LEU 918  -1.747  10.176  -1.569
  664   2HB   LEU 918          2HB       LEU 918  -0.859   9.484  -0.189
  665    HG   LEU 918           HG       LEU 918  -0.493   7.619  -1.400
  666   1HD1  LEU 918          1HD1      LEU 918  -3.534   7.544  -1.431
  667   2HD1  LEU 918          2HD1      LEU 918  -2.526   6.223  -2.067
  668   3HD1  LEU 918          3HD1      LEU 918  -2.431   6.665  -0.345
  669   1HD2  LEU 918          1HD2      LEU 918  -0.509   8.794  -3.454
  670   2HD2  LEU 918          2HD2      LEU 918  -1.636   7.444  -3.731
  671   3HD2  LEU 918          3HD2      LEU 918  -2.266   9.072  -3.383
  672    H    VAL 919           H        VAL 919  -3.069   8.429   2.339
  673    HA   VAL 919           HA       VAL 919  -3.280  11.173   3.429
  674    HB   VAL 919           HB       VAL 919  -4.288  10.217   5.279
  675   1HG1  VAL 919          1HG1      VAL 919  -5.053   7.778   3.901
  676   2HG1  VAL 919          2HG1      VAL 919  -6.024   9.234   4.226
  677   3HG1  VAL 919          3HG1      VAL 919  -5.021   9.142   2.759
  678   1HG2  VAL 919          1HG2      VAL 919  -2.918   7.570   4.648
  679   2HG2  VAL 919          2HG2      VAL 919  -2.264   8.788   5.769
  680   3HG2  VAL 919          3HG2      VAL 919  -3.815   7.991   6.127
  681    H    ALA 920           H        ALA 920  -2.192  10.812   5.943
  682    HA   ALA 920           HA       ALA 920   0.598  11.158   5.401
  683   1HB   ALA 920          1HB       ALA 920  -1.101  10.933   7.894
  684   2HB   ALA 920          2HB       ALA 920   0.673  11.037   7.996
  685   3HB   ALA 920          3HB       ALA 920  -0.254  12.356   7.242
  686    HA   PRO 921           HA       PRO 921   1.465   6.761   5.372
  687   1HB   PRO 921          1HB       PRO 921   4.021   6.966   4.450
  688   2HB   PRO 921          2HB       PRO 921   2.606   7.284   3.394
  689   1HG   PRO 921          1HG       PRO 921   4.256   9.320   4.919
  690   2HG   PRO 921          2HG       PRO 921   3.844   9.341   3.173
  691   1HD   PRO 921          1HD       PRO 921   2.375  10.736   4.997
  692   2HD   PRO 921          2HD       PRO 921   1.569   9.878   3.649
  693    H    CYS 922           H        CYS 922   2.092   5.590   7.106
  694    HA   CYS 922           HA       CYS 922   4.380   6.473   8.723
  695   1HB   CYS 922          1HB       CYS 922   2.228   7.582   9.608
  696   2HB   CYS 922          2HB       CYS 922   1.716   5.940  10.073
  697    HG   CYS 922           HG       CYS 922   4.719   6.181  10.780
  Start of MODEL   10
    1    H    GLY 835           H        GLY 835  -8.041  -4.111  11.900
    2   1HA   GLY 835          1HA       GLY 835  -8.594  -1.910  11.555
    3   2HA   GLY 835          2HA       GLY 835  -7.659  -2.018  10.046
    4    H    SER 836           H        SER 836  -9.290  -0.539   9.144
    5    HA   SER 836           HA       SER 836 -12.038  -1.317   8.927
    6   1HB   SER 836          1HB       SER 836 -12.026   0.436   7.088
    7   2HB   SER 836          2HB       SER 836 -11.449   0.996   8.676
    8    HG   SER 836           HG       SER 836  -9.485   1.179   7.913
    9    H    ALA 837           H        ALA 837  -9.227  -2.614   7.570
   10    HA   ALA 837           HA       ALA 837  -9.591  -3.156   4.951
   11   1HB   ALA 837          1HB       ALA 837  -8.339  -5.097   5.270
   12   2HB   ALA 837          2HB       ALA 837  -7.965  -4.180   6.749
   13   3HB   ALA 837          3HB       ALA 837  -9.159  -5.499   6.798
   14    H    ASP 838           H        ASP 838 -10.965  -5.460   7.361
   15    HA   ASP 838           HA       ASP 838 -12.643  -6.866   5.727
   16   1HB   ASP 838          1HB       ASP 838 -12.278  -6.565   8.468
   17   2HB   ASP 838          2HB       ASP 838 -13.980  -6.113   8.227
   18    H    GLU 839           H        GLU 839 -13.270  -3.642   7.165
   19    HA   GLU 839           HA       GLU 839 -15.940  -3.465   6.080
   20   1HB   GLU 839          1HB       GLU 839 -14.160  -1.912   7.772
   21   2HB   GLU 839          2HB       GLU 839 -14.946  -0.871   6.561
   22   1HG   GLU 839          1HG       GLU 839 -16.819  -2.819   7.661
   23   2HG   GLU 839          2HG       GLU 839 -16.080  -1.842   8.949
   24    H    THR 840           H        THR 840 -12.677  -2.682   4.965
   25    HA   THR 840           HA       THR 840 -13.665  -1.103   2.710
   26    HB   THR 840           HB       THR 840 -10.865  -2.194   2.971
   27    HG1  THR 840           1HG      THR 840 -10.526  -0.281   4.302
   28   1HG2  THR 840          1HG2      THR 840 -11.534  -0.840   0.998
   29   2HG2  THR 840          2HG2      THR 840 -12.043   0.475   2.084
   30   3HG2  THR 840          3HG2      THR 840 -10.328   0.008   1.995
   31    H    LEU 841           H        LEU 841 -11.861  -4.207   3.112
   32    HA   LEU 841           HA       LEU 841 -12.099  -4.977   0.386
   33   1HB   LEU 841          1HB       LEU 841 -11.409  -6.299   2.986
   34   2HB   LEU 841          2HB       LEU 841 -11.807  -7.343   1.600
   35    HG   LEU 841           HG       LEU 841  -9.387  -5.812   2.111
   36   1HD1  LEU 841          1HD1      LEU 841 -10.140  -8.238   1.016
   37   2HD1  LEU 841          2HD1      LEU 841  -9.663  -7.308  -0.424
   38   3HD1  LEU 841          3HD1      LEU 841  -8.509  -7.533   0.912
   39   1HD2  LEU 841          1HD2      LEU 841  -9.168  -4.865  -0.192
   40   2HD2  LEU 841          2HD2      LEU 841 -10.877  -5.264  -0.492
   41   3HD2  LEU 841          3HD2      LEU 841 -10.448  -4.067   0.754
   42    H    CYS 842           H        CYS 842 -14.500  -4.522   2.663
   43    HA   CYS 842           HA       CYS 842 -16.189  -6.746   2.424
   44   1HB   CYS 842          1HB       CYS 842 -16.531  -4.831   3.973
   45   2HB   CYS 842          2HB       CYS 842 -16.959  -3.802   2.583
   46    HG   CYS 842           HG       CYS 842 -18.843  -5.233   4.339
   47    H    GLN 843           H        GLN 843 -14.995  -4.777  -0.041
   48    HA   GLN 843           HA       GLN 843 -17.301  -5.492  -1.793
   49   1HB   GLN 843          1HB       GLN 843 -15.406  -3.253  -2.454
   50   2HB   GLN 843          2HB       GLN 843 -17.119  -3.458  -2.891
   51   1HG   GLN 843          1HG       GLN 843 -16.959  -3.385  -0.037
   52   2HG   GLN 843          2HG       GLN 843 -15.987  -2.033  -0.659
   53   1HE2  GLN 843          1HE2      GLN 843 -19.172  -3.659  -1.140
   54   2HE2  GLN 843          2HE2      GLN 843 -20.067  -2.190  -1.461
   55    H    THR 844           H        THR 844 -16.167  -7.585  -2.040
   56    HA   THR 844           HA       THR 844 -14.870  -9.007  -3.278
   57    HB   THR 844           HB       THR 844 -15.426  -6.758  -4.956
   58    HG1  THR 844           1HG      THR 844 -15.442  -8.376  -6.469
   59   1HG2  THR 844          1HG2      THR 844 -12.559  -7.670  -4.887
   60   2HG2  THR 844          2HG2      THR 844 -13.299  -7.310  -6.466
   61   3HG2  THR 844          3HG2      THR 844 -13.227  -6.051  -5.209
   62    H    LYS 845           H        LYS 845 -12.989  -6.000  -3.850
   63    HA   LYS 845           HA       LYS 845 -10.960  -6.836  -1.910
   64   1HB   LYS 845          1HB       LYS 845 -10.504  -6.860  -4.911
   65   2HB   LYS 845          2HB       LYS 845  -9.175  -6.725  -3.735
   66   1HG   LYS 845          1HG       LYS 845 -11.254  -8.933  -3.576
   67   2HG   LYS 845          2HG       LYS 845  -9.768  -9.100  -4.541
   68   1HD   LYS 845          1HD       LYS 845  -8.772  -9.793  -2.629
   69   2HD   LYS 845          2HD       LYS 845  -8.856  -8.096  -2.100
   70   1HE   LYS 845          1HE       LYS 845  -9.853  -9.601  -0.414
   71   2HE   LYS 845          2HE       LYS 845 -11.074  -8.509  -1.102
   72   1HZ   LYS 845          1HZ       LYS 845 -11.349 -11.125  -0.920
   73   2HZ   LYS 845          2HZ       LYS 845 -12.131 -10.194  -2.035
   74   3HZ   LYS 845          3HZ       LYS 845 -10.760 -11.009  -2.456
   75    H    VAL 846           H        VAL 846 -12.829  -4.550  -3.360
   76    HA   VAL 846           HA       VAL 846 -12.568  -2.277  -3.817
   77    HB   VAL 846           HB       VAL 846 -11.750  -1.148  -1.630
   78   1HG1  VAL 846          1HG1      VAL 846 -14.149  -1.869  -2.380
   79   2HG1  VAL 846          2HG1      VAL 846 -13.942  -3.193  -1.209
   80   3HG1  VAL 846          3HG1      VAL 846 -13.870  -1.501  -0.661
   81   1HG2  VAL 846          1HG2      VAL 846 -10.779  -3.767  -1.210
   82   2HG2  VAL 846          2HG2      VAL 846 -10.834  -2.442  -0.022
   83   3HG2  VAL 846          3HG2      VAL 846 -12.179  -3.604  -0.123
   84    H    LEU 847           H        LEU 847 -11.145  -0.469  -4.212
   85    HA   LEU 847           HA       LEU 847  -8.277  -0.830  -3.888
   86   1HB   LEU 847          1HB       LEU 847  -9.340  -0.656  -6.722
   87   2HB   LEU 847          2HB       LEU 847  -7.681  -1.004  -6.180
   88    HG   LEU 847           HG       LEU 847  -8.907  -3.055  -6.935
   89   1HD1  LEU 847          1HD1      LEU 847  -8.726  -3.977  -4.287
   90   2HD1  LEU 847          2HD1      LEU 847  -7.420  -3.961  -5.495
   91   3HD1  LEU 847          3HD1      LEU 847  -7.597  -2.602  -4.360
   92   1HD2  LEU 847          1HD2      LEU 847 -10.543  -3.475  -4.627
   93   2HD2  LEU 847          2HD2      LEU 847 -10.963  -1.878  -5.294
   94   3HD2  LEU 847          3HD2      LEU 847 -11.058  -3.326  -6.325
   95    H    LEU 848           H        LEU 848 -10.079   0.883  -6.464
   96    HA   LEU 848           HA       LEU 848 -10.464   3.117  -6.806
   97   1HB   LEU 848          1HB       LEU 848 -10.117   3.011  -3.823
   98   2HB   LEU 848          2HB       LEU 848 -10.111   4.598  -4.629
   99    HG   LEU 848           HG       LEU 848 -12.263   2.526  -5.173
  100   1HD1  LEU 848          1HD1      LEU 848 -11.785   3.841  -2.700
  101   2HD1  LEU 848          2HD1      LEU 848 -13.133   4.708  -3.474
  102   3HD1  LEU 848          3HD1      LEU 848 -13.249   2.955  -3.191
  103   1HD2  LEU 848          1HD2      LEU 848 -12.696   4.104  -6.749
  104   2HD2  LEU 848          2HD2      LEU 848 -13.304   5.085  -5.394
  105   3HD2  LEU 848          3HD2      LEU 848 -11.632   5.299  -5.968
  106    H    ASP 849           H        ASP 849  -9.279   5.294  -6.781
  107    HA   ASP 849           HA       ASP 849  -6.478   4.751  -7.409
  108   1HB   ASP 849          1HB       ASP 849  -8.135   7.300  -7.516
  109   2HB   ASP 849          2HB       ASP 849  -6.496   7.103  -8.172
  110    H    ILE 850           H        ILE 850  -6.702   4.184  -4.788
  111    HA   ILE 850           HA       ILE 850  -6.306   6.466  -3.073
  112    HB   ILE 850           HB       ILE 850  -5.199   3.879  -2.190
  113   1HG1  ILE 850          1HG1      ILE 850  -7.122   3.418  -3.952
  114   2HG1  ILE 850          2HG1      ILE 850  -7.107   2.548  -2.399
  115   1HG2  ILE 850          1HG2      ILE 850  -7.623   4.937  -0.913
  116   2HG2  ILE 850          2HG2      ILE 850  -6.006   4.659  -0.223
  117   3HG2  ILE 850          3HG2      ILE 850  -6.355   6.173  -1.093
  118   1HD1  ILE 850          1HD1      ILE 850  -8.916   4.744  -3.348
  119   2HD1  ILE 850          2HD1      ILE 850  -9.287   3.310  -2.362
  120   3HD1  ILE 850          3HD1      ILE 850  -8.490   4.718  -1.620
  121    H    PHE 851           H        PHE 851  -3.945   3.834  -3.073
  122    HA   PHE 851           HA       PHE 851  -1.736   5.542  -2.723
  123   1HB   PHE 851          1HB       PHE 851  -1.575   2.838  -4.056
  124   2HB   PHE 851          2HB       PHE 851  -0.417   3.602  -2.955
  125    HD1  PHE 851           1HD      PHE 851  -2.604   0.985  -3.149
  126    HD2  PHE 851           2HD      PHE 851  -1.751   4.341  -0.608
  127    HE1  PHE 851           1HE      PHE 851  -3.647  -0.199  -1.236
  128    HE2  PHE 851           2HE      PHE 851  -2.795   3.157   1.306
  129    HZ   PHE 851           HZ       PHE 851  -3.742   0.887   0.991
  130    H    THR 852           H        THR 852  -3.645   5.914  -5.193
  131    HA   THR 852           HA       THR 852  -2.679   5.536  -7.631
  132    HB   THR 852           HB       THR 852  -4.286   7.442  -6.529
  133    HG1  THR 852           1HG      THR 852  -4.665   6.861  -8.563
  134   1HG2  THR 852          1HG2      THR 852  -3.353   9.646  -7.276
  135   2HG2  THR 852          2HG2      THR 852  -2.426   8.918  -5.942
  136   3HG2  THR 852          3HG2      THR 852  -1.801   8.840  -7.607
  137    H    GLY 853           H        GLY 853  -0.607   5.151  -8.209
  138   1HA   GLY 853          1HA       GLY 853   1.614   5.544  -8.632
  139   2HA   GLY 853          2HA       GLY 853   1.241   7.278  -8.497
  140    H    VAL 854           H        VAL 854   1.226   4.507  -6.180
  141    HA   VAL 854           HA       VAL 854   3.019   6.132  -4.436
  142    HB   VAL 854           HB       VAL 854   0.520   4.564  -3.854
  143   1HG1  VAL 854          1HG1      VAL 854   1.242   4.456  -1.453
  144   2HG1  VAL 854          2HG1      VAL 854   2.209   3.408  -2.518
  145   3HG1  VAL 854          3HG1      VAL 854   2.873   4.961  -1.957
  146   1HG2  VAL 854          1HG2      VAL 854   0.362   6.499  -2.169
  147   2HG2  VAL 854          2HG2      VAL 854   1.790   7.184  -2.981
  148   3HG2  VAL 854          3HG2      VAL 854   0.279   6.943  -3.891
  149    H    ARG 855           H        ARG 855   4.994   5.233  -4.492
  150    HA   ARG 855           HA       ARG 855   5.340   2.412  -5.116
  151   1HB   ARG 855          1HB       ARG 855   7.246   4.660  -4.372
  152   2HB   ARG 855          2HB       ARG 855   7.774   3.003  -4.749
  153   1HG   ARG 855          1HG       ARG 855   6.517   3.210  -6.948
  154   2HG   ARG 855          2HG       ARG 855   6.286   4.934  -6.572
  155   1HD   ARG 855          1HD       ARG 855   9.040   3.686  -6.479
  156   2HD   ARG 855          2HD       ARG 855   8.344   4.224  -8.022
  157    HE   ARG 855           HE       ARG 855   9.353   5.896  -5.865
  158   1HH1  ARG 855          2HH2      ARG 855   7.132   5.681  -8.608
  159   2HH1  ARG 855          1HH2      ARG 855   7.093   7.407  -8.888
  160   1HH2  ARG 855          2HH1      ARG 855   9.301   8.177  -6.235
  161   2HH2  ARG 855          1HH1      ARG 855   8.330   8.830  -7.535
  162    H    LEU 856           H        LEU 856   3.797   2.131  -3.052
  163    HA   LEU 856           HA       LEU 856   5.256   2.202  -0.523
  164   1HB   LEU 856          1HB       LEU 856   2.916   2.659  -0.407
  165   2HB   LEU 856          2HB       LEU 856   2.514   1.227  -1.385
  166    HG   LEU 856           HG       LEU 856   2.493   1.306   1.374
  167   1HD1  LEU 856          1HD1      LEU 856   2.192  -0.586  -0.745
  168   2HD1  LEU 856          2HD1      LEU 856   3.189  -1.358   0.511
  169   3HD1  LEU 856          3HD1      LEU 856   1.585  -0.707   0.924
  170   1HD2  LEU 856          1HD2      LEU 856   4.889  -0.393   0.862
  171   2HD2  LEU 856          2HD2      LEU 856   5.166   1.365   0.852
  172   3HD2  LEU 856          3HD2      LEU 856   4.465   0.582   2.289
  173    H    TYR 857           H        TYR 857   6.654   0.671   0.095
  174    HA   TYR 857           HA       TYR 857   6.822  -1.836  -1.373
  175   1HB   TYR 857          1HB       TYR 857   8.934  -1.272  -0.792
  176   2HB   TYR 857          2HB       TYR 857   8.406  -0.312   0.600
  177    HD1  TYR 857           1HD      TYR 857   7.756  -3.925  -0.126
  178    HD2  TYR 857           2HD      TYR 857   9.777  -1.056   2.351
  179    HE1  TYR 857           1HE      TYR 857   8.471  -5.746   1.399
  180    HE2  TYR 857           2HE      TYR 857  10.492  -2.877   3.876
  181    HH   TYR 857           HH       TYR 857  10.322  -5.106   4.384
  182    H    LEU 858           H        LEU 858   5.238  -3.301  -0.993
  183    HA   LEU 858           HA       LEU 858   4.146  -3.601   1.715
  184   1HB   LEU 858          1HB       LEU 858   2.724  -3.646  -0.358
  185   2HB   LEU 858          2HB       LEU 858   3.536  -5.159  -0.824
  186    HG   LEU 858           HG       LEU 858   2.365  -6.382   0.690
  187   1HD1  LEU 858          1HD1      LEU 858   3.565  -5.658   2.617
  188   2HD1  LEU 858          2HD1      LEU 858   2.860  -4.025   2.539
  189   3HD1  LEU 858          3HD1      LEU 858   1.850  -5.409   3.024
  190   1HD2  LEU 858          1HD2      LEU 858   0.802  -4.290  -0.247
  191   2HD2  LEU 858          2HD2      LEU 858   0.194  -5.717   0.626
  192   3HD2  LEU 858          3HD2      LEU 858   0.541  -4.213   1.512
  193    HA   PRO 859           HA       PRO 859   7.298  -6.706   2.465
  194   1HB   PRO 859          1HB       PRO 859   6.865  -6.924   5.146
  195   2HB   PRO 859          2HB       PRO 859   7.651  -5.479   4.429
  196   1HG   PRO 859          1HG       PRO 859   4.721  -5.821   5.132
  197   2HG   PRO 859          2HG       PRO 859   5.810  -4.483   5.626
  198   1HD   PRO 859          1HD       PRO 859   4.171  -4.256   3.460
  199   2HD   PRO 859          2HD       PRO 859   5.835  -3.598   3.412
  200    HA   PRO 860           HA       PRO 860   4.700 -10.270   2.239
  201   1HB   PRO 860          1HB       PRO 860   6.515 -12.224   2.795
  202   2HB   PRO 860          2HB       PRO 860   6.625 -11.228   1.308
  203   1HG   PRO 860          1HG       PRO 860   8.079 -10.782   3.931
  204   2HG   PRO 860          2HG       PRO 860   8.798 -10.869   2.289
  205   1HD   PRO 860          1HD       PRO 860   8.180  -8.479   3.446
  206   2HD   PRO 860          2HD       PRO 860   7.877  -8.749   1.703
  207    H    SER 861           H        SER 861   6.448  -9.282   5.106
  208    HA   SER 861           HA       SER 861   5.211 -11.293   6.827
  209   1HB   SER 861          1HB       SER 861   7.394  -9.423   6.960
  210   2HB   SER 861          2HB       SER 861   6.290  -9.116   8.322
  211    HG   SER 861           HG       SER 861   6.981 -10.882   9.181
  212    H    THR 862           H        THR 862   4.352  -8.259   5.448
  213    HA   THR 862           HA       THR 862   2.727  -7.230   7.565
  214    HB   THR 862           HB       THR 862   3.288  -6.666   4.737
  215    HG1  THR 862           1HG      THR 862   2.887  -4.543   5.615
  216   1HG2  THR 862          1HG2      THR 862   0.835  -7.252   4.640
  217   2HG2  THR 862          2HG2      THR 862   0.533  -5.972   5.840
  218   3HG2  THR 862          3HG2      THR 862   1.184  -5.553   4.237
  219    HA   PRO 863           HA       PRO 863  -0.682 -10.016   7.357
  220   1HB   PRO 863          1HB       PRO 863  -2.517  -8.565   8.755
  221   2HB   PRO 863          2HB       PRO 863  -1.043  -9.227   9.534
  222   1HG   PRO 863          1HG       PRO 863  -1.438  -6.433   8.424
  223   2HG   PRO 863          2HG       PRO 863  -0.853  -6.882  10.059
  224   1HD   PRO 863          1HD       PRO 863   0.881  -6.293   8.040
  225   2HD   PRO 863          2HD       PRO 863   1.234  -7.628   9.179
  226    H    ASP 864           H        ASP 864  -2.548 -10.324   6.113
  227    HA   ASP 864           HA       ASP 864  -4.150  -9.876   4.529
  228   1HB   ASP 864          1HB       ASP 864  -3.853  -7.394   5.936
  229   2HB   ASP 864          2HB       ASP 864  -3.994  -7.040   4.200
  230    H    PHE 865           H        PHE 865  -0.954  -9.603   4.273
  231    HA   PHE 865           HA       PHE 865  -0.203  -8.112   2.112
  232   1HB   PHE 865          1HB       PHE 865   1.094  -9.854   3.507
  233   2HB   PHE 865          2HB       PHE 865   0.525 -11.038   2.318
  234    HD1  PHE 865           1HD      PHE 865   1.966  -7.560   2.201
  235    HD2  PHE 865           2HD      PHE 865   2.096 -11.591   0.723
  236    HE1  PHE 865           1HE      PHE 865   3.838  -6.947   0.694
  237    HE2  PHE 865           2HE      PHE 865   3.969 -10.978  -0.783
  238    HZ   PHE 865           HZ       PHE 865   4.840  -8.656  -0.798
  239    H    SER 866           H        SER 866  -1.843 -11.317   1.973
  240    HA   SER 866           HA       SER 866  -1.969 -12.024  -0.567
  241   1HB   SER 866          1HB       SER 866  -3.451 -13.091   0.954
  242   2HB   SER 866          2HB       SER 866  -4.315 -11.574   1.301
  243    HG   SER 866           HG       SER 866  -4.398 -13.203  -0.991
  244    H    ARG 867           H        ARG 867  -4.592  -9.759   0.366
  245    HA   ARG 867           HA       ARG 867  -4.751  -8.752  -2.342
  246   1HB   ARG 867          1HB       ARG 867  -6.029  -7.552   0.133
  247   2HB   ARG 867          2HB       ARG 867  -6.613  -7.507  -1.548
  248   1HG   ARG 867          1HG       ARG 867  -7.888  -9.292  -0.949
  249   2HG   ARG 867          2HG       ARG 867  -6.378 -10.224  -1.086
  250   1HD   ARG 867          1HD       ARG 867  -6.119 -10.394   1.182
  251   2HD   ARG 867          2HD       ARG 867  -6.785  -8.775   1.484
  252    HE   ARG 867           HE       ARG 867  -8.895 -10.427   0.576
  253   1HH1  ARG 867          2HH2      ARG 867  -6.685 -10.107   3.318
  254   2HH1  ARG 867          1HH2      ARG 867  -7.800 -10.803   4.473
  255   1HH2  ARG 867          2HH1      ARG 867 -10.367 -11.346   2.102
  256   2HH2  ARG 867          1HH1      ARG 867  -9.899 -11.509   3.780
  257    H    LEU 868           H        LEU 868  -3.458  -7.590   0.782
  258    HA   LEU 868           HA       LEU 868  -2.965  -4.972   0.450
  259   1HB   LEU 868          1HB       LEU 868  -1.461  -7.221   1.625
  260   2HB   LEU 868          2HB       LEU 868  -0.447  -5.819   1.205
  261    HG   LEU 868           HG       LEU 868  -2.325  -6.125   3.396
  262   1HD1  LEU 868          1HD1      LEU 868  -0.009  -4.557   2.570
  263   2HD1  LEU 868          2HD1      LEU 868  -1.219  -3.530   3.375
  264   3HD1  LEU 868          3HD1      LEU 868  -0.569  -4.961   4.210
  265   1HD2  LEU 868          1HD2      LEU 868  -2.781  -3.706   1.601
  266   2HD2  LEU 868          2HD2      LEU 868  -3.890  -5.095   1.705
  267   3HD2  LEU 868          3HD2      LEU 868  -3.604  -4.075   3.136
  268    H    ARG 869           H        ARG 869  -0.962  -7.540  -1.100
  269    HA   ARG 869           HA       ARG 869   0.661  -5.709  -2.570
  270   1HB   ARG 869          1HB       ARG 869   1.208  -8.108  -2.051
  271   2HB   ARG 869          2HB       ARG 869  -0.025  -8.596  -3.239
  272   1HG   ARG 869          1HG       ARG 869   1.255  -7.954  -5.031
  273   2HG   ARG 869          2HG       ARG 869   1.966  -6.573  -4.162
  274   1HD   ARG 869          1HD       ARG 869   3.794  -8.016  -4.326
  275   2HD   ARG 869          2HD       ARG 869   3.143  -8.436  -2.726
  276    HE   ARG 869           HE       ARG 869   2.975 -10.059  -5.197
  277   1HH1  ARG 869          2HH2      ARG 869   2.189  -9.588  -1.782
  278   2HH1  ARG 869          1HH2      ARG 869   1.774 -11.265  -1.505
  279   1HH2  ARG 869          2HH1      ARG 869   2.426 -12.274  -4.831
  280   2HH2  ARG 869          1HH1      ARG 869   1.909 -12.796  -3.244
  281    H    ARG 870           H        ARG 870  -1.275  -8.132  -4.297
  282    HA   ARG 870           HA       ARG 870  -1.683  -6.876  -6.637
  283   1HB   ARG 870          1HB       ARG 870  -2.617  -9.062  -6.216
  284   2HB   ARG 870          2HB       ARG 870  -3.739  -8.406  -5.001
  285   1HG   ARG 870          1HG       ARG 870  -4.943  -8.739  -7.101
  286   2HG   ARG 870          2HG       ARG 870  -4.779  -6.993  -6.795
  287   1HD   ARG 870          1HD       ARG 870  -3.659  -6.723  -8.725
  288   2HD   ARG 870          2HD       ARG 870  -2.453  -7.928  -8.224
  289    HE   ARG 870           HE       ARG 870  -4.818  -9.263  -9.101
  290   1HH1  ARG 870          2HH2      ARG 870  -2.096  -7.354 -10.305
  291   2HH1  ARG 870          1HH2      ARG 870  -2.102  -8.093 -11.890
  292   1HH2  ARG 870          2HH1      ARG 870  -4.826 -10.239 -11.196
  293   2HH2  ARG 870          1HH1      ARG 870  -3.658  -9.738 -12.399
  294    H    TYR 871           H        TYR 871  -3.920  -6.422  -3.834
  295    HA   TYR 871           HA       TYR 871  -5.616  -4.530  -4.854
  296   1HB   TYR 871          1HB       TYR 871  -5.561  -5.538  -2.531
  297   2HB   TYR 871          2HB       TYR 871  -4.331  -4.333  -2.115
  298    HD1  TYR 871           1HD      TYR 871  -7.466  -4.035  -4.157
  299    HD2  TYR 871           2HD      TYR 871  -5.317  -2.830  -0.638
  300    HE1  TYR 871           1HE      TYR 871  -9.250  -2.395  -3.629
  301    HE2  TYR 871           2HE      TYR 871  -7.101  -1.191  -0.110
  302    HH   TYR 871           HH       TYR 871  -9.701  -0.956  -0.704
  303    H    PHE 872           H        PHE 872  -2.605  -3.668  -3.047
  304    HA   PHE 872           HA       PHE 872  -2.621  -0.943  -3.636
  305   1HB   PHE 872          1HB       PHE 872  -1.104  -2.301  -2.080
  306   2HB   PHE 872          2HB       PHE 872  -0.122  -2.646  -3.514
  307    HD1  PHE 872           1HD      PHE 872  -0.184  -0.675  -0.728
  308    HD2  PHE 872           2HD      PHE 872   0.172  -0.280  -4.990
  309    HE1  PHE 872           1HE      PHE 872   1.004   1.481  -0.429
  310    HE2  PHE 872           2HE      PHE 872   1.360   1.877  -4.691
  311    HZ   PHE 872           HZ       PHE 872   1.776   2.757  -2.410
  312    H    VAL 873           H        VAL 873   0.033  -2.756  -5.104
  313    HA   VAL 873           HA       VAL 873   0.519  -1.274  -7.285
  314    HB   VAL 873           HB       VAL 873   1.850  -3.190  -7.014
  315   1HG1  VAL 873          1HG1      VAL 873  -0.216  -4.365  -5.845
  316   2HG1  VAL 873          2HG1      VAL 873  -0.451  -5.090  -7.454
  317   3HG1  VAL 873          3HG1      VAL 873   1.076  -5.348  -6.575
  318   1HG2  VAL 873          1HG2      VAL 873   0.086  -4.120  -9.295
  319   2HG2  VAL 873          2HG2      VAL 873   1.054  -2.633  -9.434
  320   3HG2  VAL 873          3HG2      VAL 873   1.858  -4.196  -9.152
  321    H    ALA 874           H        ALA 874  -2.313  -3.362  -6.842
  322    HA   ALA 874           HA       ALA 874  -3.241  -3.362  -9.518
  323   1HB   ALA 874          1HB       ALA 874  -4.559  -3.644  -6.809
  324   2HB   ALA 874          2HB       ALA 874  -5.518  -3.664  -8.308
  325   3HB   ALA 874          3HB       ALA 874  -4.258  -4.893  -8.041
  326    H    PHE 875           H        PHE 875  -4.124  -1.226  -6.742
  327    HA   PHE 875           HA       PHE 875  -5.936   0.453  -7.866
  328   1HB   PHE 875          1HB       PHE 875  -3.500   1.320  -6.274
  329   2HB   PHE 875          2HB       PHE 875  -5.002   2.240  -6.461
  330    HD1  PHE 875           1HD      PHE 875  -4.557   2.082  -3.817
  331    HD2  PHE 875           2HD      PHE 875  -5.877  -1.152  -6.317
  332    HE1  PHE 875           1HE      PHE 875  -5.503   0.934  -1.833
  333    HE2  PHE 875           2HE      PHE 875  -6.823  -2.300  -4.333
  334    HZ   PHE 875           HZ       PHE 875  -6.637  -1.257  -2.091
  335    H    ASP 876           H        ASP 876  -2.383   0.591  -8.389
  336    HA   ASP 876           HA       ASP 876  -2.049   1.107 -10.926
  337   1HB   ASP 876          1HB       ASP 876  -3.670   3.365  -9.820
  338   2HB   ASP 876          2HB       ASP 876  -2.395   3.769 -10.991
  339    H    GLY 877           H        GLY 877  -1.133   1.385  -7.823
  340   1HA   GLY 877          1HA       GLY 877   0.969   3.393  -8.095
  341   2HA   GLY 877          2HA       GLY 877   0.680   2.317  -6.709
  342    H    ASP 878           H        ASP 878   2.666   1.392  -6.396
  343    HA   ASP 878           HA       ASP 878   3.555  -0.517  -8.425
  344   1HB   ASP 878          1HB       ASP 878   4.958   2.054  -7.854
  345   2HB   ASP 878          2HB       ASP 878   5.968   0.597  -7.969
  346    H    LEU 879           H        LEU 879   4.790  -2.186  -7.534
  347    HA   LEU 879           HA       LEU 879   5.196  -2.004  -4.585
  348   1HB   LEU 879          1HB       LEU 879   4.120  -4.242  -6.321
  349   2HB   LEU 879          2HB       LEU 879   4.808  -4.552  -4.710
  350    HG   LEU 879           HG       LEU 879   2.174  -3.833  -5.229
  351   1HD1  LEU 879          1HD1      LEU 879   2.517  -4.802  -3.164
  352   2HD1  LEU 879          2HD1      LEU 879   4.006  -3.876  -2.859
  353   3HD1  LEU 879          3HD1      LEU 879   2.418  -3.101  -2.647
  354   1HD2  LEU 879          1HD2      LEU 879   2.959  -1.534  -5.807
  355   2HD2  LEU 879          2HD2      LEU 879   1.920  -1.551  -4.362
  356   3HD2  LEU 879          3HD2      LEU 879   3.685  -1.399  -4.188
  357    H    VAL 880           H        VAL 880   7.280  -2.132  -4.022
  358    HA   VAL 880           HA       VAL 880   9.132  -3.521  -5.900
  359    HB   VAL 880           HB       VAL 880  10.399  -1.746  -3.967
  360   1HG1  VAL 880          1HG1      VAL 880  11.139  -2.748  -6.277
  361   2HG1  VAL 880          2HG1      VAL 880  10.249  -1.368  -6.964
  362   3HG1  VAL 880          3HG1      VAL 880  11.619  -1.085  -5.863
  363   1HG2  VAL 880          1HG2      VAL 880   8.091  -0.722  -5.633
  364   2HG2  VAL 880          2HG2      VAL 880   8.518  -0.333  -3.950
  365   3HG2  VAL 880          3HG2      VAL 880   9.487   0.327  -5.289
  366    H    GLN 881           H        GLN 881  10.409  -5.144  -5.119
  367    HA   GLN 881           HA       GLN 881   9.681  -6.357  -2.629
  368   1HB   GLN 881          1HB       GLN 881  12.164  -6.875  -4.303
  369   2HB   GLN 881          2HB       GLN 881  11.347  -7.999  -3.191
  370   1HG   GLN 881          1HG       GLN 881   9.803  -8.577  -4.743
  371   2HG   GLN 881          2HG       GLN 881   9.539  -6.887  -5.225
  372   1HE2  GLN 881          1HE2      GLN 881  10.277  -6.239  -7.180
  373   2HE2  GLN 881          2HE2      GLN 881  11.428  -7.119  -8.163
  374    H    GLU 882           H        GLU 882  10.532  -6.161  -0.619
  375    HA   GLU 882           HA       GLU 882  11.759  -4.083   0.453
  376   1HB   GLU 882          1HB       GLU 882  11.242  -6.102   1.733
  377   2HB   GLU 882          2HB       GLU 882  12.597  -6.964   0.966
  378   1HG   GLU 882          1HG       GLU 882  13.809  -4.660   1.908
  379   2HG   GLU 882          2HG       GLU 882  12.606  -5.000   3.171
  380    H    PHE 883           H        PHE 883  13.903  -6.790  -0.595
  381    HA   PHE 883           HA       PHE 883  16.224  -5.121  -0.655
  382   1HB   PHE 883          1HB       PHE 883  17.331  -7.035  -1.542
  383   2HB   PHE 883          2HB       PHE 883  16.138  -7.625  -0.372
  384    HD1  PHE 883           1HD      PHE 883  17.072  -7.450  -3.925
  385    HD2  PHE 883           2HD      PHE 883  14.150  -8.844  -1.103
  386    HE1  PHE 883           1HE      PHE 883  16.100  -8.929  -5.663
  387    HE2  PHE 883           2HE      PHE 883  13.178 -10.323  -2.840
  388    HZ   PHE 883           HZ       PHE 883  14.153 -10.366  -5.120
  389    H    ASP 884           H        ASP 884  13.623  -4.615  -2.416
  390    HA   ASP 884           HA       ASP 884  15.201  -3.743  -4.770
  391   1HB   ASP 884          1HB       ASP 884  12.595  -5.307  -4.830
  392   2HB   ASP 884          2HB       ASP 884  13.303  -4.478  -6.233
  393    H    MET 885           H        MET 885  15.077  -1.652  -3.732
  394    HA   MET 885           HA       MET 885  12.458  -0.361  -4.236
  395   1HB   MET 885          1HB       MET 885  13.208   0.980  -2.018
  396   2HB   MET 885          2HB       MET 885  12.158  -0.456  -1.966
  397   1HG   MET 885          1HG       MET 885  14.345  -1.817  -1.826
  398   2HG   MET 885          2HG       MET 885  15.137  -0.276  -1.456
  399   1HE   MET 885          1HE       MET 885  12.368  -2.618  -0.790
  400   2HE   MET 885          2HE       MET 885  12.291  -2.818   0.977
  401   3HE   MET 885          3HE       MET 885  11.402  -1.490   0.192
  402    H    THR 886           H        THR 886  15.973  -0.174  -3.724
  403    HA   THR 886           HA       THR 886  16.914   2.211  -3.872
  404    HB   THR 886           HB       THR 886  18.491   1.626  -5.532
  405    HG1  THR 886           1HG      THR 886  16.615  -0.210  -6.601
  406   1HG2  THR 886          1HG2      THR 886  18.148  -0.024  -3.569
  407   2HG2  THR 886          2HG2      THR 886  17.377  -1.091  -4.766
  408   3HG2  THR 886          3HG2      THR 886  19.078  -0.608  -4.969
  409    H    SER 887           H        SER 887  15.031   1.007  -6.704
  410    HA   SER 887           HA       SER 887  14.762   3.795  -7.644
  411   1HB   SER 887          1HB       SER 887  14.630   1.085  -8.829
  412   2HB   SER 887          2HB       SER 887  13.410   2.226  -9.442
  413    HG   SER 887           HG       SER 887  15.491   3.663  -9.399
  414    H    ALA 888           H        ALA 888  13.129   1.490  -5.721
  415    HA   ALA 888           HA       ALA 888  10.438   1.826  -6.358
  416   1HB   ALA 888          1HB       ALA 888  10.114   1.501  -3.827
  417   2HB   ALA 888          2HB       ALA 888  11.024   0.239  -4.692
  418   3HB   ALA 888          3HB       ALA 888  11.891   1.455  -3.723
  419    H    THR 889           H        THR 889   9.286   2.972  -3.986
  420    HA   THR 889           HA       THR 889  10.183   5.751  -3.870
  421    HB   THR 889           HB       THR 889   8.515   5.160  -5.944
  422    HG1  THR 889           1HG      THR 889   8.139   7.351  -5.932
  423   1HG2  THR 889          1HG2      THR 889   6.680   6.167  -3.744
  424   2HG2  THR 889          2HG2      THR 889   6.243   5.603  -5.375
  425   3HG2  THR 889          3HG2      THR 889   6.806   4.439  -4.152
  426    H    HIS 890           H        HIS 890   7.731   3.262  -3.107
  427    HA   HIS 890           HA       HIS 890   7.396   4.584  -0.453
  428   1HB   HIS 890          1HB       HIS 890   5.452   3.263  -2.328
  429   2HB   HIS 890          2HB       HIS 890   5.159   3.192  -0.581
  430    HD1  HIS 890           1HD      HIS 890   5.183   5.680  -3.481
  431    HD2  HIS 890           2HD      HIS 890   4.551   5.506   0.676
  432    HE1  HIS 890           1HE      HIS 890   4.119   7.904  -2.805
  433    H    VAL 891           H        VAL 891   7.162   3.178   1.375
  434    HA   VAL 891           HA       VAL 891   7.788   0.328   0.935
  435    HB   VAL 891           HB       VAL 891   9.608   0.501   2.688
  436   1HG1  VAL 891          1HG1      VAL 891  10.403   0.204   0.495
  437   2HG1  VAL 891          2HG1      VAL 891   9.781   1.781  -0.047
  438   3HG1  VAL 891          3HG1      VAL 891  11.217   1.704   1.001
  439   1HG2  VAL 891          1HG2      VAL 891   8.923   2.708   3.592
  440   2HG2  VAL 891          2HG2      VAL 891  10.613   2.732   3.033
  441   3HG2  VAL 891          3HG2      VAL 891   9.335   3.468   2.036
  442    H    LEU 892           H        LEU 892   6.534  -0.879   2.232
  443    HA   LEU 892           HA       LEU 892   4.909   0.439   4.259
  444   1HB   LEU 892          1HB       LEU 892   4.614  -1.759   2.580
  445   2HB   LEU 892          2HB       LEU 892   4.856  -2.496   4.183
  446    HG   LEU 892           HG       LEU 892   3.068  -0.144   4.212
  447   1HD1  LEU 892          1HD1      LEU 892   1.165  -1.682   3.302
  448   2HD1  LEU 892          2HD1      LEU 892   2.218  -0.855   2.128
  449   3HD1  LEU 892          3HD1      LEU 892   2.482  -2.575   2.504
  450   1HD2  LEU 892          1HD2      LEU 892   3.428  -1.691   6.118
  451   2HD2  LEU 892          2HD2      LEU 892   1.725  -1.684   5.601
  452   3HD2  LEU 892          3HD2      LEU 892   2.789  -3.035   5.141
  453    H    GLY 893           H        GLY 893   5.521   0.734   6.315
  454   1HA   GLY 893          1HA       GLY 893   6.673   0.498   8.288
  455   2HA   GLY 893          2HA       GLY 893   6.571  -1.253   7.990
  456    H    SER 894           H        SER 894   8.673   1.345   8.408
  457    HA   SER 894           HA       SER 894  10.981   1.341   8.436
  458   1HB   SER 894          1HB       SER 894  10.592  -1.389   7.162
  459   2HB   SER 894          2HB       SER 894  12.194  -0.677   7.475
  460    HG   SER 894           HG       SER 894  10.219  -0.861   9.487
  461    H    ARG 895           H        ARG 895  12.837   1.485   6.793
  462    HA   ARG 895           HA       ARG 895  11.869   1.921   4.035
  463   1HB   ARG 895          1HB       ARG 895  13.080   4.162   4.063
  464   2HB   ARG 895          2HB       ARG 895  11.556   4.100   4.980
  465   1HG   ARG 895          1HG       ARG 895  12.707   3.927   7.071
  466   2HG   ARG 895          2HG       ARG 895  14.259   3.581   6.270
  467   1HD   ARG 895          1HD       ARG 895  13.285   6.042   5.202
  468   2HD   ARG 895          2HD       ARG 895  13.115   6.135   6.968
  469    HE   ARG 895           HE       ARG 895  15.654   5.117   6.591
  470   1HH1  ARG 895          2HH2      ARG 895  13.876   7.961   5.472
  471   2HH1  ARG 895          1HH2      ARG 895  15.298   8.974   5.358
  472   1HH2  ARG 895          2HH1      ARG 895  17.532   6.455   6.440
  473   2HH2  ARG 895          1HH1      ARG 895  17.382   8.115   5.909
  474    H    ASP 896           H        ASP 896  14.477   1.589   6.417
  475    HA   ASP 896           HA       ASP 896  16.839   1.737   5.447
  476   1HB   ASP 896          1HB       ASP 896  16.595   0.184   7.207
  477   2HB   ASP 896          2HB       ASP 896  15.527  -0.867   6.251
  478    H    LYS 897           H        LYS 897  15.291  -1.252   4.201
  479    HA   LYS 897           HA       LYS 897  16.772  -1.804   2.050
  480   1HB   LYS 897          1HB       LYS 897  14.139  -1.891   1.006
  481   2HB   LYS 897          2HB       LYS 897  15.041  -3.209   1.790
  482   1HG   LYS 897          1HG       LYS 897  13.105  -3.036   3.120
  483   2HG   LYS 897          2HG       LYS 897  14.293  -2.067   4.023
  484   1HD   LYS 897          1HD       LYS 897  13.402  -0.062   2.621
  485   2HD   LYS 897          2HD       LYS 897  12.016  -1.120   2.264
  486   1HE   LYS 897          1HE       LYS 897  12.171  -1.486   4.939
  487   2HE   LYS 897          2HE       LYS 897  12.841   0.156   4.837
  488   1HZ   LYS 897          1HZ       LYS 897  10.349  -0.154   5.060
  489   2HZ   LYS 897          2HZ       LYS 897  10.907   0.950   3.969
  490   3HZ   LYS 897          3HZ       LYS 897  10.371  -0.522   3.452
  491    H    ASN 898           H        ASN 898  14.589   0.988   2.310
  492    HA   ASN 898           HA       ASN 898  16.004   2.300   0.132
  493   1HB   ASN 898          1HB       ASN 898  13.759   0.747  -0.530
  494   2HB   ASN 898          2HB       ASN 898  13.156   2.417  -0.467
  495   1HD2  ASN 898          1HD2      ASN 898  12.975   2.971  -2.598
  496   2HD2  ASN 898          2HD2      ASN 898  14.295   2.920  -3.747
  497    HA   PRO 899           HA       PRO 899  14.620   5.189   3.347
  498   1HB   PRO 899          1HB       PRO 899  16.736   6.891   3.121
  499   2HB   PRO 899          2HB       PRO 899  16.886   5.299   3.932
  500   1HG   PRO 899          1HG       PRO 899  17.567   5.966   1.054
  501   2HG   PRO 899          2HG       PRO 899  18.616   5.151   2.260
  502   1HD   PRO 899          1HD       PRO 899  17.138   3.725   0.468
  503   2HD   PRO 899          2HD       PRO 899  17.301   3.164   2.160
  504    H    ALA 900           H        ALA 900  15.059   5.285  -0.051
  505    HA   ALA 900           HA       ALA 900  14.236   8.097  -0.316
  506   1HB   ALA 900          1HB       ALA 900  14.239   7.245  -2.831
  507   2HB   ALA 900          2HB       ALA 900  15.764   7.592  -1.981
  508   3HB   ALA 900          3HB       ALA 900  15.196   5.912  -2.141
  509    H    ALA 901           H        ALA 901  12.739   5.188   0.353
  510    HA   ALA 901           HA       ALA 901  10.368   5.693  -1.324
  511   1HB   ALA 901          1HB       ALA 901  11.342   3.382  -0.926
  512   2HB   ALA 901          2HB       ALA 901  10.812   3.532   0.766
  513   3HB   ALA 901          3HB       ALA 901   9.611   3.549  -0.548
  514    H    GLN 902           H        GLN 902   8.477   4.634   0.597
  515    HA   GLN 902           HA       GLN 902   8.422   6.871   2.568
  516   1HB   GLN 902          1HB       GLN 902   6.382   5.903   0.597
  517   2HB   GLN 902          2HB       GLN 902   5.809   6.448   2.192
  518   1HG   GLN 902          1HG       GLN 902   7.538   8.026   0.243
  519   2HG   GLN 902          2HG       GLN 902   5.834   8.338   0.637
  520   1HE2  GLN 902          1HE2      GLN 902   5.972   7.839   3.460
  521   2HE2  GLN 902          2HE2      GLN 902   6.898   9.133   4.188
  522    H    GLN 903           H        GLN 903   7.994   6.310   4.648
  523    HA   GLN 903           HA       GLN 903   7.727   3.430   5.206
  524   1HB   GLN 903          1HB       GLN 903   8.358   5.887   6.868
  525   2HB   GLN 903          2HB       GLN 903   8.049   4.295   7.602
  526   1HG   GLN 903          1HG       GLN 903  10.131   3.610   7.094
  527   2HG   GLN 903          2HG       GLN 903   9.876   4.001   5.380
  528   1HE2  GLN 903          1HE2      GLN 903  10.513   6.052   4.563
  529   2HE2  GLN 903          2HE2      GLN 903  11.603   7.094   5.452
  530    H    VAL 904           H        VAL 904   5.473   3.538   4.232
  531    HA   VAL 904           HA       VAL 904   3.484   4.801   6.008
  532    HB   VAL 904           HB       VAL 904   2.185   4.860   4.165
  533   1HG1  VAL 904          1HG1      VAL 904   4.484   3.633   2.613
  534   2HG1  VAL 904          2HG1      VAL 904   3.350   4.904   2.099
  535   3HG1  VAL 904          3HG1      VAL 904   4.602   5.266   3.312
  536   1HG2  VAL 904          1HG2      VAL 904   1.887   2.818   2.694
  537   2HG2  VAL 904          2HG2      VAL 904   3.050   1.971   3.741
  538   3HG2  VAL 904          3HG2      VAL 904   1.506   2.549   4.412
  539    H    SER 905           H        SER 905   1.452   3.353   6.391
  540    HA   SER 905           HA       SER 905   2.354   0.615   7.144
  541   1HB   SER 905          1HB       SER 905   1.819   2.716   8.916
  542   2HB   SER 905          2HB       SER 905   0.326   1.747   8.918
  543    HG   SER 905           HG       SER 905   2.074   1.088  10.397
  544    HA   PRO 906           HA       PRO 906  -1.543  -0.904   5.738
  545   1HB   PRO 906          1HB       PRO 906  -2.875  -2.059   7.815
  546   2HB   PRO 906          2HB       PRO 906  -1.292  -2.681   7.245
  547   1HG   PRO 906          1HG       PRO 906  -1.795  -0.765   9.540
  548   2HG   PRO 906          2HG       PRO 906  -0.840  -2.283   9.579
  549   1HD   PRO 906          1HD       PRO 906   0.354   0.140   9.214
  550   2HD   PRO 906          2HD       PRO 906   0.908  -1.293   8.294
  551    H    GLU 907           H        GLU 907  -1.782   1.233   8.567
  552    HA   GLU 907           HA       GLU 907  -4.581   1.800   8.293
  553   1HB   GLU 907          1HB       GLU 907  -3.158   2.163  10.348
  554   2HB   GLU 907          2HB       GLU 907  -2.412   3.546   9.513
  555   1HG   GLU 907          1HG       GLU 907  -4.663   4.560   9.221
  556   2HG   GLU 907          2HG       GLU 907  -5.379   3.195  10.105
  557    H    TRP 908           H        TRP 908  -1.622   3.054   6.811
  558    HA   TRP 908           HA       TRP 908  -2.763   5.465   5.776
  559   1HB   TRP 908          1HB       TRP 908  -0.369   5.152   5.978
  560   2HB   TRP 908          2HB       TRP 908  -0.421   3.754   4.894
  561    HD1  TRP 908           HD       TRP 908  -0.690   7.570   4.878
  562    HE1  TRP 908           1HE      TRP 908  -0.226   8.461   2.537
  563    HE3  TRP 908           3HE      TRP 908  -0.445   3.123   2.355
  564    HZ2  TRP 908           2HZ      TRP 908   0.200   7.384  -0.115
  565    HZ3  TRP 908           3HZ      TRP 908  -0.009   3.096  -0.074
  566    HH2  TRP 908           HH       TRP 908   0.315   5.212  -1.321
  567    H    ILE 909           H        ILE 909  -2.216   2.203   4.350
  568    HA   ILE 909           HA       ILE 909  -3.206   2.686   1.791
  569    HB   ILE 909           HB       ILE 909  -2.979   0.323   3.605
  570   1HG1  ILE 909          1HG1      ILE 909  -2.258  -0.091   0.847
  571   2HG1  ILE 909          2HG1      ILE 909  -1.633   1.493   1.367
  572   1HG2  ILE 909          1HG2      ILE 909  -4.021  -0.875   1.398
  573   2HG2  ILE 909          2HG2      ILE 909  -4.990  -0.470   2.835
  574   3HG2  ILE 909          3HG2      ILE 909  -4.995   0.615   1.424
  575   1HD1  ILE 909          1HD1      ILE 909  -0.790  -1.212   2.162
  576   2HD1  ILE 909          2HD1      ILE 909   0.071   0.338   2.316
  577   3HD1  ILE 909          3HD1      ILE 909  -1.110  -0.152   3.555
  578    H    TRP 910           H        TRP 910  -5.051   1.509   4.667
  579    HA   TRP 910           HA       TRP 910  -7.583   1.518   3.431
  580   1HB   TRP 910          1HB       TRP 910  -7.026   2.195   6.326
  581   2HB   TRP 910          2HB       TRP 910  -8.469   1.430   5.646
  582    HD1  TRP 910           HD       TRP 910  -5.668   0.552   7.642
  583    HE1  TRP 910           1HE      TRP 910  -5.043  -1.914   7.513
  584    HE3  TRP 910           3HE      TRP 910  -8.243  -0.713   3.403
  585    HZ2  TRP 910           2HZ      TRP 910  -5.588  -4.170   5.785
  586    HZ3  TRP 910           3HZ      TRP 910  -8.166  -3.026   2.548
  587    HH2  TRP 910           HH       TRP 910  -6.846  -4.762   3.723
  588    H    ALA 911           H        ALA 911  -6.151   4.029   5.600
  589    HA   ALA 911           HA       ALA 911  -8.170   5.939   5.294
  590   1HB   ALA 911          1HB       ALA 911  -5.198   6.108   5.841
  591   2HB   ALA 911          2HB       ALA 911  -6.204   7.573   5.745
  592   3HB   ALA 911          3HB       ALA 911  -6.557   6.331   6.969
  593    H    CYS 912           H        CYS 912  -5.457   5.090   3.170
  594    HA   CYS 912           HA       CYS 912  -5.718   7.386   1.453
  595   1HB   CYS 912          1HB       CYS 912  -4.453   4.645   1.061
  596   2HB   CYS 912          2HB       CYS 912  -4.294   6.003  -0.081
  597    HG   CYS 912           HG       CYS 912  -2.400   6.911   0.953
  598    H    ILE 913           H        ILE 913  -6.153   3.980   0.418
  599    HA   ILE 913           HA       ILE 913  -7.719   4.352  -1.766
  600    HB   ILE 913           HB       ILE 913  -7.089   2.138  -1.210
  601   1HG1  ILE 913          1HG1      ILE 913 -10.072   2.310  -0.607
  602   2HG1  ILE 913          2HG1      ILE 913  -9.368   2.374  -2.241
  603   1HG2  ILE 913          1HG2      ILE 913  -8.702   1.551   1.104
  604   2HG2  ILE 913          2HG2      ILE 913  -6.930   1.490   0.942
  605   3HG2  ILE 913          3HG2      ILE 913  -7.726   3.001   1.443
  606   1HD1  ILE 913          1HD1      ILE 913 -10.172   0.062  -1.078
  607   2HD1  ILE 913          2HD1      ILE 913  -8.829   0.139  -2.244
  608   3HD1  ILE 913          3HD1      ILE 913  -8.491   0.112  -0.496
  609    H    ARG 914           H        ARG 914  -8.899   4.266   1.629
  610    HA   ARG 914           HA       ARG 914 -11.648   4.637   0.965
  611   1HB   ARG 914          1HB       ARG 914 -10.609   3.828   3.166
  612   2HB   ARG 914          2HB       ARG 914 -10.283   5.542   3.518
  613   1HG   ARG 914          1HG       ARG 914 -12.599   4.304   4.208
  614   2HG   ARG 914          2HG       ARG 914 -12.502   6.040   3.828
  615   1HD   ARG 914          1HD       ARG 914 -13.113   5.592   1.496
  616   2HD   ARG 914          2HD       ARG 914 -13.129   3.844   1.813
  617    HE   ARG 914           HE       ARG 914 -14.904   4.939   3.656
  618   1HH1  ARG 914          2HH2      ARG 914 -14.531   4.873   0.141
  619   2HH1  ARG 914          1HH2      ARG 914 -16.248   4.973  -0.181
  620   1HH2  ARG 914          2HH1      ARG 914 -17.172   5.071   3.231
  621   2HH2  ARG 914          1HH1      ARG 914 -17.754   5.086   1.582
  622    H    LYS 915           H        LYS 915  -8.939   6.873   1.603
  623    HA   LYS 915           HA       LYS 915 -10.648   9.222   1.548
  624   1HB   LYS 915          1HB       LYS 915  -7.666   8.709   1.603
  625   2HB   LYS 915          2HB       LYS 915  -8.319  10.348   1.367
  626   1HG   LYS 915          1HG       LYS 915  -9.230   8.562   3.649
  627   2HG   LYS 915          2HG       LYS 915  -7.817   9.634   3.795
  628   1HD   LYS 915          1HD       LYS 915  -9.136  11.591   3.444
  629   2HD   LYS 915          2HD       LYS 915 -10.521  10.644   2.849
  630   1HE   LYS 915          1HE       LYS 915 -10.314   9.512   5.260
  631   2HE   LYS 915          2HE       LYS 915  -9.549  11.065   5.660
  632   1HZ   LYS 915          1HZ       LYS 915 -11.904  11.408   4.156
  633   2HZ   LYS 915          2HZ       LYS 915 -12.202  10.551   5.533
  634   3HZ   LYS 915          3HZ       LYS 915 -11.493  12.037   5.624
  635    H    ARG 916           H        ARG 916  -9.347   7.102  -0.794
  636    HA   ARG 916           HA       ARG 916  -9.386   7.171  -3.084
  637   1HB   ARG 916          1HB       ARG 916 -11.239   9.331  -2.277
  638   2HB   ARG 916          2HB       ARG 916 -10.534   9.533  -3.900
  639   1HG   ARG 916          1HG       ARG 916 -11.456   6.782  -3.208
  640   2HG   ARG 916          2HG       ARG 916 -12.733   8.006  -3.404
  641   1HD   ARG 916          1HD       ARG 916 -10.748   8.316  -5.489
  642   2HD   ARG 916          2HD       ARG 916 -11.312   6.632  -5.447
  643    HE   ARG 916           HE       ARG 916 -13.507   7.352  -5.969
  644   1HH1  ARG 916          2HH2      ARG 916 -11.197  10.012  -5.673
  645   2HH1  ARG 916          1HH2      ARG 916 -12.230  11.179  -6.468
  646   1HH2  ARG 916          2HH1      ARG 916 -14.872   8.893  -7.019
  647   2HH2  ARG 916          1HH1      ARG 916 -14.325  10.541  -7.236
  648    H    ARG 917           H        ARG 917  -7.796   9.335  -1.085
  649    HA   ARG 917           HA       ARG 917  -5.974  10.082  -3.294
  650   1HB   ARG 917          1HB       ARG 917  -5.962  12.355  -1.736
  651   2HB   ARG 917          2HB       ARG 917  -6.845  12.174  -3.270
  652   1HG   ARG 917          1HG       ARG 917  -8.169  11.151  -0.781
  653   2HG   ARG 917          2HG       ARG 917  -8.079  12.916  -0.999
  654   1HD   ARG 917          1HD       ARG 917  -8.941  12.433  -3.411
  655   2HD   ARG 917          2HD       ARG 917  -9.411  10.847  -2.763
  656    HE   ARG 917           HE       ARG 917 -11.182  11.856  -1.685
  657   1HH1  ARG 917          2HH2      ARG 917  -8.736  14.275  -2.500
  658   2HH1  ARG 917          1HH2      ARG 917  -9.705  15.632  -1.970
  659   1HH2  ARG 917          2HH1      ARG 917 -12.461  13.648  -0.985
  660   2HH2  ARG 917          1HH1      ARG 917 -11.829  15.275  -1.106
  661    H    LEU 918           H        LEU 918  -4.010   9.375  -2.728
  662    HA   LEU 918           HA       LEU 918  -3.200   8.194  -0.433
  663   1HB   LEU 918          1HB       LEU 918  -1.755   9.946  -2.411
  664   2HB   LEU 918          2HB       LEU 918  -0.887   9.341  -0.979
  665    HG   LEU 918           HG       LEU 918  -0.600   7.377  -2.050
  666   1HD1  LEU 918          1HD1      LEU 918  -2.505   6.570  -0.836
  667   2HD1  LEU 918          2HD1      LEU 918  -3.639   7.394  -1.933
  668   3HD1  LEU 918          3HD1      LEU 918  -2.705   5.991  -2.507
  669   1HD2  LEU 918          1HD2      LEU 918  -2.669   7.903  -4.168
  670   2HD2  LEU 918          2HD2      LEU 918  -1.233   8.954  -4.113
  671   3HD2  LEU 918          3HD2      LEU 918  -1.042   7.197  -4.320
  672    H    VAL 919           H        VAL 919  -3.086   8.710   1.666
  673    HA   VAL 919           HA       VAL 919  -3.235  11.574   2.400
  674    HB   VAL 919           HB       VAL 919  -4.376  10.891   4.249
  675   1HG1  VAL 919          1HG1      VAL 919  -5.880   9.234   3.668
  676   2HG1  VAL 919          2HG1      VAL 919  -5.120   9.493   2.080
  677   3HG1  VAL 919          3HG1      VAL 919  -4.606   8.128   3.101
  678   1HG2  VAL 919          1HG2      VAL 919  -3.639   8.303   4.987
  679   2HG2  VAL 919          2HG2      VAL 919  -2.118   9.015   4.398
  680   3HG2  VAL 919          3HG2      VAL 919  -3.023   9.809   5.709
  681    H    ALA 920           H        ALA 920  -2.145  11.373   4.990
  682    HA   ALA 920           HA       ALA 920   0.653  11.644   4.373
  683   1HB   ALA 920          1HB       ALA 920   0.401  12.952   6.184
  684   2HB   ALA 920          2HB       ALA 920  -1.171  12.210   6.566
  685   3HB   ALA 920          3HB       ALA 920   0.331  11.470   7.168
  686    HA   PRO 921           HA       PRO 921   1.462   7.269   4.846
  687   1HB   PRO 921          1HB       PRO 921   4.044   7.340   3.979
  688   2HB   PRO 921          2HB       PRO 921   2.664   7.569   2.857
  689   1HG   PRO 921          1HG       PRO 921   4.309   9.726   4.211
  690   2HG   PRO 921          2HG       PRO 921   3.942   9.574   2.462
  691   1HD   PRO 921          1HD       PRO 921   2.452  11.170   4.093
  692   2HD   PRO 921          2HD       PRO 921   1.666  10.191   2.818
  693    H    CYS 922           H        CYS 922   2.040   6.261   6.698
  694    HA   CYS 922           HA       CYS 922   4.354   7.105   8.233
  695   1HB   CYS 922          1HB       CYS 922   1.993   8.459   8.794
  696   2HB   CYS 922          2HB       CYS 922   1.995   7.138   9.988
  697    HG   CYS 922           HG       CYS 922   3.797   7.829  11.363
  Start of MODEL   11
    1    H    GLY 835           H        GLY 835 -12.900  -1.799  13.171
    2   1HA   GLY 835          1HA       GLY 835 -12.904  -3.282  11.166
    3   2HA   GLY 835          2HA       GLY 835 -14.543  -2.721  11.565
    4    H    SER 836           H        SER 836 -11.799  -0.925  10.097
    5    HA   SER 836           HA       SER 836 -13.478   0.291   8.128
    6   1HB   SER 836          1HB       SER 836 -11.063   0.726   7.109
    7   2HB   SER 836          2HB       SER 836 -11.593   1.552   8.594
    8    HG   SER 836           HG       SER 836  -9.505   0.020   8.312
    9    H    ALA 837           H        ALA 837 -10.648  -1.860   7.531
   10    HA   ALA 837           HA       ALA 837 -11.021  -2.525   4.944
   11   1HB   ALA 837          1HB       ALA 837 -10.618  -4.876   6.736
   12   2HB   ALA 837          2HB       ALA 837  -9.648  -4.311   5.354
   13   3HB   ALA 837          3HB       ALA 837  -9.487  -3.515   6.938
   14    H    ASP 838           H        ASP 838 -12.519  -4.513   7.565
   15    HA   ASP 838           HA       ASP 838 -14.146  -6.112   6.039
   16   1HB   ASP 838          1HB       ASP 838 -15.324  -6.539   7.991
   17   2HB   ASP 838          2HB       ASP 838 -13.822  -5.848   8.640
   18    H    GLU 839           H        GLU 839 -14.643  -2.686   6.891
   19    HA   GLU 839           HA       GLU 839 -17.251  -2.684   5.518
   20   1HB   GLU 839          1HB       GLU 839 -15.787  -0.952   7.427
   21   2HB   GLU 839          2HB       GLU 839 -16.739  -0.084   6.200
   22   1HG   GLU 839          1HG       GLU 839 -18.263  -2.334   7.172
   23   2HG   GLU 839          2HG       GLU 839 -17.682  -1.384   8.556
   24    H    THR 840           H        THR 840 -13.884  -1.953   4.956
   25    HA   THR 840           HA       THR 840 -14.565  -0.364   2.550
   26    HB   THR 840           HB       THR 840 -11.954  -0.916   4.007
   27    HG1  THR 840           1HG      THR 840 -12.820   0.685   5.075
   28   1HG2  THR 840          1HG2      THR 840 -12.364   0.998   1.690
   29   2HG2  THR 840          2HG2      THR 840 -10.837   0.394   2.376
   30   3HG2  THR 840          3HG2      THR 840 -11.876  -0.692   1.423
   31    H    LEU 841           H        LEU 841 -12.070  -2.855   3.308
   32    HA   LEU 841           HA       LEU 841 -11.826  -3.757   0.644
   33   1HB   LEU 841          1HB       LEU 841 -10.200  -4.164   2.499
   34   2HB   LEU 841          2HB       LEU 841 -11.351  -5.320   3.211
   35    HG   LEU 841           HG       LEU 841  -9.404  -6.042   1.452
   36   1HD1  LEU 841          1HD1      LEU 841 -10.369  -8.062   1.781
   37   2HD1  LEU 841          2HD1      LEU 841 -11.645  -7.197   2.670
   38   3HD1  LEU 841          3HD1      LEU 841 -11.858  -7.564   0.941
   39   1HD2  LEU 841          1HD2      LEU 841 -10.960  -4.519  -0.178
   40   2HD2  LEU 841          2HD2      LEU 841 -10.025  -5.921  -0.752
   41   3HD2  LEU 841          3HD2      LEU 841 -11.757  -6.098  -0.381
   42    H    CYS 842           H        CYS 842 -14.532  -3.873   2.542
   43    HA   CYS 842           HA       CYS 842 -15.492  -6.519   2.254
   44   1HB   CYS 842          1HB       CYS 842 -16.787  -5.272   3.703
   45   2HB   CYS 842          2HB       CYS 842 -16.685  -3.802   2.701
   46    HG   CYS 842           HG       CYS 842 -19.148  -4.535   2.714
   47    H    GLN 843           H        GLN 843 -14.705  -4.220  -0.116
   48    HA   GLN 843           HA       GLN 843 -16.633  -5.406  -2.048
   49   1HB   GLN 843          1HB       GLN 843 -14.924  -3.005  -2.646
   50   2HB   GLN 843          2HB       GLN 843 -16.552  -3.414  -3.236
   51   1HG   GLN 843          1HG       GLN 843 -16.672  -3.200  -0.380
   52   2HG   GLN 843          2HG       GLN 843 -15.821  -1.768  -0.998
   53   1HE2  GLN 843          1HE2      GLN 843 -17.696  -0.513  -0.292
   54   2HE2  GLN 843          2HE2      GLN 843 -19.129  -0.457  -1.296
   55    H    THR 844           H        THR 844 -14.635  -7.124  -1.350
   56    HA   THR 844           HA       THR 844 -12.729  -8.207  -2.082
   57    HB   THR 844           HB       THR 844 -14.690  -7.895  -4.197
   58    HG1  THR 844           1HG      THR 844 -12.739  -9.864  -3.574
   59   1HG2  THR 844          1HG2      THR 844 -12.967  -8.653  -5.997
   60   2HG2  THR 844          2HG2      THR 844 -13.074  -6.917  -5.620
   61   3HG2  THR 844          3HG2      THR 844 -11.752  -7.895  -4.940
   62    H    LYS 845           H        LYS 845 -10.881  -7.114  -1.589
   63    HA   LYS 845           HA       LYS 845  -9.230  -5.491  -1.755
   64   1HB   LYS 845          1HB       LYS 845  -9.446  -6.857  -4.443
   65   2HB   LYS 845          2HB       LYS 845  -8.197  -5.624  -4.143
   66   1HG   LYS 845          1HG       LYS 845  -7.440  -7.987  -3.667
   67   2HG   LYS 845          2HG       LYS 845  -7.312  -6.893  -2.269
   68   1HD   LYS 845          1HD       LYS 845  -9.916  -8.309  -2.566
   69   2HD   LYS 845          2HD       LYS 845  -8.519  -9.337  -2.166
   70   1HE   LYS 845          1HE       LYS 845  -8.298  -6.995  -0.566
   71   2HE   LYS 845          2HE       LYS 845  -9.991  -7.522  -0.462
   72   1HZ   LYS 845          1HZ       LYS 845  -8.073  -8.515   1.015
   73   2HZ   LYS 845          2HZ       LYS 845  -9.411  -9.377   0.583
   74   3HZ   LYS 845          3HZ       LYS 845  -7.998  -9.579  -0.243
   75    H    VAL 846           H        VAL 846 -12.184  -4.972  -3.225
   76    HA   VAL 846           HA       VAL 846 -12.993  -3.232  -4.594
   77    HB   VAL 846           HB       VAL 846 -13.551  -1.607  -3.089
   78   1HG1  VAL 846          1HG1      VAL 846 -12.089  -2.855  -0.857
   79   2HG1  VAL 846          2HG1      VAL 846 -13.842  -2.713  -1.130
   80   3HG1  VAL 846          3HG1      VAL 846 -12.927  -4.038  -1.889
   81   1HG2  VAL 846          1HG2      VAL 846 -10.634  -1.581  -2.202
   82   2HG2  VAL 846          2HG2      VAL 846 -11.398  -0.429  -3.324
   83   3HG2  VAL 846          3HG2      VAL 846 -11.899  -0.474  -1.617
   84    H    LEU 847           H        LEU 847  -9.840  -2.139  -3.204
   85    HA   LEU 847           HA       LEU 847  -7.980  -1.333  -4.315
   86   1HB   LEU 847          1HB       LEU 847  -9.600  -1.449  -6.883
   87   2HB   LEU 847          2HB       LEU 847  -7.830  -1.373  -6.711
   88    HG   LEU 847           HG       LEU 847  -8.422  -3.673  -7.183
   89   1HD1  LEU 847          1HD1      LEU 847  -8.087  -3.678  -4.180
   90   2HD1  LEU 847          2HD1      LEU 847  -7.310  -4.714  -5.401
   91   3HD1  LEU 847          3HD1      LEU 847  -6.800  -3.019  -5.218
   92   1HD2  LEU 847          1HD2      LEU 847 -10.023  -4.911  -5.767
   93   2HD2  LEU 847          2HD2      LEU 847 -10.322  -3.440  -4.809
   94   3HD2  LEU 847          3HD2      LEU 847 -10.809  -3.502  -6.520
   95    H    LEU 848           H        LEU 848  -9.212   0.277  -6.945
   96    HA   LEU 848           HA       LEU 848 -10.299   2.368  -7.162
   97   1HB   LEU 848          1HB       LEU 848 -10.182   2.104  -4.223
   98   2HB   LEU 848          2HB       LEU 848  -9.976   3.771  -4.812
   99    HG   LEU 848           HG       LEU 848 -12.195   1.942  -5.799
  100   1HD1  LEU 848          1HD1      LEU 848 -12.713   2.129  -3.505
  101   2HD1  LEU 848          2HD1      LEU 848 -12.044   3.775  -3.394
  102   3HD1  LEU 848          3HD1      LEU 848 -13.591   3.498  -4.230
  103   1HD2  LEU 848          1HD2      LEU 848 -12.048   3.701  -7.309
  104   2HD2  LEU 848          2HD2      LEU 848 -13.140   4.416  -6.099
  105   3HD2  LEU 848          3HD2      LEU 848 -11.409   4.831  -6.092
  106    H    ASP 849           H        ASP 849  -9.414   4.655  -7.173
  107    HA   ASP 849           HA       ASP 849  -6.575   4.514  -7.776
  108   1HB   ASP 849          1HB       ASP 849  -6.926   6.943  -8.336
  109   2HB   ASP 849          2HB       ASP 849  -8.005   5.828  -9.203
  110    H    ILE 850           H        ILE 850  -6.551   3.794  -5.239
  111    HA   ILE 850           HA       ILE 850  -6.378   6.104  -3.457
  112    HB   ILE 850           HB       ILE 850  -5.252   3.521  -2.570
  113   1HG1  ILE 850          1HG1      ILE 850  -7.293   3.213  -4.345
  114   2HG1  ILE 850          2HG1      ILE 850  -7.046   2.144  -2.943
  115   1HG2  ILE 850          1HG2      ILE 850  -7.454   5.405  -1.627
  116   2HG2  ILE 850          2HG2      ILE 850  -6.920   3.961  -0.734
  117   3HG2  ILE 850          3HG2      ILE 850  -5.789   5.308  -1.006
  118   1HD1  ILE 850          1HD1      ILE 850  -9.305   2.769  -2.726
  119   2HD1  ILE 850          2HD1      ILE 850  -8.475   3.919  -1.650
  120   3HD1  ILE 850          3HD1      ILE 850  -8.996   4.434  -3.273
  121    H    PHE 851           H        PHE 851  -3.973   3.545  -3.296
  122    HA   PHE 851           HA       PHE 851  -1.807   5.304  -2.982
  123   1HB   PHE 851          1HB       PHE 851  -1.564   2.549  -4.195
  124   2HB   PHE 851          2HB       PHE 851  -0.445   3.383  -3.104
  125    HD1  PHE 851           1HD      PHE 851  -3.459   1.328  -3.358
  126    HD2  PHE 851           2HD      PHE 851  -0.963   3.587  -0.691
  127    HE1  PHE 851           1HE      PHE 851  -4.522   0.209  -1.416
  128    HE2  PHE 851           2HE      PHE 851  -2.025   2.468   1.251
  129    HZ   PHE 851           HZ       PHE 851  -3.805   0.779   0.888
  130    H    THR 852           H        THR 852  -3.564   5.847  -5.388
  131    HA   THR 852           HA       THR 852  -2.681   5.328  -7.849
  132    HB   THR 852           HB       THR 852  -4.100   7.372  -6.758
  133    HG1  THR 852           1HG      THR 852  -4.409   7.951  -8.860
  134   1HG2  THR 852          1HG2      THR 852  -2.080   8.648  -6.162
  135   2HG2  THR 852          2HG2      THR 852  -1.515   8.566  -7.848
  136   3HG2  THR 852          3HG2      THR 852  -2.983   9.489  -7.445
  137    H    GLY 853           H        GLY 853  -0.656   4.735  -8.430
  138   1HA   GLY 853          1HA       GLY 853   1.536   5.075  -9.068
  139   2HA   GLY 853          2HA       GLY 853   1.405   6.765  -8.529
  140    H    VAL 854           H        VAL 854   0.568   6.244  -5.829
  141    HA   VAL 854           HA       VAL 854   2.837   6.277  -4.373
  142    HB   VAL 854           HB       VAL 854   0.133   5.065  -3.816
  143   1HG1  VAL 854          1HG1      VAL 854   0.757   4.506  -1.572
  144   2HG1  VAL 854          2HG1      VAL 854   1.983   3.751  -2.619
  145   3HG1  VAL 854          3HG1      VAL 854   2.358   5.261  -1.754
  146   1HG2  VAL 854          1HG2      VAL 854   1.514   7.608  -3.503
  147   2HG2  VAL 854          2HG2      VAL 854  -0.213   7.232  -3.292
  148   3HG2  VAL 854          3HG2      VAL 854   0.916   7.022  -1.933
  149    H    ARG 855           H        ARG 855   4.631   5.067  -4.546
  150    HA   ARG 855           HA       ARG 855   4.311   2.146  -4.983
  151   1HB   ARG 855          1HB       ARG 855   6.416   2.175  -6.001
  152   2HB   ARG 855          2HB       ARG 855   5.739   3.746  -6.491
  153   1HG   ARG 855          1HG       ARG 855   6.861   4.672  -4.340
  154   2HG   ARG 855          2HG       ARG 855   7.795   3.157  -4.342
  155   1HD   ARG 855          1HD       ARG 855   8.884   5.127  -5.544
  156   2HD   ARG 855          2HD       ARG 855   8.737   3.631  -6.491
  157    HE   ARG 855           HE       ARG 855   6.757   4.647  -7.592
  158   1HH1  ARG 855          2HH2      ARG 855   9.036   6.717  -5.854
  159   2HH1  ARG 855          1HH2      ARG 855   8.622   8.160  -6.753
  160   1HH2  ARG 855          2HH1      ARG 855   6.211   6.553  -8.779
  161   2HH2  ARG 855          1HH1      ARG 855   7.011   8.066  -8.421
  162    H    LEU 856           H        LEU 856   3.784   1.632  -2.794
  163    HA   LEU 856           HA       LEU 856   5.919   2.199  -0.811
  164   1HB   LEU 856          1HB       LEU 856   4.284   2.203   0.765
  165   2HB   LEU 856          2HB       LEU 856   3.195   2.441  -0.622
  166    HG   LEU 856           HG       LEU 856   2.754   0.067  -0.773
  167   1HD1  LEU 856          1HD1      LEU 856   3.937  -1.190   1.372
  168   2HD1  LEU 856          2HD1      LEU 856   4.563  -1.232  -0.293
  169   3HD1  LEU 856          3HD1      LEU 856   5.216  -0.057   0.873
  170   1HD2  LEU 856          1HD2      LEU 856   2.731   0.461   2.210
  171   2HD2  LEU 856          2HD2      LEU 856   1.803   1.592   1.197
  172   3HD2  LEU 856          3HD2      LEU 856   1.450  -0.151   1.137
  173    H    TYR 857           H        TYR 857   7.097   0.575   0.140
  174    HA   TYR 857           HA       TYR 857   7.130  -1.976  -1.253
  175   1HB   TYR 857          1HB       TYR 857   9.268  -1.615  -0.669
  176   2HB   TYR 857          2HB       TYR 857   8.818  -0.444   0.583
  177    HD1  TYR 857           1HD      TYR 857   8.138  -4.120   0.171
  178    HD2  TYR 857           2HD      TYR 857   9.855  -1.002   2.576
  179    HE1  TYR 857           1HE      TYR 857   8.697  -5.781   1.925
  180    HE2  TYR 857           2HE      TYR 857  10.414  -2.664   4.330
  181    HH   TYR 857           HH       TYR 857  10.633  -5.814   3.962
  182    H    LEU 858           H        LEU 858   5.235  -3.097  -0.832
  183    HA   LEU 858           HA       LEU 858   4.213  -3.353   1.873
  184   1HB   LEU 858          1HB       LEU 858   2.797  -3.379  -0.199
  185   2HB   LEU 858          2HB       LEU 858   3.530  -4.944  -0.629
  186    HG   LEU 858           HG       LEU 858   2.269  -6.067   0.887
  187   1HD1  LEU 858          1HD1      LEU 858   3.594  -5.337   2.771
  188   2HD1  LEU 858          2HD1      LEU 858   2.841  -3.724   2.746
  189   3HD1  LEU 858          3HD1      LEU 858   1.883  -5.147   3.223
  190   1HD2  LEU 858          1HD2      LEU 858   0.732  -3.546   1.503
  191   2HD2  LEU 858          2HD2      LEU 858   0.746  -4.172  -0.163
  192   3HD2  LEU 858          3HD2      LEU 858   0.126  -5.185   1.162
  193    HA   PRO 859           HA       PRO 859   7.141  -6.621   2.782
  194   1HB   PRO 859          1HB       PRO 859   6.600  -6.775   5.448
  195   2HB   PRO 859          2HB       PRO 859   7.484  -5.383   4.741
  196   1HG   PRO 859          1HG       PRO 859   4.518  -5.564   5.340
  197   2HG   PRO 859          2HG       PRO 859   5.655  -4.276   5.855
  198   1HD   PRO 859          1HD       PRO 859   4.110  -4.000   3.627
  199   2HD   PRO 859          2HD       PRO 859   5.806  -3.429   3.631
  200    HA   PRO 860           HA       PRO 860   4.349 -10.034   2.486
  201   1HB   PRO 860          1HB       PRO 860   6.056 -12.082   3.048
  202   2HB   PRO 860          2HB       PRO 860   6.230 -11.085   1.566
  203   1HG   PRO 860          1HG       PRO 860   7.682 -10.728   4.204
  204   2HG   PRO 860          2HG       PRO 860   8.410 -10.844   2.568
  205   1HD   PRO 860          1HD       PRO 860   7.906  -8.431   3.732
  206   2HD   PRO 860          2HD       PRO 860   7.605  -8.676   1.985
  207    H    SER 861           H        SER 861   6.166  -9.203   5.375
  208    HA   SER 861           HA       SER 861   4.885 -11.154   7.091
  209   1HB   SER 861          1HB       SER 861   7.002  -9.215   7.246
  210   2HB   SER 861          2HB       SER 861   5.856  -8.915   8.574
  211    HG   SER 861           HG       SER 861   5.975 -11.287   8.876
  212    H    THR 862           H        THR 862   4.004  -8.109   5.703
  213    HA   THR 862           HA       THR 862   2.282  -7.132   7.751
  214    HB   THR 862           HB       THR 862   3.080  -6.408   5.121
  215    HG1  THR 862           1HG      THR 862   2.829  -4.603   6.133
  216   1HG2  THR 862          1HG2      THR 862   0.109  -6.885   5.463
  217   2HG2  THR 862          2HG2      THR 862   0.705  -5.583   4.406
  218   3HG2  THR 862          3HG2      THR 862   1.152  -7.274   4.074
  219    HA   PRO 863           HA       PRO 863  -1.086  -9.953   7.510
  220   1HB   PRO 863          1HB       PRO 863  -3.042  -8.451   8.668
  221   2HB   PRO 863          2HB       PRO 863  -1.610  -9.012   9.591
  222   1HG   PRO 863          1HG       PRO 863  -1.991  -6.323   8.244
  223   2HG   PRO 863          2HG       PRO 863  -1.507  -6.629   9.944
  224   1HD   PRO 863          1HD       PRO 863   0.345  -6.148   8.003
  225   2HD   PRO 863          2HD       PRO 863   0.650  -7.383   9.262
  226    H    ASP 864           H        ASP 864  -2.843 -10.411   6.164
  227    HA   ASP 864           HA       ASP 864  -4.234 -10.194   4.359
  228   1HB   ASP 864          1HB       ASP 864  -4.402  -7.689   5.786
  229   2HB   ASP 864          2HB       ASP 864  -4.513  -7.386   4.038
  230    H    PHE 865           H        PHE 865  -1.105  -9.453   4.415
  231    HA   PHE 865           HA       PHE 865  -0.426  -7.815   2.313
  232   1HB   PHE 865          1HB       PHE 865   1.164  -9.014   3.762
  233   2HB   PHE 865          2HB       PHE 865   0.736 -10.542   2.973
  234    HD1  PHE 865           1HD      PHE 865   1.935 -11.271   1.108
  235    HD2  PHE 865           2HD      PHE 865   2.099  -7.129   2.233
  236    HE1  PHE 865           1HE      PHE 865   3.685 -10.876  -0.605
  237    HE2  PHE 865           2HE      PHE 865   3.849  -6.733   0.520
  238    HZ   PHE 865           HZ       PHE 865   4.641  -8.607  -0.899
  239    H    SER 866           H        SER 866  -1.244 -11.322   2.058
  240    HA   SER 866           HA       SER 866  -1.002 -11.887  -0.542
  241   1HB   SER 866          1HB       SER 866  -2.133 -13.333   1.130
  242   2HB   SER 866          2HB       SER 866  -3.585 -12.310   1.012
  243    HG   SER 866           HG       SER 866  -2.815 -12.962  -1.444
  244    H    ARG 867           H        ARG 867  -3.352  -9.576   0.795
  245    HA   ARG 867           HA       ARG 867  -4.386  -9.043  -1.927
  246   1HB   ARG 867          1HB       ARG 867  -5.354  -7.577   0.499
  247   2HB   ARG 867          2HB       ARG 867  -6.263  -8.191  -0.903
  248   1HG   ARG 867          1HG       ARG 867  -5.087  -9.849   1.369
  249   2HG   ARG 867          2HG       ARG 867  -6.813  -9.534   1.069
  250   1HD   ARG 867          1HD       ARG 867  -5.862 -10.511  -1.376
  251   2HD   ARG 867          2HD       ARG 867  -5.030 -11.508  -0.162
  252    HE   ARG 867           HE       ARG 867  -7.587 -11.556   0.746
  253   1HH1  ARG 867          2HH2      ARG 867  -6.166 -12.057  -2.452
  254   2HH1  ARG 867          1HH2      ARG 867  -7.402 -13.180  -2.975
  255   1HH2  ARG 867          2HH1      ARG 867  -9.219 -13.039   0.055
  256   2HH2  ARG 867          1HH1      ARG 867  -9.142 -13.740  -1.546
  257    H    LEU 868           H        LEU 868  -3.309  -7.116   0.936
  258    HA   LEU 868           HA       LEU 868  -3.015  -4.644  -0.018
  259   1HB   LEU 868          1HB       LEU 868  -0.883  -6.244   1.447
  260   2HB   LEU 868          2HB       LEU 868  -0.857  -4.473   1.264
  261    HG   LEU 868           HG       LEU 868  -3.268  -5.924   2.401
  262   1HD1  LEU 868          1HD1      LEU 868  -1.061  -6.391   3.662
  263   2HD1  LEU 868          2HD1      LEU 868  -1.063  -4.655   4.057
  264   3HD1  LEU 868          3HD1      LEU 868  -2.400  -5.695   4.605
  265   1HD2  LEU 868          1HD2      LEU 868  -2.271  -3.136   3.024
  266   2HD2  LEU 868          2HD2      LEU 868  -3.205  -3.451   1.542
  267   3HD2  LEU 868          3HD2      LEU 868  -3.924  -3.786   3.135
  268    H    ARG 869           H        ARG 869  -0.695  -7.289  -0.785
  269    HA   ARG 869           HA       ARG 869   0.928  -5.706  -2.516
  270   1HB   ARG 869          1HB       ARG 869   0.988  -8.272  -1.436
  271   2HB   ARG 869          2HB       ARG 869   0.777  -8.559  -3.180
  272   1HG   ARG 869          1HG       ARG 869   2.646  -6.589  -3.260
  273   2HG   ARG 869          2HG       ARG 869   3.071  -7.346  -1.706
  274   1HD   ARG 869          1HD       ARG 869   2.717  -9.573  -3.201
  275   2HD   ARG 869          2HD       ARG 869   3.219  -8.448  -4.480
  276    HE   ARG 869           HE       ARG 869   5.094  -8.001  -2.556
  277   1HH1  ARG 869          2HH2      ARG 869   3.796 -10.933  -4.045
  278   2HH1  ARG 869          1HH2      ARG 869   5.280 -11.844  -3.867
  279   1HH2  ARG 869          2HH1      ARG 869   7.053  -9.204  -2.322
  280   2HH2  ARG 869          1HH1      ARG 869   7.136 -10.858  -2.885
  281    H    ARG 870           H        ARG 870  -0.966  -8.533  -3.638
  282    HA   ARG 870           HA       ARG 870  -1.179  -7.824  -6.285
  283   1HB   ARG 870          1HB       ARG 870  -1.953  -9.961  -5.203
  284   2HB   ARG 870          2HB       ARG 870  -3.405  -9.095  -4.648
  285   1HG   ARG 870          1HG       ARG 870  -4.087 -10.091  -6.684
  286   2HG   ARG 870          2HG       ARG 870  -3.696  -8.416  -7.142
  287   1HD   ARG 870          1HD       ARG 870  -2.618  -9.750  -8.782
  288   2HD   ARG 870          2HD       ARG 870  -1.325  -9.293  -7.652
  289    HE   ARG 870           HE       ARG 870  -2.547 -11.971  -7.969
  290   1HH1  ARG 870          2HH2      ARG 870  -0.290  -9.812  -6.311
  291   2HH1  ARG 870          1HH2      ARG 870   0.644 -11.109  -5.602
  292   1HH2  ARG 870          2HH1      ARG 870  -1.312 -13.685  -7.032
  293   2HH2  ARG 870          1HH1      ARG 870   0.062 -13.318  -6.013
  294    H    TYR 871           H        TYR 871  -3.091  -6.609  -3.538
  295    HA   TYR 871           HA       TYR 871  -5.032  -5.227  -5.139
  296   1HB   TYR 871          1HB       TYR 871  -5.086  -5.929  -2.643
  297   2HB   TYR 871          2HB       TYR 871  -4.167  -4.443  -2.354
  298    HD1  TYR 871           1HD      TYR 871  -6.897  -5.035  -1.201
  299    HD2  TYR 871           2HD      TYR 871  -5.702  -3.067  -4.827
  300    HE1  TYR 871           1HE      TYR 871  -9.007  -3.731  -1.189
  301    HE2  TYR 871           2HE      TYR 871  -7.811  -1.763  -4.815
  302    HH   TYR 871           HH       TYR 871 -10.216  -2.066  -2.190
  303    H    PHE 872           H        PHE 872  -2.394  -3.879  -3.069
  304    HA   PHE 872           HA       PHE 872  -2.413  -1.283  -3.922
  305   1HB   PHE 872          1HB       PHE 872  -0.864  -2.522  -2.265
  306   2HB   PHE 872          2HB       PHE 872   0.176  -2.820  -3.668
  307    HD1  PHE 872           1HD      PHE 872  -0.445  -0.643  -0.985
  308    HD2  PHE 872           2HD      PHE 872   0.670  -0.631  -5.133
  309    HE1  PHE 872           1HE      PHE 872   0.569   1.603  -0.706
  310    HE2  PHE 872           2HE      PHE 872   1.684   1.615  -4.854
  311    HZ   PHE 872           HZ       PHE 872   1.634   2.732  -2.640
  312    H    VAL 873           H        VAL 873   0.293  -3.172  -5.235
  313    HA   VAL 873           HA       VAL 873   0.844  -1.810  -7.474
  314    HB   VAL 873           HB       VAL 873   2.185  -3.654  -7.356
  315   1HG1  VAL 873          1HG1      VAL 873   1.299  -5.935  -6.744
  316   2HG1  VAL 873          2HG1      VAL 873   0.994  -4.693  -5.507
  317   3HG1  VAL 873          3HG1      VAL 873  -0.319  -5.211  -6.590
  318   1HG2  VAL 873          1HG2      VAL 873   0.155  -5.185  -8.956
  319   2HG2  VAL 873          2HG2      VAL 873   0.726  -3.627  -9.601
  320   3HG2  VAL 873          3HG2      VAL 873   1.889  -4.932  -9.265
  321    H    ALA 874           H        ALA 874  -2.019  -3.863  -7.010
  322    HA   ALA 874           HA       ALA 874  -2.901  -3.933  -9.700
  323   1HB   ALA 874          1HB       ALA 874  -5.217  -3.938  -8.232
  324   2HB   ALA 874          2HB       ALA 874  -4.186  -5.365  -8.494
  325   3HB   ALA 874          3HB       ALA 874  -4.023  -4.411  -7.000
  326    H    PHE 875           H        PHE 875  -4.265  -1.892  -7.050
  327    HA   PHE 875           HA       PHE 875  -5.885  -0.193  -8.244
  328   1HB   PHE 875          1HB       PHE 875  -3.494   0.751  -6.628
  329   2HB   PHE 875          2HB       PHE 875  -4.998   1.652  -6.881
  330    HD1  PHE 875           1HD      PHE 875  -3.428  -1.207  -5.159
  331    HD2  PHE 875           2HD      PHE 875  -7.040   1.050  -5.713
  332    HE1  PHE 875           1HE      PHE 875  -4.417  -2.300  -3.163
  333    HE2  PHE 875           2HE      PHE 875  -8.029  -0.041  -3.717
  334    HZ   PHE 875           HZ       PHE 875  -6.717  -1.716  -2.443
  335    H    ASP 876           H        ASP 876  -2.312   0.113  -8.611
  336    HA   ASP 876           HA       ASP 876  -1.931   0.511 -11.189
  337   1HB   ASP 876          1HB       ASP 876  -3.706   2.681 -10.223
  338   2HB   ASP 876          2HB       ASP 876  -2.333   3.215 -11.216
  339    H    GLY 877           H        GLY 877  -0.998   0.721  -8.152
  340   1HA   GLY 877          1HA       GLY 877   1.085   2.788  -8.461
  341   2HA   GLY 877          2HA       GLY 877   0.715   1.850  -6.996
  342    H    ASP 878           H        ASP 878   2.677   0.937  -6.519
  343    HA   ASP 878           HA       ASP 878   3.559  -1.255  -8.192
  344   1HB   ASP 878          1HB       ASP 878   4.963   1.381  -8.236
  345   2HB   ASP 878          2HB       ASP 878   5.976  -0.074  -8.119
  346    H    LEU 879           H        LEU 879   5.095  -2.601  -7.099
  347    HA   LEU 879           HA       LEU 879   5.590  -1.831  -4.266
  348   1HB   LEU 879          1HB       LEU 879   4.776  -4.599  -5.222
  349   2HB   LEU 879          2HB       LEU 879   4.979  -4.047  -3.542
  350    HG   LEU 879           HG       LEU 879   2.812  -3.331  -5.531
  351   1HD1  LEU 879          1HD1      LEU 879   1.673  -3.594  -3.066
  352   2HD1  LEU 879          2HD1      LEU 879   1.908  -4.952  -4.192
  353   3HD1  LEU 879          3HD1      LEU 879   3.081  -4.669  -2.884
  354   1HD2  LEU 879          1HD2      LEU 879   2.395  -1.771  -3.239
  355   2HD2  LEU 879          2HD2      LEU 879   4.126  -1.564  -3.599
  356   3HD2  LEU 879          3HD2      LEU 879   2.907  -1.180  -4.838
  357    H    VAL 880           H        VAL 880   7.689  -1.958  -3.740
  358    HA   VAL 880           HA       VAL 880   9.453  -3.558  -5.527
  359    HB   VAL 880           HB       VAL 880  10.793  -1.704  -3.716
  360   1HG1  VAL 880          1HG1      VAL 880  12.001  -1.189  -5.663
  361   2HG1  VAL 880          2HG1      VAL 880  11.469  -2.858  -5.978
  362   3HG1  VAL 880          3HG1      VAL 880  10.607  -1.493  -6.726
  363   1HG2  VAL 880          1HG2      VAL 880   9.094  -0.144  -3.745
  364   2HG2  VAL 880          2HG2      VAL 880   9.843   0.248  -5.312
  365   3HG2  VAL 880          3HG2      VAL 880   8.391  -0.781  -5.251
  366    H    GLN 881           H        GLN 881  10.829  -5.086  -4.666
  367    HA   GLN 881           HA       GLN 881  10.087  -6.250  -2.164
  368   1HB   GLN 881          1HB       GLN 881  12.654  -6.700  -3.726
  369   2HB   GLN 881          2HB       GLN 881  11.834  -7.832  -2.623
  370   1HG   GLN 881          1HG       GLN 881  10.440  -8.539  -4.250
  371   2HG   GLN 881          2HG       GLN 881  10.035  -6.873  -4.717
  372   1HE2  GLN 881          1HE2      GLN 881  10.586  -6.310  -6.741
  373   2HE2  GLN 881          2HE2      GLN 881  11.899  -7.001  -7.671
  374    H    GLU 882           H        GLU 882  10.830  -5.923  -0.133
  375    HA   GLU 882           HA       GLU 882  11.936  -3.765   0.906
  376   1HB   GLU 882          1HB       GLU 882  11.433  -5.865   2.159
  377   2HB   GLU 882          2HB       GLU 882  12.982  -6.538   1.599
  378   1HG   GLU 882          1HG       GLU 882  13.985  -4.309   2.575
  379   2HG   GLU 882          2HG       GLU 882  12.469  -4.249   3.500
  380    H    PHE 883           H        PHE 883  14.222  -6.424   0.053
  381    HA   PHE 883           HA       PHE 883  16.473  -4.655   0.010
  382   1HB   PHE 883          1HB       PHE 883  17.691  -6.570  -0.779
  383   2HB   PHE 883          2HB       PHE 883  16.536  -7.113   0.450
  384    HD1  PHE 883           1HD      PHE 883  14.609  -8.485  -0.149
  385    HD2  PHE 883           2HD      PHE 883  17.424  -7.184  -3.121
  386    HE1  PHE 883           1HE      PHE 883  13.693 -10.149  -1.744
  387    HE2  PHE 883           2HE      PHE 883  16.509  -8.848  -4.716
  388    HZ   PHE 883           HZ       PHE 883  14.643 -10.331  -4.027
  389    H    ASP 884           H        ASP 884  13.982  -4.210  -1.826
  390    HA   ASP 884           HA       ASP 884  15.601  -3.410  -4.157
  391   1HB   ASP 884          1HB       ASP 884  13.135  -5.182  -4.307
  392   2HB   ASP 884          2HB       ASP 884  13.877  -4.365  -5.700
  393    H    MET 885           H        MET 885  15.275  -1.264  -3.448
  394    HA   MET 885           HA       MET 885  12.580  -0.240  -4.080
  395   1HB   MET 885          1HB       MET 885  13.133   1.286  -1.906
  396   2HB   MET 885          2HB       MET 885  12.148  -0.195  -1.837
  397   1HG   MET 885          1HG       MET 885  14.353  -1.452  -1.474
  398   2HG   MET 885          2HG       MET 885  15.093   0.133  -1.197
  399   1HE   MET 885          1HE       MET 885  12.527  -2.354  -0.430
  400   2HE   MET 885          2HE       MET 885  12.444  -2.439   1.346
  401   3HE   MET 885          3HE       MET 885  11.393  -1.308   0.459
  402    H    THR 886           H        THR 886  16.037   0.262  -3.422
  403    HA   THR 886           HA       THR 886  16.891   2.630  -3.654
  404    HB   THR 886           HB       THR 886  18.428   2.128  -5.377
  405    HG1  THR 886           1HG      THR 886  16.605   0.225  -6.415
  406   1HG2  THR 886          1HG2      THR 886  18.343   0.472  -3.460
  407   2HG2  THR 886          2HG2      THR 886  17.375  -0.594  -4.507
  408   3HG2  THR 886          3HG2      THR 886  19.045  -0.177  -4.961
  409    H    SER 887           H        SER 887  14.980   1.403  -6.460
  410    HA   SER 887           HA       SER 887  14.553   4.199  -7.317
  411   1HB   SER 887          1HB       SER 887  14.580   1.533  -8.580
  412   2HB   SER 887          2HB       SER 887  13.232   2.567  -9.111
  413    HG   SER 887           HG       SER 887  15.087   4.220  -9.180
  414    H    ALA 888           H        ALA 888  13.074   1.739  -5.448
  415    HA   ALA 888           HA       ALA 888  10.375   1.881  -5.981
  416   1HB   ALA 888          1HB       ALA 888  11.077   0.434  -4.253
  417   2HB   ALA 888          2HB       ALA 888  11.928   1.736  -3.387
  418   3HB   ALA 888          3HB       ALA 888  10.149   1.696  -3.407
  419    H    THR 889           H        THR 889   8.784   3.044  -4.265
  420    HA   THR 889           HA       THR 889   9.559   5.916  -4.164
  421    HB   THR 889           HB       THR 889   7.843   4.928  -6.041
  422    HG1  THR 889           1HG      THR 889   7.557   7.390  -4.654
  423   1HG2  THR 889          1HG2      THR 889   5.966   6.051  -3.968
  424   2HG2  THR 889          2HG2      THR 889   5.616   4.994  -5.356
  425   3HG2  THR 889          3HG2      THR 889   6.391   4.324  -3.901
  426    H    HIS 890           H        HIS 890   7.396   3.295  -3.019
  427    HA   HIS 890           HA       HIS 890   7.204   4.770  -0.434
  428   1HB   HIS 890          1HB       HIS 890   5.125   3.248  -2.014
  429   2HB   HIS 890          2HB       HIS 890   4.970   3.474  -0.262
  430    HD1  HIS 890           1HD      HIS 890   6.237   6.211  -2.677
  431    HD2  HIS 890           2HD      HIS 890   2.958   5.183  -0.246
  432    HE1  HIS 890           1HE      HIS 890   4.699   8.254  -2.613
  433    H    VAL 891           H        VAL 891   6.854   3.333   1.454
  434    HA   VAL 891           HA       VAL 891   7.611   0.520   1.079
  435    HB   VAL 891           HB       VAL 891   9.446   0.850   2.852
  436   1HG1  VAL 891          1HG1      VAL 891  10.825   0.609   1.082
  437   2HG1  VAL 891          2HG1      VAL 891   9.440   0.984   0.030
  438   3HG1  VAL 891          3HG1      VAL 891  10.531   2.286   0.562
  439   1HG2  VAL 891          1HG2      VAL 891  10.466   3.112   2.872
  440   2HG2  VAL 891          2HG2      VAL 891   9.141   3.713   1.847
  441   3HG2  VAL 891          3HG2      VAL 891   8.800   3.146   3.500
  442    H    LEU 892           H        LEU 892   6.324  -0.638   2.378
  443    HA   LEU 892           HA       LEU 892   4.755   0.679   4.430
  444   1HB   LEU 892          1HB       LEU 892   4.513  -1.602   2.833
  445   2HB   LEU 892          2HB       LEU 892   4.755  -2.246   4.474
  446    HG   LEU 892           HG       LEU 892   2.953   0.053   4.492
  447   1HD1  LEU 892          1HD1      LEU 892   1.857  -0.382   2.547
  448   2HD1  LEU 892          2HD1      LEU 892   2.610  -1.986   2.378
  449   3HD1  LEU 892          3HD1      LEU 892   1.182  -1.779   3.419
  450   1HD2  LEU 892          1HD2      LEU 892   2.827  -2.874   5.308
  451   2HD2  LEU 892          2HD2      LEU 892   3.051  -1.452   6.356
  452   3HD2  LEU 892          3HD2      LEU 892   1.479  -1.742   5.573
  453    H    GLY 893           H        GLY 893   5.430   1.076   6.449
  454   1HA   GLY 893          1HA       GLY 893   6.602   0.910   8.416
  455   2HA   GLY 893          2HA       GLY 893   6.579  -0.849   8.152
  456    H    SER 894           H        SER 894   8.575   1.805   8.554
  457    HA   SER 894           HA       SER 894  10.873   1.938   8.505
  458   1HB   SER 894          1HB       SER 894  10.462  -0.884   7.544
  459   2HB   SER 894          2HB       SER 894  12.062  -0.128   7.353
  460    HG   SER 894           HG       SER 894  10.769  -0.979   9.615
  461    H    ARG 895           H        ARG 895  12.703   2.088   6.818
  462    HA   ARG 895           HA       ARG 895  11.689   2.383   4.063
  463   1HB   ARG 895          1HB       ARG 895  12.662   4.699   3.960
  464   2HB   ARG 895          2HB       ARG 895  11.232   4.566   5.011
  465   1HG   ARG 895          1HG       ARG 895  12.540   4.629   6.990
  466   2HG   ARG 895          2HG       ARG 895  14.042   4.259   6.111
  467   1HD   ARG 895          1HD       ARG 895  13.038   6.586   4.888
  468   2HD   ARG 895          2HD       ARG 895  12.781   6.840   6.628
  469    HE   ARG 895           HE       ARG 895  15.398   5.830   6.284
  470   1HH1  ARG 895          2HH2      ARG 895  13.470   8.681   5.475
  471   2HH1  ARG 895          1HH2      ARG 895  14.834   9.777   5.488
  472   1HH2  ARG 895          2HH1      ARG 895  17.200   7.277   6.300
  473   2HH2  ARG 895          1HH1      ARG 895  16.961   8.976   5.958
  474    H    ASP 896           H        ASP 896  14.318   2.318   6.442
  475    HA   ASP 896           HA       ASP 896  16.662   2.599   5.450
  476   1HB   ASP 896          1HB       ASP 896  16.613   1.115   7.254
  477   2HB   ASP 896          2HB       ASP 896  15.512  -0.011   6.429
  478    H    LYS 897           H        LYS 897  15.251  -0.510   4.319
  479    HA   LYS 897           HA       LYS 897  16.777  -1.071   2.191
  480   1HB   LYS 897          1HB       LYS 897  14.142  -1.337   1.168
  481   2HB   LYS 897          2HB       LYS 897  15.128  -2.578   1.979
  482   1HG   LYS 897          1HG       LYS 897  13.196  -2.476   3.325
  483   2HG   LYS 897          2HG       LYS 897  14.339  -1.419   4.188
  484   1HD   LYS 897          1HD       LYS 897  13.330   0.504   2.773
  485   2HD   LYS 897          2HD       LYS 897  12.012  -0.634   2.408
  486   1HE   LYS 897          1HE       LYS 897  12.177  -0.964   5.097
  487   2HE   LYS 897          2HE       LYS 897  12.714   0.725   4.969
  488   1HZ   LYS 897          1HZ       LYS 897  10.322  -0.162   3.568
  489   2HZ   LYS 897          2HZ       LYS 897  10.248   0.202   5.175
  490   3HZ   LYS 897          3HZ       LYS 897  10.728   1.348   4.091
  491    H    ASN 898           H        ASN 898  14.467   1.618   2.364
  492    HA   ASN 898           HA       ASN 898  15.795   2.916   0.129
  493   1HB   ASN 898          1HB       ASN 898  13.604   1.227  -0.443
  494   2HB   ASN 898          2HB       ASN 898  12.964   2.883  -0.498
  495   1HD2  ASN 898          1HD2      ASN 898  12.767   3.196  -2.691
  496   2HD2  ASN 898          2HD2      ASN 898  14.111   3.134  -3.811
  497    HA   PRO 899           HA       PRO 899  14.245   5.840   3.236
  498   1HB   PRO 899          1HB       PRO 899  16.268   7.643   2.955
  499   2HB   PRO 899          2HB       PRO 899  16.499   6.092   3.825
  500   1HG   PRO 899          1HG       PRO 899  17.158   6.690   0.926
  501   2HG   PRO 899          2HG       PRO 899  18.243   5.976   2.164
  502   1HD   PRO 899          1HD       PRO 899  16.852   4.410   0.421
  503   2HD   PRO 899          2HD       PRO 899  17.036   3.920   2.132
  504    H    ALA 900           H        ALA 900  14.786   5.888  -0.170
  505    HA   ALA 900           HA       ALA 900  13.775   8.620  -0.529
  506   1HB   ALA 900          1HB       ALA 900  15.485   7.945  -2.058
  507   2HB   ALA 900          2HB       ALA 900  14.661   6.406  -2.408
  508   3HB   ALA 900          3HB       ALA 900  13.963   7.940  -2.982
  509    H    ALA 901           H        ALA 901  12.420   5.693   0.260
  510    HA   ALA 901           HA       ALA 901  10.059   5.980  -1.486
  511   1HB   ALA 901          1HB       ALA 901   9.382   3.844  -0.538
  512   2HB   ALA 901          2HB       ALA 901  11.088   3.741  -1.036
  513   3HB   ALA 901          3HB       ALA 901  10.674   3.937   0.684
  514    H    GLN 902           H        GLN 902   8.239   4.863   0.514
  515    HA   GLN 902           HA       GLN 902   8.002   7.206   2.342
  516   1HB   GLN 902          1HB       GLN 902   6.078   6.019   0.390
  517   2HB   GLN 902          2HB       GLN 902   5.422   6.515   1.969
  518   1HG   GLN 902          1HG       GLN 902   6.953   8.223  -0.028
  519   2HG   GLN 902          2HG       GLN 902   5.266   8.418   0.496
  520   1HE2  GLN 902          1HE2      GLN 902   5.982   7.729   3.333
  521   2HE2  GLN 902          2HE2      GLN 902   6.742   9.168   3.978
  522    H    GLN 903           H        GLN 903   7.686   6.719   4.450
  523    HA   GLN 903           HA       GLN 903   7.612   3.874   5.175
  524   1HB   GLN 903          1HB       GLN 903   8.096   6.479   6.628
  525   2HB   GLN 903          2HB       GLN 903   7.766   4.982   7.532
  526   1HG   GLN 903          1HG       GLN 903   9.872   4.269   7.194
  527   2HG   GLN 903          2HG       GLN 903   9.675   4.434   5.436
  528   1HE2  GLN 903          1HE2      GLN 903  10.218   6.456   4.410
  529   2HE2  GLN 903          2HE2      GLN 903  11.312   7.582   5.184
  530    H    VAL 904           H        VAL 904   5.325   3.985   4.050
  531    HA   VAL 904           HA       VAL 904   3.230   5.113   5.742
  532    HB   VAL 904           HB       VAL 904   1.962   4.873   3.890
  533   1HG1  VAL 904          1HG1      VAL 904   3.170   4.989   1.909
  534   2HG1  VAL 904          2HG1      VAL 904   4.473   5.275   3.087
  535   3HG1  VAL 904          3HG1      VAL 904   4.259   3.660   2.372
  536   1HG2  VAL 904          1HG2      VAL 904   1.846   2.685   2.637
  537   2HG2  VAL 904          2HG2      VAL 904   3.088   2.045   3.739
  538   3HG2  VAL 904          3HG2      VAL 904   1.500   2.536   4.376
  539    H    SER 905           H        SER 905   1.339   3.598   6.329
  540    HA   SER 905           HA       SER 905   2.434   1.017   7.342
  541   1HB   SER 905          1HB       SER 905   1.708   1.453   9.461
  542   2HB   SER 905          2HB       SER 905   1.894   3.146   8.943
  543    HG   SER 905           HG       SER 905  -0.199   2.507   9.879
  544    HA   PRO 906           HA       PRO 906  -1.291  -0.957   6.048
  545   1HB   PRO 906          1HB       PRO 906  -2.527  -2.051   8.216
  546   2HB   PRO 906          2HB       PRO 906  -0.890  -2.570   7.699
  547   1HG   PRO 906          1HG       PRO 906  -1.581  -0.523   9.825
  548   2HG   PRO 906          2HG       PRO 906  -0.492  -1.939   9.991
  549   1HD   PRO 906          1HD       PRO 906   0.479   0.544   9.422
  550   2HD   PRO 906          2HD       PRO 906   1.167  -0.904   8.626
  551    H    GLU 907           H        GLU 907  -1.705   1.436   8.624
  552    HA   GLU 907           HA       GLU 907  -4.564   1.707   8.274
  553   1HB   GLU 907          1HB       GLU 907  -2.394   2.963   9.859
  554   2HB   GLU 907          2HB       GLU 907  -3.751   4.038   9.446
  555   1HG   GLU 907          1HG       GLU 907  -4.988   3.070  11.054
  556   2HG   GLU 907          2HG       GLU 907  -4.865   1.520  10.194
  557    H    TRP 908           H        TRP 908  -1.700   2.929   6.682
  558    HA   TRP 908           HA       TRP 908  -2.856   5.304   5.577
  559   1HB   TRP 908          1HB       TRP 908  -0.444   4.899   5.720
  560   2HB   TRP 908          2HB       TRP 908  -0.594   3.527   4.613
  561    HD1  TRP 908           HD       TRP 908  -1.014   7.356   4.640
  562    HE1  TRP 908           1HE      TRP 908  -0.550   8.279   2.312
  563    HE3  TRP 908           3HE      TRP 908  -0.391   2.939   2.130
  564    HZ2  TRP 908           2HZ      TRP 908   0.022   7.237  -0.326
  565    HZ3  TRP 908           3HZ      TRP 908   0.111   2.945  -0.286
  566    HH2  TRP 908           HH       TRP 908   0.320   5.079  -1.526
  567    H    ILE 909           H        ILE 909  -2.282   2.025   4.182
  568    HA   ILE 909           HA       ILE 909  -3.395   2.361   1.687
  569    HB   ILE 909           HB       ILE 909  -3.230   0.086   3.631
  570   1HG1  ILE 909          1HG1      ILE 909  -2.464  -0.445   0.895
  571   2HG1  ILE 909          2HG1      ILE 909  -1.783   1.120   1.402
  572   1HG2  ILE 909          1HG2      ILE 909  -5.330  -0.537   2.830
  573   2HG2  ILE 909          2HG2      ILE 909  -5.088   0.275   1.265
  574   3HG2  ILE 909          3HG2      ILE 909  -4.270  -1.269   1.602
  575   1HD1  ILE 909          1HD1      ILE 909  -0.866   0.048   3.445
  576   2HD1  ILE 909          2HD1      ILE 909  -1.530  -1.516   2.914
  577   3HD1  ILE 909          3HD1      ILE 909  -0.244  -0.727   1.969
  578    H    TRP 910           H        TRP 910  -5.188   1.408   4.677
  579    HA   TRP 910           HA       TRP 910  -7.750   1.352   3.558
  580   1HB   TRP 910          1HB       TRP 910  -7.039   2.368   6.321
  581   2HB   TRP 910          2HB       TRP 910  -8.556   1.616   5.809
  582    HD1  TRP 910           HD       TRP 910  -5.920   0.777   7.914
  583    HE1  TRP 910           1HE      TRP 910  -5.364  -1.707   8.007
  584    HE3  TRP 910           3HE      TRP 910  -8.267  -0.737   3.625
  585    HZ2  TRP 910           2HZ      TRP 910  -5.870  -4.072   6.418
  586    HZ3  TRP 910           3HZ      TRP 910  -8.208  -3.109   2.949
  587    HH2  TRP 910           HH       TRP 910  -7.017  -4.785   4.330
  588    H    ALA 911           H        ALA 911  -6.494   4.070   5.570
  589    HA   ALA 911           HA       ALA 911  -8.406   5.950   5.009
  590   1HB   ALA 911          1HB       ALA 911  -6.189   7.520   5.007
  591   2HB   ALA 911          2HB       ALA 911  -6.881   6.800   6.480
  592   3HB   ALA 911          3HB       ALA 911  -5.504   6.016   5.669
  593    H    CYS 912           H        CYS 912  -5.575   5.094   2.981
  594    HA   CYS 912           HA       CYS 912  -6.060   7.081   0.983
  595   1HB   CYS 912          1HB       CYS 912  -4.671   4.390   0.680
  596   2HB   CYS 912          2HB       CYS 912  -4.434   5.847  -0.317
  597    HG   CYS 912           HG       CYS 912  -4.281   6.608   2.723
  598    H    ILE 913           H        ILE 913  -6.637   3.511   0.944
  599    HA   ILE 913           HA       ILE 913  -7.916   3.145  -1.401
  600    HB   ILE 913           HB       ILE 913  -9.051   2.151   1.239
  601   1HG1  ILE 913          1HG1      ILE 913  -6.726   1.099  -0.432
  602   2HG1  ILE 913          2HG1      ILE 913  -6.598   1.855   1.175
  603   1HG2  ILE 913          1HG2      ILE 913 -10.444   1.072  -0.180
  604   2HG2  ILE 913          2HG2      ILE 913  -9.508   1.594  -1.602
  605   3HG2  ILE 913          3HG2      ILE 913  -9.025   0.134  -0.706
  606   1HD1  ILE 913          1HD1      ILE 913  -7.064  -0.888   0.577
  607   2HD1  ILE 913          2HD1      ILE 913  -7.067  -0.108   2.177
  608   3HD1  ILE 913          3HD1      ILE 913  -8.582  -0.250   1.253
  609    H    ARG 914           H        ARG 914  -9.664   4.237   1.568
  610    HA   ARG 914           HA       ARG 914 -12.081   4.831   0.169
  611   1HB   ARG 914          1HB       ARG 914 -11.391   4.561   2.775
  612   2HB   ARG 914          2HB       ARG 914 -11.415   6.337   2.653
  613   1HG   ARG 914          1HG       ARG 914 -13.670   4.487   1.766
  614   2HG   ARG 914          2HG       ARG 914 -13.642   5.411   3.287
  615   1HD   ARG 914          1HD       ARG 914 -13.061   7.369   1.448
  616   2HD   ARG 914          2HD       ARG 914 -14.152   6.324   0.512
  617    HE   ARG 914           HE       ARG 914 -15.917   6.980   1.861
  618   1HH1  ARG 914          2HH2      ARG 914 -12.832   7.863   3.344
  619   2HH1  ARG 914          1HH2      ARG 914 -13.561   8.813   4.620
  620   1HH2  ARG 914          2HH1      ARG 914 -16.880   8.235   3.546
  621   2HH2  ARG 914          1HH1      ARG 914 -15.869   9.024   4.735
  622    H    LYS 915           H        LYS 915  -9.617   7.056   1.600
  623    HA   LYS 915           HA       LYS 915 -10.547   9.459   0.671
  624   1HB   LYS 915          1HB       LYS 915  -7.694   8.419   0.806
  625   2HB   LYS 915          2HB       LYS 915  -8.109  10.127   0.525
  626   1HG   LYS 915          1HG       LYS 915  -9.292   8.620   2.868
  627   2HG   LYS 915          2HG       LYS 915  -7.664   9.333   2.978
  628   1HD   LYS 915          1HD       LYS 915  -8.515  11.542   2.515
  629   2HD   LYS 915          2HD       LYS 915 -10.119  10.898   2.092
  630   1HE   LYS 915          1HE       LYS 915 -10.459  11.620   4.288
  631   2HE   LYS 915          2HE       LYS 915 -10.064   9.903   4.522
  632   1HZ   LYS 915          1HZ       LYS 915  -7.786  10.588   4.920
  633   2HZ   LYS 915          2HZ       LYS 915  -8.226  12.173   4.804
  634   3HZ   LYS 915          3HZ       LYS 915  -8.831  11.235   6.019
  635    H    ARG 916           H        ARG 916  -9.344   6.787  -1.222
  636    HA   ARG 916           HA       ARG 916  -9.260   6.468  -3.488
  637   1HB   ARG 916          1HB       ARG 916 -10.983   8.908  -3.236
  638   2HB   ARG 916          2HB       ARG 916 -10.341   8.502  -4.846
  639   1HG   ARG 916          1HG       ARG 916 -11.413   6.190  -3.334
  640   2HG   ARG 916          2HG       ARG 916 -12.628   7.420  -3.758
  641   1HD   ARG 916          1HD       ARG 916 -10.768   5.905  -5.622
  642   2HD   ARG 916          2HD       ARG 916 -12.544   5.889  -5.601
  643    HE   ARG 916           HE       ARG 916 -10.809   7.881  -6.835
  644   1HH1  ARG 916          2HH2      ARG 916 -13.994   7.198  -5.460
  645   2HH1  ARG 916          1HH2      ARG 916 -14.802   8.468  -6.351
  646   1HH2  ARG 916          2HH1      ARG 916 -11.877   9.559  -8.012
  647   2HH2  ARG 916          1HH1      ARG 916 -13.595   9.814  -7.806
  648    H    ARG 917           H        ARG 917  -7.724   8.936  -1.814
  649    HA   ARG 917           HA       ARG 917  -5.802   9.284  -4.043
  650   1HB   ARG 917          1HB       ARG 917  -5.762  11.750  -2.814
  651   2HB   ARG 917          2HB       ARG 917  -6.611  11.380  -4.334
  652   1HG   ARG 917          1HG       ARG 917  -8.021  10.755  -1.760
  653   2HG   ARG 917          2HG       ARG 917  -7.884  12.465  -2.234
  654   1HD   ARG 917          1HD       ARG 917  -8.752  11.761  -4.532
  655   2HD   ARG 917          2HD       ARG 917  -9.136  10.186  -3.807
  656    HE   ARG 917           HE       ARG 917 -10.227  12.367  -2.261
  657   1HH1  ARG 917          2HH2      ARG 917 -10.675  10.401  -5.165
  658   2HH1  ARG 917          1HH2      ARG 917 -12.410  10.623  -5.213
  659   1HH2  ARG 917          2HH1      ARG 917 -12.519  12.660  -2.325
  660   2HH2  ARG 917          1HH1      ARG 917 -13.461  11.911  -3.594
  661    H    LEU 918           H        LEU 918  -3.860   8.646  -3.337
  662    HA   LEU 918           HA       LEU 918  -3.080   7.703  -0.964
  663   1HB   LEU 918          1HB       LEU 918  -1.549   9.556  -2.816
  664   2HB   LEU 918          2HB       LEU 918  -0.786   8.744  -1.428
  665    HG   LEU 918           HG       LEU 918  -0.404   7.235  -3.197
  666   1HD1  LEU 918          1HD1      LEU 918  -3.052   6.057  -2.487
  667   2HD1  LEU 918          2HD1      LEU 918  -1.424   5.344  -2.394
  668   3HD1  LEU 918          3HD1      LEU 918  -1.981   6.460  -1.123
  669   1HD2  LEU 918          1HD2      LEU 918  -3.293   7.427  -4.098
  670   2HD2  LEU 918          2HD2      LEU 918  -2.058   8.560  -4.696
  671   3HD2  LEU 918          3HD2      LEU 918  -1.886   6.814  -4.999
  672    H    VAL 919           H        VAL 919  -2.938   8.323   1.115
  673    HA   VAL 919           HA       VAL 919  -3.292  11.215   1.693
  674    HB   VAL 919           HB       VAL 919  -4.431  10.595   3.598
  675   1HG1  VAL 919          1HG1      VAL 919  -5.662   8.377   3.111
  676   2HG1  VAL 919          2HG1      VAL 919  -5.779   9.654   1.876
  677   3HG1  VAL 919          3HG1      VAL 919  -4.664   8.287   1.639
  678   1HG2  VAL 919          1HG2      VAL 919  -2.349   9.284   4.382
  679   2HG2  VAL 919          2HG2      VAL 919  -3.930   8.709   4.965
  680   3HG2  VAL 919          3HG2      VAL 919  -3.110   7.861   3.632
  681    H    ALA 920           H        ALA 920  -2.342  11.312   4.281
  682    HA   ALA 920           HA       ALA 920   0.467  11.584   3.849
  683   1HB   ALA 920          1HB       ALA 920  -1.501  12.124   5.944
  684   2HB   ALA 920          2HB       ALA 920   0.043  11.543   6.613
  685   3HB   ALA 920          3HB       ALA 920   0.013  12.977   5.560
  686    HA   PRO 921           HA       PRO 921   1.375   7.256   4.555
  687   1HB   PRO 921          1HB       PRO 921   3.989   7.367   3.794
  688   2HB   PRO 921          2HB       PRO 921   2.652   7.499   2.605
  689   1HG   PRO 921          1HG       PRO 921   4.173   9.768   3.921
  690   2HG   PRO 921          2HG       PRO 921   3.888   9.522   2.167
  691   1HD   PRO 921          1HD       PRO 921   2.282  11.147   3.654
  692   2HD   PRO 921          2HD       PRO 921   1.581  10.084   2.396
  693    H    CYS 922           H        CYS 922   1.812   6.415   6.517
  694    HA   CYS 922           HA       CYS 922   4.076   7.330   8.086
  695   1HB   CYS 922          1HB       CYS 922   2.635   7.923  10.076
  696   2HB   CYS 922          2HB       CYS 922   2.534   9.083   8.728
  697    HG   CYS 922           HG       CYS 922   0.424   7.040  10.042
  Start of MODEL   12
    1    H    GLY 835           H        GLY 835 -10.500  -1.777  13.011
    2   1HA   GLY 835          1HA       GLY 835  -9.509  -3.998  11.998
    3   2HA   GLY 835          2HA       GLY 835 -11.100  -4.626  12.486
    4    H    SER 836           H        SER 836  -9.399  -2.294  10.402
    5    HA   SER 836           HA       SER 836 -11.839  -1.478   9.039
    6   1HB   SER 836          1HB       SER 836 -10.187  -0.331   7.516
    7   2HB   SER 836          2HB       SER 836 -10.034   0.115   9.232
    8    HG   SER 836           HG       SER 836  -8.562  -2.072   8.669
    9    H    ALA 837           H        ALA 837  -9.274  -2.019   6.857
   10    HA   ALA 837           HA       ALA 837  -9.557  -3.189   4.828
   11   1HB   ALA 837          1HB       ALA 837  -8.444  -5.233   5.114
   12   2HB   ALA 837          2HB       ALA 837  -7.950  -4.312   6.555
   13   3HB   ALA 837          3HB       ALA 837  -9.223  -5.549   6.683
   14    H    ASP 838           H        ASP 838 -10.918  -5.626   7.080
   15    HA   ASP 838           HA       ASP 838 -12.734  -6.809   5.450
   16   1HB   ASP 838          1HB       ASP 838 -12.258  -6.728   8.185
   17   2HB   ASP 838          2HB       ASP 838 -13.940  -6.173   8.051
   18    H    GLU 839           H        GLU 839 -13.165  -3.665   7.115
   19    HA   GLU 839           HA       GLU 839 -15.865  -3.310   6.154
   20   1HB   GLU 839          1HB       GLU 839 -13.983  -1.970   7.898
   21   2HB   GLU 839          2HB       GLU 839 -14.704  -0.800   6.768
   22   1HG   GLU 839          1HG       GLU 839 -16.686  -2.699   7.779
   23   2HG   GLU 839          2HG       GLU 839 -15.886  -1.819   9.100
   24    H    THR 840           H        THR 840 -12.611  -2.544   4.985
   25    HA   THR 840           HA       THR 840 -13.632  -0.810   2.862
   26    HB   THR 840           HB       THR 840 -10.844  -1.965   3.023
   27    HG1  THR 840           1HG      THR 840 -10.505  -0.904   4.788
   28   1HG2  THR 840          1HG2      THR 840 -11.881   0.798   2.272
   29   2HG2  THR 840          2HG2      THR 840 -10.250   0.142   1.993
   30   3HG2  THR 840          3HG2      THR 840 -11.640  -0.519   1.098
   31    H    LEU 841           H        LEU 841 -11.953  -3.998   3.072
   32    HA   LEU 841           HA       LEU 841 -12.208  -4.596   0.302
   33   1HB   LEU 841          1HB       LEU 841 -11.575  -6.083   2.822
   34   2HB   LEU 841          2HB       LEU 841 -12.043  -7.041   1.397
   35    HG   LEU 841           HG       LEU 841  -9.550  -5.612   1.937
   36   1HD1  LEU 841          1HD1      LEU 841  -9.731  -7.051  -0.592
   37   2HD1  LEU 841          2HD1      LEU 841  -8.791  -7.449   0.867
   38   3HD1  LEU 841          3HD1      LEU 841 -10.483  -7.985   0.725
   39   1HD2  LEU 841          1HD2      LEU 841  -9.310  -4.682  -0.372
   40   2HD2  LEU 841          2HD2      LEU 841 -11.034  -5.022  -0.660
   41   3HD2  LEU 841          3HD2      LEU 841 -10.554  -3.836   0.579
   42    H    CYS 842           H        CYS 842 -14.595  -4.168   2.603
   43    HA   CYS 842           HA       CYS 842 -16.385  -6.286   2.248
   44   1HB   CYS 842          1HB       CYS 842 -16.448  -4.085   3.721
   45   2HB   CYS 842          2HB       CYS 842 -17.380  -3.446   2.344
   46    HG   CYS 842           HG       CYS 842 -19.230  -5.135   2.306
   47    H    GLN 843           H        GLN 843 -15.120  -4.184  -0.104
   48    HA   GLN 843           HA       GLN 843 -17.439  -4.722  -1.900
   49   1HB   GLN 843          1HB       GLN 843 -15.357  -2.596  -2.402
   50   2HB   GLN 843          2HB       GLN 843 -17.039  -2.685  -2.976
   51   1HG   GLN 843          1HG       GLN 843 -17.023  -2.714  -0.092
   52   2HG   GLN 843          2HG       GLN 843 -16.037  -1.349  -0.661
   53   1HE2  GLN 843          1HE2      GLN 843 -19.097  -2.182   0.262
   54   2HE2  GLN 843          2HE2      GLN 843 -20.026  -1.020  -0.660
   55    H    THR 844           H        THR 844 -16.411  -6.897  -2.152
   56    HA   THR 844           HA       THR 844 -15.200  -8.375  -3.411
   57    HB   THR 844           HB       THR 844 -15.741  -6.130  -5.083
   58    HG1  THR 844           1HG      THR 844 -15.811  -7.748  -6.594
   59   1HG2  THR 844          1HG2      THR 844 -13.653  -6.710  -6.640
   60   2HG2  THR 844          2HG2      THR 844 -13.544  -5.445  -5.392
   61   3HG2  THR 844          3HG2      THR 844 -12.883  -7.067  -5.075
   62    H    LYS 845           H        LYS 845 -13.263  -5.379  -3.917
   63    HA   LYS 845           HA       LYS 845 -11.187  -6.357  -2.105
   64   1HB   LYS 845          1HB       LYS 845 -11.105  -7.000  -4.897
   65   2HB   LYS 845          2HB       LYS 845  -9.843  -5.787  -4.570
   66   1HG   LYS 845          1HG       LYS 845  -8.806  -7.887  -4.128
   67   2HG   LYS 845          2HG       LYS 845  -9.222  -7.234  -2.525
   68   1HD   LYS 845          1HD       LYS 845 -11.382  -8.816  -3.789
   69   2HD   LYS 845          2HD       LYS 845  -9.911  -9.750  -3.426
   70   1HE   LYS 845          1HE       LYS 845  -9.963  -9.039  -1.105
   71   2HE   LYS 845          2HE       LYS 845 -11.308  -7.925  -1.431
   72   1HZ   LYS 845          1HZ       LYS 845 -12.529  -9.972  -2.147
   73   2HZ   LYS 845          2HZ       LYS 845 -11.337 -10.847  -1.416
   74   3HZ   LYS 845          3HZ       LYS 845 -12.256  -9.802  -0.529
   75    H    VAL 846           H        VAL 846 -13.025  -3.965  -3.471
   76    HA   VAL 846           HA       VAL 846 -12.775  -1.681  -3.753
   77    HB   VAL 846           HB       VAL 846 -11.490  -0.796  -1.559
   78   1HG1  VAL 846          1HG1      VAL 846 -13.609  -0.570  -0.647
   79   2HG1  VAL 846          2HG1      VAL 846 -14.049  -0.980  -2.322
   80   3HG1  VAL 846          3HG1      VAL 846 -14.081  -2.236  -1.061
   81   1HG2  VAL 846          1HG2      VAL 846 -11.055  -2.371   0.029
   82   2HG2  VAL 846          2HG2      VAL 846 -12.511  -3.313  -0.374
   83   3HG2  VAL 846          3HG2      VAL 846 -11.031  -3.505  -1.343
   84    H    LEU 847           H        LEU 847 -11.546  -0.541  -5.122
   85    HA   LEU 847           HA       LEU 847  -8.647  -0.380  -4.669
   86   1HB   LEU 847          1HB       LEU 847  -9.662  -1.190  -7.403
   87   2HB   LEU 847          2HB       LEU 847  -7.999  -1.241  -6.769
   88    HG   LEU 847           HG       LEU 847  -9.167  -3.497  -6.891
   89   1HD1  LEU 847          1HD1      LEU 847  -8.758  -3.529  -4.086
   90   2HD1  LEU 847          2HD1      LEU 847  -7.577  -3.938  -5.353
   91   3HD1  LEU 847          3HD1      LEU 847  -7.668  -2.275  -4.724
   92   1HD2  LEU 847          1HD2      LEU 847 -11.234  -2.024  -5.645
   93   2HD2  LEU 847          2HD2      LEU 847 -11.196  -3.778  -5.945
   94   3HD2  LEU 847          3HD2      LEU 847 -10.614  -3.127  -4.393
   95    H    LEU 848           H        LEU 848  -9.277   1.813  -4.146
   96    HA   LEU 848           HA       LEU 848 -10.347   3.410  -6.389
   97   1HB   LEU 848          1HB       LEU 848 -10.167   3.654  -3.439
   98   2HB   LEU 848          2HB       LEU 848  -9.908   5.167  -4.340
   99    HG   LEU 848           HG       LEU 848 -12.189   3.384  -5.159
  100   1HD1  LEU 848          1HD1      LEU 848 -13.268   5.236  -3.342
  101   2HD1  LEU 848          2HD1      LEU 848 -13.128   3.478  -3.105
  102   3HD1  LEU 848          3HD1      LEU 848 -11.851   4.561  -2.503
  103   1HD2  LEU 848          1HD2      LEU 848 -12.150   6.393  -4.849
  104   2HD2  LEU 848          2HD2      LEU 848 -11.348   5.621  -6.238
  105   3HD2  LEU 848          3HD2      LEU 848 -13.095   5.394  -5.979
  106    H    ASP 849           H        ASP 849  -9.239   5.725  -6.456
  107    HA   ASP 849           HA       ASP 849  -6.512   5.226  -7.311
  108   1HB   ASP 849          1HB       ASP 849  -6.576   7.609  -7.949
  109   2HB   ASP 849          2HB       ASP 849  -8.005   6.735  -8.544
  110    H    ILE 850           H        ILE 850  -6.761   4.614  -4.580
  111    HA   ILE 850           HA       ILE 850  -6.020   6.797  -2.886
  112    HB   ILE 850           HB       ILE 850  -5.010   4.167  -2.078
  113   1HG1  ILE 850          1HG1      ILE 850  -6.951   3.725  -3.803
  114   2HG1  ILE 850          2HG1      ILE 850  -6.966   2.884  -2.234
  115   1HG2  ILE 850          1HG2      ILE 850  -5.984   6.440  -0.889
  116   2HG2  ILE 850          2HG2      ILE 850  -7.409   5.377  -0.812
  117   3HG2  ILE 850          3HG2      ILE 850  -5.871   4.859  -0.080
  118   1HD1  ILE 850          1HD1      ILE 850  -8.307   5.043  -1.458
  119   2HD1  ILE 850          2HD1      ILE 850  -8.668   5.176  -3.196
  120   3HD1  ILE 850          3HD1      ILE 850  -9.141   3.713  -2.297
  121    H    PHE 851           H        PHE 851  -3.863   3.998  -3.173
  122    HA   PHE 851           HA       PHE 851  -1.521   5.588  -2.964
  123   1HB   PHE 851          1HB       PHE 851  -1.599   2.851  -4.228
  124   2HB   PHE 851          2HB       PHE 851  -0.349   3.567  -3.196
  125    HD1  PHE 851           1HD      PHE 851  -1.608   4.464  -0.827
  126    HD2  PHE 851           2HD      PHE 851  -2.603   1.035  -3.215
  127    HE1  PHE 851           1HE      PHE 851  -2.619   3.374   1.159
  128    HE2  PHE 851           2HE      PHE 851  -3.615  -0.055  -1.230
  129    HZ   PHE 851           HZ       PHE 851  -3.623   1.115   0.957
  130    H    THR 852           H        THR 852  -3.335   6.487  -5.114
  131    HA   THR 852           HA       THR 852  -2.715   5.851  -7.687
  132    HB   THR 852           HB       THR 852  -3.972   7.939  -6.455
  133    HG1  THR 852           1HG      THR 852  -4.640   7.463  -8.425
  134   1HG2  THR 852          1HG2      THR 852  -2.863  10.012  -7.263
  135   2HG2  THR 852          2HG2      THR 852  -1.851   9.143  -6.085
  136   3HG2  THR 852          3HG2      THR 852  -1.480   9.042  -7.823
  137    H    GLY 853           H        GLY 853  -0.722   5.140  -8.305
  138   1HA   GLY 853          1HA       GLY 853   1.447   5.365  -9.049
  139   2HA   GLY 853          2HA       GLY 853   1.354   7.104  -8.687
  140    H    VAL 854           H        VAL 854   0.359   5.485  -5.943
  141    HA   VAL 854           HA       VAL 854   2.808   6.122  -4.540
  142    HB   VAL 854           HB       VAL 854   0.083   5.071  -3.872
  143   1HG1  VAL 854          1HG1      VAL 854   1.963   3.590  -2.808
  144   2HG1  VAL 854          2HG1      VAL 854   2.289   5.021  -1.801
  145   3HG1  VAL 854          3HG1      VAL 854   0.688   4.245  -1.753
  146   1HG2  VAL 854          1HG2      VAL 854   1.958   7.246  -2.867
  147   2HG2  VAL 854          2HG2      VAL 854   0.430   7.449  -3.756
  148   3HG2  VAL 854          3HG2      VAL 854   0.411   6.858  -2.077
  149    H    ARG 855           H        ARG 855   4.582   4.884  -4.709
  150    HA   ARG 855           HA       ARG 855   4.229   1.964  -5.098
  151   1HB   ARG 855          1HB       ARG 855   6.394   1.960  -6.033
  152   2HB   ARG 855          2HB       ARG 855   5.678   3.478  -6.626
  153   1HG   ARG 855          1HG       ARG 855   6.720   4.494  -4.424
  154   2HG   ARG 855          2HG       ARG 855   7.769   3.058  -4.489
  155   1HD   ARG 855          1HD       ARG 855   8.715   5.076  -5.670
  156   2HD   ARG 855          2HD       ARG 855   8.545   3.641  -6.704
  157    HE   ARG 855           HE       ARG 855   6.615   4.660  -7.747
  158   1HH1  ARG 855          2HH2      ARG 855   8.441   6.717  -5.525
  159   2HH1  ARG 855          1HH2      ARG 855   7.813   8.214  -6.177
  160   1HH2  ARG 855          2HH1      ARG 855   5.786   6.638  -8.609
  161   2HH2  ARG 855          1HH1      ARG 855   6.299   8.168  -7.936
  162    H    LEU 856           H        LEU 856   3.578   1.687  -2.830
  163    HA   LEU 856           HA       LEU 856   5.728   2.156  -0.856
  164   1HB   LEU 856          1HB       LEU 856   3.990   2.509   0.517
  165   2HB   LEU 856          2HB       LEU 856   2.865   2.145  -0.813
  166    HG   LEU 856           HG       LEU 856   2.550   0.659   1.190
  167   1HD1  LEU 856          1HD1      LEU 856   3.558  -1.275  -0.795
  168   2HD1  LEU 856          2HD1      LEU 856   1.898  -1.001  -0.214
  169   3HD1  LEU 856          3HD1      LEU 856   2.565   0.016  -1.513
  170   1HD2  LEU 856          1HD2      LEU 856   4.783  -1.097   0.693
  171   2HD2  LEU 856          2HD2      LEU 856   5.400   0.542   1.011
  172   3HD2  LEU 856          3HD2      LEU 856   4.343  -0.258   2.200
  173    H    TYR 857           H        TYR 857   7.097   0.583  -0.256
  174    HA   TYR 857           HA       TYR 857   7.030  -1.991  -1.480
  175   1HB   TYR 857          1HB       TYR 857   9.159  -1.526  -0.866
  176   2HB   TYR 857          2HB       TYR 857   8.657  -0.525   0.506
  177    HD1  TYR 857           1HD      TYR 857   9.916  -1.316   2.312
  178    HD2  TYR 857           2HD      TYR 857   7.863  -4.112  -0.221
  179    HE1  TYR 857           1HE      TYR 857  10.500  -3.155   3.870
  180    HE2  TYR 857           2HE      TYR 857   8.446  -5.951   1.337
  181    HH   TYR 857           HH       TYR 857   9.990  -5.380   4.457
  182    H    LEU 858           H        LEU 858   5.462  -3.449  -1.092
  183    HA   LEU 858           HA       LEU 858   4.276  -3.607   1.603
  184   1HB   LEU 858          1HB       LEU 858   2.832  -3.584  -0.423
  185   2HB   LEU 858          2HB       LEU 858   3.604  -5.093  -0.967
  186    HG   LEU 858           HG       LEU 858   2.461  -6.365   0.541
  187   1HD1  LEU 858          1HD1      LEU 858   1.897  -5.450   2.873
  188   2HD1  LEU 858          2HD1      LEU 858   3.628  -5.620   2.493
  189   3HD1  LEU 858          3HD1      LEU 858   2.857  -4.017   2.431
  190   1HD2  LEU 858          1HD2      LEU 858   0.868  -4.408  -0.476
  191   2HD2  LEU 858          2HD2      LEU 858   0.263  -5.709   0.578
  192   3HD2  LEU 858          3HD2      LEU 858   0.645  -4.111   1.265
  193    HA   PRO 859           HA       PRO 859   7.225  -6.888   2.416
  194   1HB   PRO 859          1HB       PRO 859   6.742  -7.064   5.091
  195   2HB   PRO 859          2HB       PRO 859   7.620  -5.672   4.379
  196   1HG   PRO 859          1HG       PRO 859   4.666  -5.838   5.041
  197   2HG   PRO 859          2HG       PRO 859   5.824  -4.563   5.543
  198   1HD   PRO 859          1HD       PRO 859   4.232  -4.255   3.352
  199   2HD   PRO 859          2HD       PRO 859   5.932  -3.695   3.324
  200    HA   PRO 860           HA       PRO 860   4.418 -10.290   2.163
  201   1HB   PRO 860          1HB       PRO 860   6.114 -12.348   2.721
  202   2HB   PRO 860          2HB       PRO 860   6.287 -11.357   1.236
  203   1HG   PRO 860          1HG       PRO 860   7.756 -11.001   3.864
  204   2HG   PRO 860          2HG       PRO 860   8.474 -11.127   2.225
  205   1HD   PRO 860          1HD       PRO 860   7.992  -8.708   3.385
  206   2HD   PRO 860          2HD       PRO 860   7.680  -8.955   1.640
  207    H    SER 861           H        SER 861   6.187  -9.383   5.036
  208    HA   SER 861           HA       SER 861   4.837 -11.331   6.750
  209   1HB   SER 861          1HB       SER 861   7.126  -9.594   6.894
  210   2HB   SER 861          2HB       SER 861   6.036  -9.221   8.251
  211    HG   SER 861           HG       SER 861   6.097 -11.346   8.866
  212    H    THR 862           H        THR 862   4.183  -8.232   5.388
  213    HA   THR 862           HA       THR 862   2.635  -7.075   7.472
  214    HB   THR 862           HB       THR 862   3.178  -6.633   4.632
  215    HG1  THR 862           1HG      THR 862   2.911  -4.488   5.394
  216   1HG2  THR 862          1HG2      THR 862   1.097  -5.485   4.086
  217   2HG2  THR 862          2HG2      THR 862   0.722  -7.170   4.522
  218   3HG2  THR 862          3HG2      THR 862   0.427  -5.861   5.692
  219    HA   PRO 863           HA       PRO 863  -0.928  -9.664   7.474
  220   1HB   PRO 863          1HB       PRO 863  -2.667  -8.033   8.793
  221   2HB   PRO 863          2HB       PRO 863  -1.218  -8.719   9.598
  222   1HG   PRO 863          1HG       PRO 863  -1.486  -5.986   8.312
  223   2HG   PRO 863          2HG       PRO 863  -0.902  -6.357   9.967
  224   1HD   PRO 863          1HD       PRO 863   0.832  -5.991   7.895
  225   2HD   PRO 863          2HD       PRO 863   1.132  -7.266   9.115
  226    H    ASP 864           H        ASP 864  -2.697 -10.009   6.155
  227    HA   ASP 864           HA       ASP 864  -4.284  -9.608   4.544
  228   1HB   ASP 864          1HB       ASP 864  -4.050  -7.107   5.923
  229   2HB   ASP 864          2HB       ASP 864  -4.158  -6.771   4.182
  230    H    PHE 865           H        PHE 865  -1.131  -9.439   4.285
  231    HA   PHE 865           HA       PHE 865  -0.309  -7.926   2.155
  232   1HB   PHE 865          1HB       PHE 865   0.957  -9.680   3.518
  233   2HB   PHE 865          2HB       PHE 865   0.308 -10.881   2.389
  234    HD1  PHE 865           1HD      PHE 865   2.010  -7.526   2.235
  235    HD2  PHE 865           2HD      PHE 865   1.686 -11.504   0.645
  236    HE1  PHE 865           1HE      PHE 865   3.864  -7.047   0.659
  237    HE2  PHE 865           2HE      PHE 865   3.540 -11.025  -0.931
  238    HZ   PHE 865           HZ       PHE 865   4.629  -8.797  -0.924
  239    H    SER 866           H        SER 866  -2.012 -11.097   1.946
  240    HA   SER 866           HA       SER 866  -2.140 -11.721  -0.623
  241   1HB   SER 866          1HB       SER 866  -3.600 -12.714   1.099
  242   2HB   SER 866          2HB       SER 866  -4.622 -11.256   1.078
  243    HG   SER 866           HG       SER 866  -4.676 -11.769  -1.321
  244    H    ARG 867           H        ARG 867  -4.800  -9.538   0.378
  245    HA   ARG 867           HA       ARG 867  -5.058  -8.458  -2.261
  246   1HB   ARG 867          1HB       ARG 867  -6.080  -7.201   0.303
  247   2HB   ARG 867          2HB       ARG 867  -6.793  -7.129  -1.327
  248   1HG   ARG 867          1HG       ARG 867  -7.945  -9.032  -0.958
  249   2HG   ARG 867          2HG       ARG 867  -6.451  -9.894  -0.518
  250   1HD   ARG 867          1HD       ARG 867  -6.966  -9.803   1.672
  251   2HD   ARG 867          2HD       ARG 867  -7.219  -8.046   1.589
  252    HE   ARG 867           HE       ARG 867  -9.490  -8.424   1.579
  253   1HH1  ARG 867          2HH2      ARG 867  -7.795 -11.328   0.486
  254   2HH1  ARG 867          1HH2      ARG 867  -9.245 -12.301   0.380
  255   1HH2  ARG 867          2HH1      ARG 867 -11.406  -9.709   1.440
  256   2HH2  ARG 867          1HH1      ARG 867 -11.304 -11.378   0.924
  257    H    LEU 868           H        LEU 868  -3.523  -7.311   0.766
  258    HA   LEU 868           HA       LEU 868  -2.932  -4.720   0.307
  259   1HB   LEU 868          1HB       LEU 868  -1.433  -7.000   1.487
  260   2HB   LEU 868          2HB       LEU 868  -0.462  -5.564   1.083
  261    HG   LEU 868           HG       LEU 868  -2.334  -5.956   3.271
  262   1HD1  LEU 868          1HD1      LEU 868  -0.569  -4.802   4.091
  263   2HD1  LEU 868          2HD1      LEU 868  -0.062  -4.295   2.462
  264   3HD1  LEU 868          3HD1      LEU 868  -1.287  -3.354   3.346
  265   1HD2  LEU 868          1HD2      LEU 868  -2.823  -3.490   1.554
  266   2HD2  LEU 868          2HD2      LEU 868  -3.895  -4.911   1.563
  267   3HD2  LEU 868          3HD2      LEU 868  -3.672  -3.955   3.048
  268    H    ARG 869           H        ARG 869  -1.171  -7.472  -1.210
  269    HA   ARG 869           HA       ARG 869   0.562  -5.827  -2.771
  270   1HB   ARG 869          1HB       ARG 869   0.775  -8.320  -2.174
  271   2HB   ARG 869          2HB       ARG 869  -0.378  -8.617  -3.497
  272   1HG   ARG 869          1HG       ARG 869   1.447  -8.637  -4.848
  273   2HG   ARG 869          2HG       ARG 869   1.437  -6.868  -4.656
  274   1HD   ARG 869          1HD       ARG 869   3.627  -7.442  -4.034
  275   2HD   ARG 869          2HD       ARG 869   2.788  -7.335  -2.471
  276    HE   ARG 869           HE       ARG 869   2.984  -9.646  -2.205
  277   1HH1  ARG 869          2HH2      ARG 869   3.947  -8.632  -5.453
  278   2HH1  ARG 869          1HH2      ARG 869   4.655 -10.176  -5.873
  279   1HH2  ARG 869          2HH1      ARG 869   3.919 -11.685  -2.760
  280   2HH2  ARG 869          1HH1      ARG 869   4.639 -11.916  -4.338
  281    H    ARG 870           H        ARG 870  -1.833  -8.053  -4.227
  282    HA   ARG 870           HA       ARG 870  -2.135  -6.787  -6.639
  283   1HB   ARG 870          1HB       ARG 870  -3.178  -8.953  -5.953
  284   2HB   ARG 870          2HB       ARG 870  -4.388  -8.040  -5.020
  285   1HG   ARG 870          1HG       ARG 870  -4.268  -6.872  -7.625
  286   2HG   ARG 870          2HG       ARG 870  -4.365  -8.636  -7.842
  287   1HD   ARG 870          1HD       ARG 870  -6.319  -8.730  -6.353
  288   2HD   ARG 870          2HD       ARG 870  -6.205  -6.980  -6.066
  289    HE   ARG 870           HE       ARG 870  -7.113  -6.571  -8.181
  290   1HH1  ARG 870          2HH2      ARG 870  -6.370  -9.998  -7.725
  291   2HH1  ARG 870          1HH2      ARG 870  -7.248 -10.518  -9.146
  292   1HH2  ARG 870          2HH1      ARG 870  -8.273  -7.258 -10.058
  293   2HH2  ARG 870          1HH1      ARG 870  -8.333  -8.956 -10.476
  294    H    TYR 871           H        TYR 871  -4.320  -6.241  -3.810
  295    HA   TYR 871           HA       TYR 871  -5.908  -4.243  -4.738
  296   1HB   TYR 871          1HB       TYR 871  -5.771  -5.247  -2.403
  297   2HB   TYR 871          2HB       TYR 871  -4.492  -4.068  -2.064
  298    HD1  TYR 871           1HD      TYR 871  -7.702  -3.710  -3.976
  299    HD2  TYR 871           2HD      TYR 871  -5.381  -2.529  -0.560
  300    HE1  TYR 871           1HE      TYR 871  -9.418  -2.017  -3.395
  301    HE2  TYR 871           2HE      TYR 871  -7.097  -0.836   0.021
  302    HH   TYR 871           HH       TYR 871  -9.822  -0.092  -2.089
  303    H    PHE 872           H        PHE 872  -2.798  -3.511  -3.046
  304    HA   PHE 872           HA       PHE 872  -2.678  -0.805  -3.656
  305   1HB   PHE 872          1HB       PHE 872  -1.152  -2.276  -2.197
  306   2HB   PHE 872          2HB       PHE 872  -0.263  -2.626  -3.690
  307    HD1  PHE 872           1HD      PHE 872   0.152  -0.303  -5.129
  308    HD2  PHE 872           2HD      PHE 872  -0.191  -0.661  -0.862
  309    HE1  PHE 872           1HE      PHE 872   1.450   1.791  -4.849
  310    HE2  PHE 872           2HE      PHE 872   1.107   1.434  -0.582
  311    HZ   PHE 872           HZ       PHE 872   1.927   2.660  -2.576
  312    H    VAL 873           H        VAL 873  -0.159  -2.671  -5.252
  313    HA   VAL 873           HA       VAL 873   0.263  -1.241  -7.460
  314    HB   VAL 873           HB       VAL 873   1.543  -3.131  -7.528
  315   1HG1  VAL 873          1HG1      VAL 873  -0.963  -4.597  -6.619
  316   2HG1  VAL 873          2HG1      VAL 873   0.558  -5.429  -7.021
  317   3HG1  VAL 873          3HG1      VAL 873   0.508  -4.266  -5.674
  318   1HG2  VAL 873          1HG2      VAL 873  -0.725  -4.394  -9.081
  319   2HG2  VAL 873          2HG2      VAL 873   0.074  -2.926  -9.693
  320   3HG2  VAL 873          3HG2      VAL 873   1.021  -4.410  -9.430
  321    H    ALA 874           H        ALA 874  -2.623  -3.249  -6.913
  322    HA   ALA 874           HA       ALA 874  -3.701  -3.168  -9.516
  323   1HB   ALA 874          1HB       ALA 874  -5.920  -3.371  -8.223
  324   2HB   ALA 874          2HB       ALA 874  -4.696  -4.632  -7.937
  325   3HB   ALA 874          3HB       ALA 874  -4.924  -3.328  -6.748
  326    H    PHE 875           H        PHE 875  -4.387  -0.997  -6.709
  327    HA   PHE 875           HA       PHE 875  -6.128   0.782  -7.791
  328   1HB   PHE 875          1HB       PHE 875  -3.623   1.554  -6.259
  329   2HB   PHE 875          2HB       PHE 875  -5.123   2.491  -6.371
  330    HD1  PHE 875           1HD      PHE 875  -6.116  -0.842  -6.259
  331    HD2  PHE 875           2HD      PHE 875  -4.487   2.232  -3.740
  332    HE1  PHE 875           1HE      PHE 875  -7.001  -2.012  -4.260
  333    HE2  PHE 875           2HE      PHE 875  -5.371   1.062  -1.740
  334    HZ   PHE 875           HZ       PHE 875  -6.628  -1.060  -2.000
  335    H    ASP 876           H        ASP 876  -2.592   0.696  -8.405
  336    HA   ASP 876           HA       ASP 876  -2.303   1.238 -10.945
  337   1HB   ASP 876          1HB       ASP 876  -3.712   3.583  -9.741
  338   2HB   ASP 876          2HB       ASP 876  -2.438   3.924 -10.933
  339    H    GLY 877           H        GLY 877  -1.166   1.147  -7.995
  340   1HA   GLY 877          1HA       GLY 877   1.115   3.000  -8.377
  341   2HA   GLY 877          2HA       GLY 877   0.689   2.136  -6.882
  342    H    ASP 878           H        ASP 878   2.627   1.080  -6.513
  343    HA   ASP 878           HA       ASP 878   3.118  -1.275  -8.140
  344   1HB   ASP 878          1HB       ASP 878   4.634   1.184  -8.585
  345   2HB   ASP 878          2HB       ASP 878   5.682  -0.159  -8.081
  346    H    LEU 879           H        LEU 879   4.807  -2.654  -7.157
  347    HA   LEU 879           HA       LEU 879   5.392  -1.915  -4.336
  348   1HB   LEU 879          1HB       LEU 879   4.551  -4.703  -5.171
  349   2HB   LEU 879          2HB       LEU 879   4.636  -4.008  -3.534
  350    HG   LEU 879           HG       LEU 879   2.652  -3.339  -5.741
  351   1HD1  LEU 879          1HD1      LEU 879   1.654  -5.071  -4.613
  352   2HD1  LEU 879          2HD1      LEU 879   2.637  -4.820  -3.150
  353   3HD1  LEU 879          3HD1      LEU 879   1.230  -3.776  -3.466
  354   1HD2  LEU 879          1HD2      LEU 879   2.002  -1.954  -3.359
  355   2HD2  LEU 879          2HD2      LEU 879   3.735  -1.654  -3.634
  356   3HD2  LEU 879          3HD2      LEU 879   2.550  -1.249  -4.899
  357    H    VAL 880           H        VAL 880   7.519  -2.029  -3.964
  358    HA   VAL 880           HA       VAL 880   9.159  -3.697  -5.796
  359    HB   VAL 880           HB       VAL 880  10.620  -1.943  -3.980
  360   1HG1  VAL 880          1HG1      VAL 880  11.931  -2.128  -5.804
  361   2HG1  VAL 880          2HG1      VAL 880  10.602  -2.875  -6.723
  362   3HG1  VAL 880          3HG1      VAL 880  10.778  -1.104  -6.692
  363   1HG2  VAL 880          1HG2      VAL 880   9.676   0.076  -5.515
  364   2HG2  VAL 880          2HG2      VAL 880   8.193  -0.900  -5.381
  365   3HG2  VAL 880          3HG2      VAL 880   9.003  -0.307  -3.912
  366    H    GLN 881           H        GLN 881  10.403  -5.359  -5.037
  367    HA   GLN 881           HA       GLN 881   9.729  -6.534  -2.535
  368   1HB   GLN 881          1HB       GLN 881  12.225  -7.057  -4.186
  369   2HB   GLN 881          2HB       GLN 881  11.377  -8.183  -3.098
  370   1HG   GLN 881          1HG       GLN 881   9.941  -8.785  -4.726
  371   2HG   GLN 881          2HG       GLN 881   9.555  -7.089  -5.088
  372   1HE2  GLN 881          1HE2      GLN 881  11.190  -9.935  -6.134
  373   2HE2  GLN 881          2HE2      GLN 881  12.009  -9.249  -7.521
  374    H    GLU 882           H        GLU 882  10.574  -6.326  -0.524
  375    HA   GLU 882           HA       GLU 882  11.813  -4.232   0.524
  376   1HB   GLU 882          1HB       GLU 882  11.226  -6.325   1.752
  377   2HB   GLU 882          2HB       GLU 882  12.718  -7.073   1.133
  378   1HG   GLU 882          1HG       GLU 882  13.785  -4.812   2.119
  379   2HG   GLU 882          2HG       GLU 882  12.361  -4.910   3.177
  380    H    PHE 883           H        PHE 883  13.943  -6.996  -0.386
  381    HA   PHE 883           HA       PHE 883  16.296  -5.410  -0.442
  382   1HB   PHE 883          1HB       PHE 883  17.352  -7.341  -1.324
  383   2HB   PHE 883          2HB       PHE 883  16.085  -7.928  -0.233
  384    HD1  PHE 883           1HD      PHE 883  17.152  -7.608  -3.748
  385    HD2  PHE 883           2HD      PHE 883  14.127  -9.091  -1.084
  386    HE1  PHE 883           1HE      PHE 883  16.209  -8.982  -5.584
  387    HE2  PHE 883           2HE      PHE 883  13.184 -10.465  -2.920
  388    HZ   PHE 883           HZ       PHE 883  14.225 -10.411  -5.170
  389    H    ASP 884           H        ASP 884  13.698  -4.888  -2.277
  390    HA   ASP 884           HA       ASP 884  15.345  -3.917  -4.543
  391   1HB   ASP 884          1HB       ASP 884  12.762  -5.507  -4.765
  392   2HB   ASP 884          2HB       ASP 884  13.565  -4.670  -6.112
  393    H    MET 885           H        MET 885  15.172  -1.779  -3.908
  394    HA   MET 885           HA       MET 885  12.502  -0.595  -4.275
  395   1HB   MET 885          1HB       MET 885  13.305   0.814  -2.087
  396   2HB   MET 885          2HB       MET 885  12.204  -0.583  -2.016
  397   1HG   MET 885          1HG       MET 885  14.341  -2.019  -1.858
  398   2HG   MET 885          2HG       MET 885  15.188  -0.503  -1.508
  399   1HE   MET 885          1HE       MET 885  12.350  -2.983   0.978
  400   2HE   MET 885          2HE       MET 885  11.440  -1.700   0.145
  401   3HE   MET 885          3HE       MET 885  12.438  -2.836  -0.794
  402    H    THR 886           H        THR 886  16.015  -0.286  -3.792
  403    HA   THR 886           HA       THR 886  16.908   2.097  -4.011
  404    HB   THR 886           HB       THR 886  18.436   1.537  -5.735
  405    HG1  THR 886           1HG      THR 886  17.879   0.402  -7.459
  406   1HG2  THR 886          1HG2      THR 886  18.306  -0.050  -3.740
  407   2HG2  THR 886          2HG2      THR 886  17.392  -1.159  -4.790
  408   3HG2  THR 886          3HG2      THR 886  19.068  -0.722  -5.202
  409    H    SER 887           H        SER 887  15.009   0.844  -6.814
  410    HA   SER 887           HA       SER 887  14.652   3.616  -7.758
  411   1HB   SER 887          1HB       SER 887  14.531   0.894  -8.906
  412   2HB   SER 887          2HB       SER 887  13.252   1.992  -9.480
  413    HG   SER 887           HG       SER 887  15.869   2.960  -9.310
  414    H    ALA 888           H        ALA 888  13.088   1.270  -5.799
  415    HA   ALA 888           HA       ALA 888  10.383   1.590  -6.336
  416   1HB   ALA 888          1HB       ALA 888  11.893   1.299  -3.717
  417   2HB   ALA 888          2HB       ALA 888  10.116   1.246  -3.822
  418   3HB   ALA 888          3HB       ALA 888  11.095   0.026  -4.672
  419    H    THR 889           H        THR 889   8.946   2.782  -4.447
  420    HA   THR 889           HA       THR 889   9.914   5.589  -4.286
  421    HB   THR 889           HB       THR 889   8.086   4.799  -6.158
  422    HG1  THR 889           1HG      THR 889   7.458   7.034  -6.056
  423   1HG2  THR 889          1HG2      THR 889   6.582   4.146  -4.169
  424   2HG2  THR 889          2HG2      THR 889   6.435   5.891  -3.855
  425   3HG2  THR 889          3HG2      THR 889   5.863   5.214  -5.398
  426    H    HIS 890           H        HIS 890   7.573   3.094  -3.205
  427    HA   HIS 890           HA       HIS 890   7.509   4.489  -0.569
  428   1HB   HIS 890          1HB       HIS 890   5.358   3.115  -2.178
  429   2HB   HIS 890          2HB       HIS 890   5.236   3.223  -0.412
  430    HD1  HIS 890           1HD      HIS 890   5.076   5.431  -3.531
  431    HD2  HIS 890           2HD      HIS 890   4.795   5.657   0.662
  432    HE1  HIS 890           1HE      HIS 890   4.138   7.745  -2.980
  433    H    VAL 891           H        VAL 891   7.140   3.020   1.289
  434    HA   VAL 891           HA       VAL 891   7.849   0.200   0.817
  435    HB   VAL 891           HB       VAL 891   9.612   0.499   2.709
  436   1HG1  VAL 891          1HG1      VAL 891  10.700  -0.098   0.797
  437   2HG1  VAL 891          2HG1      VAL 891   9.742   1.016  -0.207
  438   3HG1  VAL 891          3HG1      VAL 891  11.137   1.625   0.714
  439   1HG2  VAL 891          1HG2      VAL 891  10.711   2.773   2.573
  440   2HG2  VAL 891          2HG2      VAL 891   9.295   3.339   1.655
  441   3HG2  VAL 891          3HG2      VAL 891   9.102   2.786   3.336
  442    H    LEU 892           H        LEU 892   6.761  -1.102   2.192
  443    HA   LEU 892           HA       LEU 892   5.133   0.202   4.273
  444   1HB   LEU 892          1HB       LEU 892   4.718  -1.890   2.450
  445   2HB   LEU 892          2HB       LEU 892   4.866  -2.692   4.032
  446    HG   LEU 892           HG       LEU 892   3.263  -0.217   4.117
  447   1HD1  LEU 892          1HD1      LEU 892   2.386  -0.737   2.002
  448   2HD1  LEU 892          2HD1      LEU 892   2.566  -2.490   2.250
  449   3HD1  LEU 892          3HD1      LEU 892   1.276  -1.601   3.093
  450   1HD2  LEU 892          1HD2      LEU 892   1.780  -1.678   5.420
  451   2HD2  LEU 892          2HD2      LEU 892   2.691  -3.111   4.887
  452   3HD2  LEU 892          3HD2      LEU 892   3.466  -1.906   5.943
  453    H    GLY 893           H        GLY 893   5.754   0.258   6.349
  454   1HA   GLY 893          1HA       GLY 893   6.429  -0.978   8.324
  455   2HA   GLY 893          2HA       GLY 893   7.562  -1.905   7.315
  456    H    SER 894           H        SER 894   9.324  -0.605   6.220
  457    HA   SER 894           HA       SER 894  10.044   1.836   7.741
  458   1HB   SER 894          1HB       SER 894  11.645  -0.724   7.501
  459   2HB   SER 894          2HB       SER 894  12.431   0.846   7.794
  460    HG   SER 894           HG       SER 894  10.254  -0.072   9.347
  461    H    ARG 895           H        ARG 895  12.592   2.174   6.627
  462    HA   ARG 895           HA       ARG 895  12.002   2.291   3.708
  463   1HB   ARG 895          1HB       ARG 895  13.219   4.493   3.736
  464   2HB   ARG 895          2HB       ARG 895  11.676   4.511   4.623
  465   1HG   ARG 895          1HG       ARG 895  12.835   4.257   6.750
  466   2HG   ARG 895          2HG       ARG 895  14.395   4.050   5.918
  467   1HD   ARG 895          1HD       ARG 895  14.583   6.287   5.419
  468   2HD   ARG 895          2HD       ARG 895  12.827   6.511   5.267
  469    HE   ARG 895           HE       ARG 895  12.682   6.944   7.560
  470   1HH1  ARG 895          2HH2      ARG 895  15.910   5.825   6.649
  471   2HH1  ARG 895          1HH2      ARG 895  16.640   6.256   8.179
  472   1HH2  ARG 895          2HH1      ARG 895  13.647   7.512   9.582
  473   2HH2  ARG 895          1HH1      ARG 895  15.350   7.217   9.851
  474    H    ASP 896           H        ASP 896  14.350   1.972   6.350
  475    HA   ASP 896           HA       ASP 896  16.800   2.002   5.604
  476   1HB   ASP 896          1HB       ASP 896  16.403   0.548   7.395
  477   2HB   ASP 896          2HB       ASP 896  15.298  -0.474   6.450
  478    H    LYS 897           H        LYS 897  15.376  -1.052   4.402
  479    HA   LYS 897           HA       LYS 897  17.033  -1.674   2.398
  480   1HB   LYS 897          1HB       LYS 897  14.481  -1.919   1.185
  481   2HB   LYS 897          2HB       LYS 897  15.374  -3.157   2.100
  482   1HG   LYS 897          1HG       LYS 897  13.331  -2.977   3.273
  483   2HG   LYS 897          2HG       LYS 897  14.438  -1.948   4.214
  484   1HD   LYS 897          1HD       LYS 897  13.598  -0.039   2.614
  485   2HD   LYS 897          2HD       LYS 897  12.232  -1.139   2.312
  486   1HE   LYS 897          1HE       LYS 897  12.715  -1.109   5.131
  487   2HE   LYS 897          2HE       LYS 897  12.694   0.579   4.576
  488   1HZ   LYS 897          1HZ       LYS 897  10.535   0.431   4.464
  489   2HZ   LYS 897          2HZ       LYS 897  10.635  -0.761   3.329
  490   3HZ   LYS 897          3HZ       LYS 897  10.558  -1.151   4.930
  491    H    ASN 898           H        ASN 898  14.783   1.067   2.363
  492    HA   ASN 898           HA       ASN 898  16.280   2.256   0.162
  493   1HB   ASN 898          1HB       ASN 898  14.136   0.642  -0.528
  494   2HB   ASN 898          2HB       ASN 898  13.406   2.261  -0.460
  495   1HD2  ASN 898          1HD2      ASN 898  13.193   2.809  -2.590
  496   2HD2  ASN 898          2HD2      ASN 898  14.517   2.865  -3.734
  497    HA   PRO 899           HA       PRO 899  14.830   5.348   3.142
  498   1HB   PRO 899          1HB       PRO 899  16.932   7.052   2.820
  499   2HB   PRO 899          2HB       PRO 899  17.089   5.519   3.739
  500   1HG   PRO 899          1HG       PRO 899  17.791   5.998   0.828
  501   2HG   PRO 899          2HG       PRO 899  18.836   5.276   2.095
  502   1HD   PRO 899          1HD       PRO 899  17.389   3.719   0.391
  503   2HD   PRO 899          2HD       PRO 899  17.541   3.275   2.118
  504    H    ALA 900           H        ALA 900  15.204   5.174  -0.235
  505    HA   ALA 900           HA       ALA 900  14.403   7.970  -0.711
  506   1HB   ALA 900          1HB       ALA 900  15.815   5.941  -2.158
  507   2HB   ALA 900          2HB       ALA 900  14.353   6.361  -3.082
  508   3HB   ALA 900          3HB       ALA 900  15.515   7.631  -2.629
  509    H    ALA 901           H        ALA 901  12.899   5.163   0.229
  510    HA   ALA 901           HA       ALA 901  10.501   5.599  -1.456
  511   1HB   ALA 901          1HB       ALA 901  11.215   3.408   0.534
  512   2HB   ALA 901          2HB       ALA 901   9.742   3.461  -0.464
  513   3HB   ALA 901          3HB       ALA 901  11.335   3.295  -1.239
  514    H    GLN 902           H        GLN 902   8.613   4.589   0.428
  515    HA   GLN 902           HA       GLN 902   8.648   6.747   2.485
  516   1HB   GLN 902          1HB       GLN 902   6.611   5.990   0.440
  517   2HB   GLN 902          2HB       GLN 902   6.003   6.377   2.067
  518   1HG   GLN 902          1HG       GLN 902   7.738   8.122   0.277
  519   2HG   GLN 902          2HG       GLN 902   6.065   8.431   0.790
  520   1HE2  GLN 902          1HE2      GLN 902   6.275   7.664   3.522
  521   2HE2  GLN 902          2HE2      GLN 902   7.293   8.827   4.343
  522    H    GLN 903           H        GLN 903   8.280   6.094   4.539
  523    HA   GLN 903           HA       GLN 903   7.905   3.221   4.994
  524   1HB   GLN 903          1HB       GLN 903   8.352   5.556   6.896
  525   2HB   GLN 903          2HB       GLN 903   8.341   3.837   7.355
  526   1HG   GLN 903          1HG       GLN 903  10.545   3.801   6.878
  527   2HG   GLN 903          2HG       GLN 903  10.092   3.965   5.168
  528   1HE2  GLN 903          1HE2      GLN 903  10.006   6.110   4.215
  529   2HE2  GLN 903          2HE2      GLN 903  10.953   7.414   4.900
  530    H    VAL 904           H        VAL 904   5.668   3.438   3.958
  531    HA   VAL 904           HA       VAL 904   3.655   4.668   5.712
  532    HB   VAL 904           HB       VAL 904   2.362   4.691   3.857
  533   1HG1  VAL 904          1HG1      VAL 904   4.657   3.561   2.256
  534   2HG1  VAL 904          2HG1      VAL 904   3.584   4.929   1.877
  535   3HG1  VAL 904          3HG1      VAL 904   4.859   5.112   3.105
  536   1HG2  VAL 904          1HG2      VAL 904   3.291   1.821   3.558
  537   2HG2  VAL 904          2HG2      VAL 904   1.661   2.430   3.930
  538   3HG2  VAL 904          3HG2      VAL 904   2.329   2.617   2.290
  539    H    SER 905           H        SER 905   1.617   3.250   6.093
  540    HA   SER 905           HA       SER 905   2.478   0.501   6.855
  541   1HB   SER 905          1HB       SER 905   1.942   2.615   8.615
  542   2HB   SER 905          2HB       SER 905   0.444   1.654   8.606
  543    HG   SER 905           HG       SER 905   1.978   0.881  10.124
  544    HA   PRO 906           HA       PRO 906  -1.420  -0.977   5.408
  545   1HB   PRO 906          1HB       PRO 906  -2.785  -2.118   7.471
  546   2HB   PRO 906          2HB       PRO 906  -1.203  -2.756   6.917
  547   1HG   PRO 906          1HG       PRO 906  -1.709  -0.835   9.207
  548   2HG   PRO 906          2HG       PRO 906  -0.770  -2.363   9.255
  549   1HD   PRO 906          1HD       PRO 906   0.453   0.047   8.902
  550   2HD   PRO 906          2HD       PRO 906   1.001  -1.391   7.989
  551    H    GLU 907           H        GLU 907  -1.625   1.215   8.182
  552    HA   GLU 907           HA       GLU 907  -4.430   1.795   7.901
  553   1HB   GLU 907          1HB       GLU 907  -2.085   2.903   9.399
  554   2HB   GLU 907          2HB       GLU 907  -3.509   3.950   9.193
  555   1HG   GLU 907          1HG       GLU 907  -4.032   2.813  11.168
  556   2HG   GLU 907          2HG       GLU 907  -4.849   1.818   9.943
  557    H    TRP 908           H        TRP 908  -1.441   3.006   6.443
  558    HA   TRP 908           HA       TRP 908  -2.550   5.426   5.386
  559   1HB   TRP 908          1HB       TRP 908  -0.167   5.124   5.616
  560   2HB   TRP 908          2HB       TRP 908  -0.199   3.695   4.574
  561    HD1  TRP 908           HD       TRP 908  -0.464   7.508   4.438
  562    HE1  TRP 908           1HE      TRP 908   0.045   8.328   2.081
  563    HE3  TRP 908           3HE      TRP 908  -0.175   2.987   2.055
  564    HZ2  TRP 908           2HZ      TRP 908   0.521   7.172  -0.529
  565    HZ3  TRP 908           3HZ      TRP 908   0.307   2.887  -0.363
  566    HH2  TRP 908           HH       TRP 908   0.656   4.965  -1.666
  567    H    ILE 909           H        ILE 909  -2.068   2.128   4.034
  568    HA   ILE 909           HA       ILE 909  -3.008   2.626   1.439
  569    HB   ILE 909           HB       ILE 909  -2.772   0.260   3.248
  570   1HG1  ILE 909          1HG1      ILE 909  -2.046  -0.083   0.461
  571   2HG1  ILE 909          2HG1      ILE 909  -1.382   1.450   1.077
  572   1HG2  ILE 909          1HG2      ILE 909  -4.825   0.558   1.129
  573   2HG2  ILE 909          2HG2      ILE 909  -3.793  -0.883   0.963
  574   3HG2  ILE 909          3HG2      ILE 909  -4.721  -0.620   2.459
  575   1HD1  ILE 909          1HD1      ILE 909  -0.848  -1.371   1.983
  576   2HD1  ILE 909          2HD1      ILE 909   0.292  -0.028   1.728
  577   3HD1  ILE 909          3HD1      ILE 909  -0.744  -0.054   3.176
  578    H    TRP 910           H        TRP 910  -4.837   1.554   4.360
  579    HA   TRP 910           HA       TRP 910  -7.374   1.486   3.106
  580   1HB   TRP 910          1HB       TRP 910  -6.767   2.187   5.991
  581   2HB   TRP 910          2HB       TRP 910  -8.260   1.491   5.347
  582    HD1  TRP 910           HD       TRP 910  -5.501   0.475   7.312
  583    HE1  TRP 910           1HE      TRP 910  -4.987  -2.015   7.172
  584    HE3  TRP 910           3HE      TRP 910  -8.135  -0.656   3.072
  585    HZ2  TRP 910           2HZ      TRP 910  -5.634  -4.238   5.435
  586    HZ3  TRP 910           3HZ      TRP 910  -8.162  -2.967   2.207
  587    HH2  TRP 910           HH       TRP 910  -6.920  -4.765   3.373
  588    H    ALA 911           H        ALA 911  -6.058   4.022   5.318
  589    HA   ALA 911           HA       ALA 911  -8.069   5.913   4.899
  590   1HB   ALA 911          1HB       ALA 911  -5.190   6.753   5.194
  591   2HB   ALA 911          2HB       ALA 911  -6.647   7.411   5.977
  592   3HB   ALA 911          3HB       ALA 911  -5.982   5.847   6.505
  593    H    CYS 912           H        CYS 912  -5.283   5.048   2.891
  594    HA   CYS 912           HA       CYS 912  -5.440   7.347   1.166
  595   1HB   CYS 912          1HB       CYS 912  -4.179   4.593   0.908
  596   2HB   CYS 912          2HB       CYS 912  -4.032   5.854  -0.341
  597    HG   CYS 912           HG       CYS 912  -2.072   6.724   0.625
  598    H    ILE 913           H        ILE 913  -5.940   3.933   0.166
  599    HA   ILE 913           HA       ILE 913  -7.429   4.375  -2.088
  600    HB   ILE 913           HB       ILE 913  -6.739   2.153  -1.487
  601   1HG1  ILE 913          1HG1      ILE 913  -9.777   2.314  -1.288
  602   2HG1  ILE 913          2HG1      ILE 913  -8.849   2.365  -2.806
  603   1HG2  ILE 913          1HG2      ILE 913  -8.650   1.529   0.599
  604   2HG2  ILE 913          2HG2      ILE 913  -6.874   1.401   0.634
  605   3HG2  ILE 913          3HG2      ILE 913  -7.666   2.930   1.088
  606   1HD1  ILE 913          1HD1      ILE 913  -8.174   0.109  -0.993
  607   2HD1  ILE 913          2HD1      ILE 913  -9.818   0.064  -1.673
  608   3HD1  ILE 913          3HD1      ILE 913  -8.408   0.125  -2.757
  609    H    ARG 914           H        ARG 914  -8.596   4.368   1.295
  610    HA   ARG 914           HA       ARG 914 -11.367   4.658   0.610
  611   1HB   ARG 914          1HB       ARG 914 -10.309   3.875   2.823
  612   2HB   ARG 914          2HB       ARG 914 -10.044   5.600   3.169
  613   1HG   ARG 914          1HG       ARG 914 -12.689   5.506   2.276
  614   2HG   ARG 914          2HG       ARG 914 -12.526   4.033   3.261
  615   1HD   ARG 914          1HD       ARG 914 -11.194   6.277   4.544
  616   2HD   ARG 914          2HD       ARG 914 -12.886   6.682   4.184
  617    HE   ARG 914           HE       ARG 914 -13.098   4.192   5.284
  618   1HH1  ARG 914          2HH2      ARG 914 -11.444   7.162   6.258
  619   2HH1  ARG 914          1HH2      ARG 914 -11.599   6.848   7.972
  620   1HH2  ARG 914          2HH1      ARG 914 -13.302   3.778   7.549
  621   2HH2  ARG 914          1HH1      ARG 914 -12.658   4.919   8.708
  622    H    LYS 915           H        LYS 915  -8.639   6.873   0.970
  623    HA   LYS 915           HA       LYS 915 -10.400   9.224   0.963
  624   1HB   LYS 915          1HB       LYS 915  -7.415   8.755   1.135
  625   2HB   LYS 915          2HB       LYS 915  -8.084  10.380   0.854
  626   1HG   LYS 915          1HG       LYS 915  -9.052   8.611   3.124
  627   2HG   LYS 915          2HG       LYS 915  -7.660   9.704   3.308
  628   1HD   LYS 915          1HD       LYS 915  -8.983  11.637   2.916
  629   2HD   LYS 915          2HD       LYS 915 -10.322  10.684   2.231
  630   1HE   LYS 915          1HE       LYS 915 -11.134  10.093   4.289
  631   2HE   LYS 915          2HE       LYS 915  -9.515   9.996   5.016
  632   1HZ   LYS 915          1HZ       LYS 915  -9.721  12.575   4.550
  633   2HZ   LYS 915          2HZ       LYS 915 -11.309  12.222   4.825
  634   3HZ   LYS 915          3HZ       LYS 915 -10.174  11.867   5.968
  635    H    ARG 916           H        ARG 916  -9.025   7.076  -1.295
  636    HA   ARG 916           HA       ARG 916  -8.969   7.109  -3.585
  637   1HB   ARG 916          1HB       ARG 916 -10.735   9.460  -2.963
  638   2HB   ARG 916          2HB       ARG 916 -10.140   9.252  -4.628
  639   1HG   ARG 916          1HG       ARG 916 -12.259   8.088  -4.446
  640   2HG   ARG 916          2HG       ARG 916 -10.971   6.863  -4.537
  641   1HD   ARG 916          1HD       ARG 916 -12.559   6.270  -2.767
  642   2HD   ARG 916          2HD       ARG 916 -10.987   6.692  -2.056
  643    HE   ARG 916           HE       ARG 916 -12.231   9.069  -1.917
  644   1HH1  ARG 916          2HH2      ARG 916 -13.369   5.805  -1.174
  645   2HH1  ARG 916          1HH2      ARG 916 -14.485   6.329   0.067
  646   1HH2  ARG 916          2HH1      ARG 916 -13.706   9.761  -0.278
  647   2HH2  ARG 916          1HH1      ARG 916 -14.677   8.584   0.578
  648    H    ARG 917           H        ARG 917  -7.422   9.253  -1.566
  649    HA   ARG 917           HA       ARG 917  -5.560  10.019  -3.732
  650   1HB   ARG 917          1HB       ARG 917  -5.596  12.278  -2.135
  651   2HB   ARG 917          2HB       ARG 917  -6.400  12.119  -3.715
  652   1HG   ARG 917          1HG       ARG 917  -7.846  11.072  -1.303
  653   2HG   ARG 917          2HG       ARG 917  -7.751  12.838  -1.510
  654   1HD   ARG 917          1HD       ARG 917  -8.496  12.376  -3.957
  655   2HD   ARG 917          2HD       ARG 917  -8.974  10.773  -3.359
  656    HE   ARG 917           HE       ARG 917 -10.137  12.520  -1.570
  657   1HH1  ARG 917          2HH2      ARG 917 -10.150  12.133  -5.084
  658   2HH1  ARG 917          1HH2      ARG 917 -11.767  12.769  -5.285
  659   1HH2  ARG 917          2HH1      ARG 917 -12.273  13.360  -1.835
  660   2HH2  ARG 917          1HH1      ARG 917 -12.978  13.468  -3.433
  661    H    LEU 918           H        LEU 918  -3.634   9.245  -3.123
  662    HA   LEU 918           HA       LEU 918  -2.864   8.071  -0.826
  663   1HB   LEU 918          1HB       LEU 918  -1.369   9.850  -2.744
  664   2HB   LEU 918          2HB       LEU 918  -0.538   9.209  -1.307
  665    HG   LEU 918           HG       LEU 918  -0.238   7.268  -2.413
  666   1HD1  LEU 918          1HD1      LEU 918  -3.280   7.295  -2.371
  667   2HD1  LEU 918          2HD1      LEU 918  -2.332   5.897  -2.932
  668   3HD1  LEU 918          3HD1      LEU 918  -2.179   6.458  -1.250
  669   1HD2  LEU 918          1HD2      LEU 918  -0.302   8.381  -4.536
  670   2HD2  LEU 918          2HD2      LEU 918  -1.340   6.944  -4.704
  671   3HD2  LEU 918          3HD2      LEU 918  -2.073   8.549  -4.471
  672    H    VAL 919           H        VAL 919  -2.807   8.568   1.280
  673    HA   VAL 919           HA       VAL 919  -2.977  11.422   2.041
  674    HB   VAL 919           HB       VAL 919  -4.023  10.705   3.972
  675   1HG1  VAL 919          1HG1      VAL 919  -4.743   9.348   1.595
  676   2HG1  VAL 919          2HG1      VAL 919  -4.782   8.118   2.881
  677   3HG1  VAL 919          3HG1      VAL 919  -5.754   9.600   3.038
  678   1HG2  VAL 919          1HG2      VAL 919  -2.696   7.978   3.698
  679   2HG2  VAL 919          2HG2      VAL 919  -2.002   9.321   4.637
  680   3HG2  VAL 919          3HG2      VAL 919  -3.568   8.619   5.110
  681    H    ALA 920           H        ALA 920  -1.918  11.314   4.602
  682    HA   ALA 920           HA       ALA 920   0.880  11.571   4.051
  683   1HB   ALA 920          1HB       ALA 920   0.812  11.584   6.729
  684   2HB   ALA 920          2HB       ALA 920   0.237  12.965   5.765
  685   3HB   ALA 920          3HB       ALA 920  -0.929  11.794   6.426
  686    HA   PRO 921           HA       PRO 921   1.722   7.198   4.510
  687   1HB   PRO 921          1HB       PRO 921   4.312   7.296   3.670
  688   2HB   PRO 921          2HB       PRO 921   2.941   7.517   2.535
  689   1HG   PRO 921          1HG       PRO 921   4.552   9.684   3.914
  690   2HG   PRO 921          2HG       PRO 921   4.205   9.536   2.161
  691   1HD   PRO 921          1HD       PRO 921   2.684  11.112   3.782
  692   2HD   PRO 921          2HD       PRO 921   1.920  10.130   2.495
  693    H    CYS 922           H        CYS 922   2.292   6.187   6.362
  694    HA   CYS 922           HA       CYS 922   3.706   5.692   8.174
  695   1HB   CYS 922          1HB       CYS 922   5.375   7.359   7.053
  696   2HB   CYS 922          2HB       CYS 922   4.704   8.547   8.199
  697    HG   CYS 922           HG       CYS 922   4.969   5.944   9.799
  Start of MODEL   13
    1    H    GLY 835           H        GLY 835 -12.306  -3.366  12.826
    2   1HA   GLY 835          1HA       GLY 835 -14.823  -3.052  11.257
    3   2HA   GLY 835          2HA       GLY 835 -14.325  -2.016  12.614
    4    H    SER 836           H        SER 836 -12.892  -3.209   9.515
    5    HA   SER 836           HA       SER 836 -12.586  -0.482   8.549
    6   1HB   SER 836          1HB       SER 836 -10.228  -2.096   9.552
    7   2HB   SER 836          2HB       SER 836 -10.042  -0.858   8.286
    8    HG   SER 836           HG       SER 836 -10.173   0.590   9.777
    9    H    ALA 837           H        ALA 837 -10.262  -2.986   7.730
   10    HA   ALA 837           HA       ALA 837 -10.587  -3.013   5.037
   11   1HB   ALA 837          1HB       ALA 837 -10.332  -5.635   6.524
   12   2HB   ALA 837          2HB       ALA 837  -9.530  -5.116   5.022
   13   3HB   ALA 837          3HB       ALA 837  -9.035  -4.416   6.582
   14    H    ASP 838           H        ASP 838 -12.287  -5.404   7.149
   15    HA   ASP 838           HA       ASP 838 -13.962  -6.541   5.301
   16   1HB   ASP 838          1HB       ASP 838 -15.415  -7.087   7.121
   17   2HB   ASP 838          2HB       ASP 838 -13.767  -7.034   7.782
   18    H    GLU 839           H        GLU 839 -14.349  -3.363   6.900
   19    HA   GLU 839           HA       GLU 839 -16.924  -2.870   5.658
   20   1HB   GLU 839          1HB       GLU 839 -15.185  -1.640   7.635
   21   2HB   GLU 839          2HB       GLU 839 -15.772  -0.429   6.470
   22   1HG   GLU 839          1HG       GLU 839 -17.845  -2.349   7.302
   23   2HG   GLU 839          2HG       GLU 839 -17.191  -1.398   8.653
   24    H    THR 840           H        THR 840 -13.514  -2.197   4.942
   25    HA   THR 840           HA       THR 840 -14.265  -0.483   2.667
   26    HB   THR 840           HB       THR 840 -11.552  -1.400   3.700
   27    HG1  THR 840           1HG      THR 840 -12.806  -0.037   5.101
   28   1HG2  THR 840          1HG2      THR 840 -12.213   0.923   1.854
   29   2HG2  THR 840          2HG2      THR 840 -10.615   0.229   2.219
   30   3HG2  THR 840          3HG2      THR 840 -11.783  -0.692   1.240
   31    H    LEU 841           H        LEU 841 -12.062  -3.313   3.094
   32    HA   LEU 841           HA       LEU 841 -11.976  -4.010   0.372
   33   1HB   LEU 841          1HB       LEU 841 -10.439  -4.852   2.137
   34   2HB   LEU 841          2HB       LEU 841 -11.766  -5.837   2.797
   35    HG   LEU 841           HG       LEU 841 -10.944  -7.437   1.387
   36   1HD1  LEU 841          1HD1      LEU 841 -11.913  -7.251  -0.940
   37   2HD1  LEU 841          2HD1      LEU 841 -13.088  -6.941   0.361
   38   3HD1  LEU 841          3HD1      LEU 841 -12.389  -5.580  -0.549
   39   1HD2  LEU 841          1HD2      LEU 841  -8.934  -6.725   0.578
   40   2HD2  LEU 841          2HD2      LEU 841  -9.852  -6.399  -0.911
   41   3HD2  LEU 841          3HD2      LEU 841  -9.539  -5.084   0.248
   42    H    CYS 842           H        CYS 842 -14.640  -3.988   2.417
   43    HA   CYS 842           HA       CYS 842 -16.033  -6.344   1.895
   44   1HB   CYS 842          1HB       CYS 842 -16.562  -3.873   3.075
   45   2HB   CYS 842          2HB       CYS 842 -17.719  -3.950   1.723
   46    HG   CYS 842           HG       CYS 842 -19.262  -5.339   2.804
   47    H    GLN 843           H        GLN 843 -14.835  -4.103  -0.354
   48    HA   GLN 843           HA       GLN 843 -16.825  -5.001  -2.386
   49   1HB   GLN 843          1HB       GLN 843 -15.038  -2.605  -2.754
   50   2HB   GLN 843          2HB       GLN 843 -16.648  -2.935  -3.439
   51   1HG   GLN 843          1HG       GLN 843 -16.890  -2.928  -0.584
   52   2HG   GLN 843          2HG       GLN 843 -15.979  -1.476  -1.055
   53   1HE2  GLN 843          1HE2      GLN 843 -17.098   0.261  -1.777
   54   2HE2  GLN 843          2HE2      GLN 843 -18.774   0.240  -2.281
   55    H    THR 844           H        THR 844 -14.770  -6.743  -1.662
   56    HA   THR 844           HA       THR 844 -12.889  -7.820  -2.449
   57    HB   THR 844           HB       THR 844 -14.824  -7.393  -4.580
   58    HG1  THR 844           1HG      THR 844 -14.748  -9.432  -4.145
   59   1HG2  THR 844          1HG2      THR 844 -11.880  -7.354  -5.241
   60   2HG2  THR 844          2HG2      THR 844 -13.008  -8.204  -6.324
   61   3HG2  THR 844          3HG2      THR 844 -13.220  -6.466  -6.005
   62    H    LYS 845           H        LYS 845 -11.208  -6.487  -1.719
   63    HA   LYS 845           HA       LYS 845  -9.502  -4.953  -1.868
   64   1HB   LYS 845          1HB       LYS 845  -9.642  -6.010  -4.716
   65   2HB   LYS 845          2HB       LYS 845  -8.300  -5.027  -4.083
   66   1HG   LYS 845          1HG       LYS 845  -7.757  -7.424  -3.915
   67   2HG   LYS 845          2HG       LYS 845  -7.931  -6.715  -2.292
   68   1HD   LYS 845          1HD       LYS 845 -10.529  -7.557  -3.092
   69   2HD   LYS 845          2HD       LYS 845  -9.418  -8.888  -3.492
   70   1HE   LYS 845          1HE       LYS 845  -8.586  -7.922  -0.967
   71   2HE   LYS 845          2HE       LYS 845 -10.360  -7.997  -0.891
   72   1HZ   LYS 845          1HZ       LYS 845  -8.483 -10.159  -1.483
   73   2HZ   LYS 845          2HZ       LYS 845  -9.602 -10.072  -0.275
   74   3HZ   LYS 845          3HZ       LYS 845 -10.089 -10.275  -1.838
   75    H    VAL 846           H        VAL 846 -12.437  -4.412  -3.384
   76    HA   VAL 846           HA       VAL 846 -13.250  -2.621  -4.677
   77    HB   VAL 846           HB       VAL 846 -13.868  -1.101  -3.099
   78   1HG1  VAL 846          1HG1      VAL 846 -14.025  -2.190  -1.094
   79   2HG1  VAL 846          2HG1      VAL 846 -13.254  -3.522  -1.987
   80   3HG1  VAL 846          3HG1      VAL 846 -12.267  -2.438  -0.978
   81   1HG2  VAL 846          1HG2      VAL 846 -11.938  -0.305  -1.404
   82   2HG2  VAL 846          2HG2      VAL 846 -10.901  -0.845  -2.746
   83   3HG2  VAL 846          3HG2      VAL 846 -12.127   0.416  -3.021
   84    H    LEU 847           H        LEU 847 -10.054  -1.715  -3.264
   85    HA   LEU 847           HA       LEU 847  -8.211  -0.806  -4.304
   86   1HB   LEU 847          1HB       LEU 847  -9.790  -0.735  -6.893
   87   2HB   LEU 847          2HB       LEU 847  -8.024  -0.776  -6.678
   88    HG   LEU 847           HG       LEU 847  -8.771  -3.005  -7.303
   89   1HD1  LEU 847          1HD1      LEU 847  -7.744  -4.226  -5.566
   90   2HD1  LEU 847          2HD1      LEU 847  -7.080  -2.588  -5.354
   91   3HD1  LEU 847          3HD1      LEU 847  -8.398  -3.157  -4.302
   92   1HD2  LEU 847          1HD2      LEU 847 -10.548  -2.996  -4.837
   93   2HD2  LEU 847          2HD2      LEU 847 -11.154  -2.560  -6.453
   94   3HD2  LEU 847          3HD2      LEU 847 -10.504  -4.190  -6.156
   95    H    LEU 848           H        LEU 848  -9.399   0.945  -6.853
   96    HA   LEU 848           HA       LEU 848 -10.407   3.061  -7.021
   97   1HB   LEU 848          1HB       LEU 848 -10.521   2.623  -4.090
   98   2HB   LEU 848          2HB       LEU 848 -10.351   4.322  -4.594
   99    HG   LEU 848           HG       LEU 848 -12.412   2.417  -5.776
  100   1HD1  LEU 848          1HD1      LEU 848 -12.356   3.519  -3.164
  101   2HD1  LEU 848          2HD1      LEU 848 -13.487   4.528  -4.096
  102   3HD1  LEU 848          3HD1      LEU 848 -13.744   2.770  -3.990
  103   1HD2  LEU 848          1HD2      LEU 848 -12.226   4.164  -7.291
  104   2HD2  LEU 848          2HD2      LEU 848 -13.412   4.864  -6.163
  105   3HD2  LEU 848          3HD2      LEU 848 -11.696   5.324  -6.050
  106    H    ASP 849           H        ASP 849  -9.550   5.372  -6.685
  107    HA   ASP 849           HA       ASP 849  -6.709   5.317  -7.189
  108   1HB   ASP 849          1HB       ASP 849  -8.693   7.589  -6.804
  109   2HB   ASP 849          2HB       ASP 849  -7.008   7.798  -7.329
  110    H    ILE 850           H        ILE 850  -6.892   4.145  -4.767
  111    HA   ILE 850           HA       ILE 850  -6.749   6.007  -2.573
  112    HB   ILE 850           HB       ILE 850  -5.997   3.092  -2.948
  113   1HG1  ILE 850          1HG1      ILE 850  -7.962   2.690  -1.614
  114   2HG1  ILE 850          2HG1      ILE 850  -8.112   4.416  -1.207
  115   1HG2  ILE 850          1HG2      ILE 850  -4.463   3.867  -1.284
  116   2HG2  ILE 850          2HG2      ILE 850  -5.691   4.919  -0.540
  117   3HG2  ILE 850          3HG2      ILE 850  -5.822   3.151  -0.385
  118   1HD1  ILE 850          1HD1      ILE 850  -9.712   3.712  -2.995
  119   2HD1  ILE 850          2HD1      ILE 850  -8.573   4.962  -3.553
  120   3HD1  ILE 850          3HD1      ILE 850  -8.329   3.262  -4.020
  121    H    PHE 851           H        PHE 851  -4.151   3.733  -3.558
  122    HA   PHE 851           HA       PHE 851  -2.162   5.742  -2.782
  123   1HB   PHE 851          1HB       PHE 851  -1.563   3.056  -4.004
  124   2HB   PHE 851          2HB       PHE 851  -0.628   3.981  -2.817
  125    HD1  PHE 851           1HD      PHE 851  -3.644   1.869  -3.301
  126    HD2  PHE 851           2HD      PHE 851  -1.024   3.759  -0.471
  127    HE1  PHE 851           1HE      PHE 851  -4.687   0.566  -1.466
  128    HE2  PHE 851           2HE      PHE 851  -2.066   2.457   1.365
  129    HZ   PHE 851           HZ       PHE 851  -3.897   0.860   0.867
  130    H    THR 852           H        THR 852  -3.840   6.378  -5.077
  131    HA   THR 852           HA       THR 852  -3.100   5.919  -7.591
  132    HB   THR 852           HB       THR 852  -4.298   8.027  -6.317
  133    HG1  THR 852           1HG      THR 852  -4.958   7.583  -8.305
  134   1HG2  THR 852          1HG2      THR 852  -1.717   9.019  -7.599
  135   2HG2  THR 852          2HG2      THR 852  -3.086  10.064  -7.153
  136   3HG2  THR 852          3HG2      THR 852  -2.190   9.184  -5.891
  137    H    GLY 853           H        GLY 853  -1.176   5.309  -8.401
  138   1HA   GLY 853          1HA       GLY 853   1.099   5.248  -8.767
  139   2HA   GLY 853          2HA       GLY 853   0.941   7.016  -8.878
  140    H    VAL 854           H        VAL 854   1.245   4.347  -6.480
  141    HA   VAL 854           HA       VAL 854   2.896   6.198  -4.825
  142    HB   VAL 854           HB       VAL 854   0.651   4.335  -4.090
  143   1HG1  VAL 854          1HG1      VAL 854   2.260   3.333  -2.715
  144   2HG1  VAL 854          2HG1      VAL 854   3.200   4.836  -2.549
  145   3HG1  VAL 854          3HG1      VAL 854   1.662   4.646  -1.672
  146   1HG2  VAL 854          1HG2      VAL 854   0.261   6.759  -4.204
  147   2HG2  VAL 854          2HG2      VAL 854   0.185   6.210  -2.512
  148   3HG2  VAL 854          3HG2      VAL 854   1.636   7.050  -3.111
  149    H    ARG 855           H        ARG 855   4.691   5.263  -3.761
  150    HA   ARG 855           HA       ARG 855   5.524   2.665  -4.951
  151   1HB   ARG 855          1HB       ARG 855   7.024   5.107  -3.974
  152   2HB   ARG 855          2HB       ARG 855   7.834   3.534  -4.165
  153   1HG   ARG 855          1HG       ARG 855   6.341   5.091  -6.318
  154   2HG   ARG 855          2HG       ARG 855   8.097   4.815  -6.227
  155   1HD   ARG 855          1HD       ARG 855   7.876   2.834  -7.266
  156   2HD   ARG 855          2HD       ARG 855   6.728   2.284  -6.026
  157    HE   ARG 855           HE       ARG 855   5.076   3.754  -7.500
  158   1HH1  ARG 855          2HH2      ARG 855   7.668   1.579  -8.528
  159   2HH1  ARG 855          1HH2      ARG 855   6.896   1.151 -10.038
  160   1HH2  ARG 855          2HH1      ARG 855   4.057   3.189  -9.496
  161   2HH2  ARG 855          1HH1      ARG 855   4.837   2.069 -10.590
  162    H    LEU 856           H        LEU 856   3.746   2.331  -2.937
  163    HA   LEU 856           HA       LEU 856   5.074   2.202  -0.354
  164   1HB   LEU 856          1HB       LEU 856   2.788   2.542  -0.129
  165   2HB   LEU 856          2HB       LEU 856   2.386   1.465  -1.489
  166    HG   LEU 856           HG       LEU 856   2.152  -0.286  -0.088
  167   1HD1  LEU 856          1HD1      LEU 856   4.090  -0.811   1.559
  168   2HD1  LEU 856          2HD1      LEU 856   4.449  -0.861  -0.183
  169   3HD1  LEU 856          3HD1      LEU 856   4.932   0.553   0.785
  170   1HD2  LEU 856          1HD2      LEU 856   1.954   2.026   1.523
  171   2HD2  LEU 856          2HD2      LEU 856   1.334   0.400   1.901
  172   3HD2  LEU 856          3HD2      LEU 856   2.955   0.886   2.455
  173    H    TYR 857           H        TYR 857   6.561   0.702   0.123
  174    HA   TYR 857           HA       TYR 857   6.745  -1.747  -1.447
  175   1HB   TYR 857          1HB       TYR 857   8.865  -1.183  -0.917
  176   2HB   TYR 857          2HB       TYR 857   8.367  -0.237   0.495
  177    HD1  TYR 857           1HD      TYR 857   9.868  -0.978   2.153
  178    HD2  TYR 857           2HD      TYR 857   7.682  -3.846  -0.182
  179    HE1  TYR 857           1HE      TYR 857  10.653  -2.795   3.648
  180    HE2  TYR 857           2HE      TYR 857   8.467  -5.662   1.313
  181    HH   TYR 857           HH       TYR 857  10.381  -5.020   4.238
  182    H    LEU 858           H        LEU 858   4.859  -2.929  -1.012
  183    HA   LEU 858           HA       LEU 858   3.982  -3.439   1.690
  184   1HB   LEU 858          1HB       LEU 858   2.566  -3.465  -0.430
  185   2HB   LEU 858          2HB       LEU 858   3.326  -5.029  -0.812
  186    HG   LEU 858           HG       LEU 858   2.069  -6.124   0.722
  187   1HD1  LEU 858          1HD1      LEU 858   1.713  -5.170   3.050
  188   2HD1  LEU 858          2HD1      LEU 858   3.418  -5.368   2.577
  189   3HD1  LEU 858          3HD1      LEU 858   2.665  -3.755   2.539
  190   1HD2  LEU 858          1HD2      LEU 858  -0.072  -5.265   0.954
  191   2HD2  LEU 858          2HD2      LEU 858   0.512  -3.637   1.374
  192   3HD2  LEU 858          3HD2      LEU 858   0.549  -4.186  -0.319
  193    HA   PRO 859           HA       PRO 859   7.180  -6.525   2.316
  194   1HB   PRO 859          1HB       PRO 859   6.812  -6.790   5.002
  195   2HB   PRO 859          2HB       PRO 859   7.568  -5.327   4.291
  196   1HG   PRO 859          1HG       PRO 859   4.659  -5.706   5.057
  197   2HG   PRO 859          2HG       PRO 859   5.747  -4.367   5.546
  198   1HD   PRO 859          1HD       PRO 859   4.056  -4.119   3.423
  199   2HD   PRO 859          2HD       PRO 859   5.713  -3.446   3.347
  200    HA   PRO 860           HA       PRO 860   4.618 -10.114   2.101
  201   1HB   PRO 860          1HB       PRO 860   6.457 -12.057   2.617
  202   2HB   PRO 860          2HB       PRO 860   6.540 -11.047   1.138
  203   1HG   PRO 860          1HG       PRO 860   8.022 -10.611   3.746
  204   2HG   PRO 860          2HG       PRO 860   8.721 -10.677   2.096
  205   1HD   PRO 860          1HD       PRO 860   8.096  -8.303   3.281
  206   2HD   PRO 860          2HD       PRO 860   7.774  -8.560   1.539
  207    H    SER 861           H        SER 861   6.365  -9.109   4.954
  208    HA   SER 861           HA       SER 861   5.202 -11.159   6.678
  209   1HB   SER 861          1HB       SER 861   7.324  -9.221   6.801
  210   2HB   SER 861          2HB       SER 861   6.219  -8.949   8.170
  211    HG   SER 861           HG       SER 861   7.954 -10.984   7.722
  212    H    THR 862           H        THR 862   4.148  -8.256   5.238
  213    HA   THR 862           HA       THR 862   2.485  -7.326   7.423
  214    HB   THR 862           HB       THR 862   3.088  -6.578   4.622
  215    HG1  THR 862           1HG      THR 862   2.929  -4.537   5.622
  216   1HG2  THR 862          1HG2      THR 862   0.403  -5.840   5.857
  217   2HG2  THR 862          2HG2      THR 862   1.021  -5.365   4.257
  218   3HG2  THR 862          3HG2      THR 862   0.604  -7.064   4.580
  219    HA   PRO 863           HA       PRO 863  -0.867 -10.123   6.849
  220   1HB   PRO 863          1HB       PRO 863  -2.816  -8.772   8.190
  221   2HB   PRO 863          2HB       PRO 863  -1.384  -9.449   9.032
  222   1HG   PRO 863          1HG       PRO 863  -1.759  -6.610   8.034
  223   2HG   PRO 863          2HG       PRO 863  -1.273  -7.129   9.681
  224   1HD   PRO 863          1HD       PRO 863   0.577  -6.415   7.811
  225   2HD   PRO 863          2HD       PRO 863   0.881  -7.798   8.906
  226    H    ASP 864           H        ASP 864  -2.949 -10.264   5.744
  227    HA   ASP 864           HA       ASP 864  -4.347  -9.812   3.989
  228   1HB   ASP 864          1HB       ASP 864  -3.912  -7.175   5.305
  229   2HB   ASP 864          2HB       ASP 864  -4.584  -7.134   3.661
  230    H    PHE 865           H        PHE 865  -1.164  -9.528   3.885
  231    HA   PHE 865           HA       PHE 865  -0.320  -7.881   1.870
  232   1HB   PHE 865          1HB       PHE 865   0.911  -9.725   3.208
  233   2HB   PHE 865          2HB       PHE 865   0.421 -10.810   1.896
  234    HD1  PHE 865           1HD      PHE 865   2.195 -11.270   0.490
  235    HD2  PHE 865           2HD      PHE 865   1.724  -7.280   2.009
  236    HE1  PHE 865           1HE      PHE 865   4.147 -10.530  -0.848
  237    HE2  PHE 865           2HE      PHE 865   3.676  -6.540   0.670
  238    HZ   PHE 865           HZ       PHE 865   4.888  -8.165  -0.758
  239    H    SER 866           H        SER 866  -1.772 -11.151   1.380
  240    HA   SER 866           HA       SER 866  -1.793 -11.545  -1.243
  241   1HB   SER 866          1HB       SER 866  -3.673 -12.049   0.892
  242   2HB   SER 866          2HB       SER 866  -4.557 -11.702  -0.613
  243    HG   SER 866           HG       SER 866  -3.057 -13.864   0.066
  244    H    ARG 867           H        ARG 867  -4.315  -9.390   0.190
  245    HA   ARG 867           HA       ARG 867  -4.883  -8.246  -2.424
  246   1HB   ARG 867          1HB       ARG 867  -5.825  -7.107   0.207
  247   2HB   ARG 867          2HB       ARG 867  -6.672  -7.187  -1.356
  248   1HG   ARG 867          1HG       ARG 867  -7.742  -8.925  -0.271
  249   2HG   ARG 867          2HG       ARG 867  -6.364  -9.823  -0.951
  250   1HD   ARG 867          1HD       ARG 867  -5.699 -10.370   1.124
  251   2HD   ARG 867          2HD       ARG 867  -5.503  -8.647   1.510
  252    HE   ARG 867           HE       ARG 867  -8.137  -8.891   1.879
  253   1HH1  ARG 867          2HH2      ARG 867  -5.496 -11.057   2.793
  254   2HH1  ARG 867          1HH2      ARG 867  -6.320 -11.689   4.202
  255   1HH2  ARG 867          2HH1      ARG 867  -9.225  -9.726   3.740
  256   2HH2  ARG 867          1HH1      ARG 867  -8.445 -10.930   4.741
  257    H    LEU 868           H        LEU 868  -3.645  -6.943   0.712
  258    HA   LEU 868           HA       LEU 868  -3.076  -4.395   0.250
  259   1HB   LEU 868          1HB       LEU 868  -1.183  -6.528   1.285
  260   2HB   LEU 868          2HB       LEU 868  -0.785  -4.793   1.331
  261    HG   LEU 868           HG       LEU 868  -2.855  -6.327   2.866
  262   1HD1  LEU 868          1HD1      LEU 868  -1.292  -5.642   4.375
  263   2HD1  LEU 868          2HD1      LEU 868  -0.671  -4.371   3.295
  264   3HD1  LEU 868          3HD1      LEU 868  -2.127  -4.073   4.274
  265   1HD2  LEU 868          1HD2      LEU 868  -4.171  -4.737   1.462
  266   2HD2  LEU 868          2HD2      LEU 868  -4.218  -4.310   3.189
  267   3HD2  LEU 868          3HD2      LEU 868  -3.170  -3.399   2.076
  268    H    ARG 869           H        ARG 869  -1.127  -7.059  -1.189
  269    HA   ARG 869           HA       ARG 869   0.460  -5.204  -2.760
  270   1HB   ARG 869          1HB       ARG 869   1.205  -7.474  -1.876
  271   2HB   ARG 869          2HB       ARG 869   0.164  -8.205  -3.121
  272   1HG   ARG 869          1HG       ARG 869   1.482  -7.423  -4.877
  273   2HG   ARG 869          2HG       ARG 869   2.119  -6.058  -3.928
  274   1HD   ARG 869          1HD       ARG 869   3.689  -8.088  -4.411
  275   2HD   ARG 869          2HD       ARG 869   3.648  -7.413  -2.768
  276    HE   ARG 869           HE       ARG 869   2.470  -9.319  -2.011
  277   1HH1  ARG 869          2HH2      ARG 869   3.136  -9.389  -5.483
  278   2HH1  ARG 869          1HH2      ARG 869   2.789 -11.095  -5.654
  279   1HH2  ARG 869          2HH1      ARG 869   2.012 -11.572  -2.237
  280   2HH2  ARG 869          1HH1      ARG 869   2.148 -12.340  -3.803
  281    H    ARG 870           H        ARG 870  -1.091  -8.058  -4.184
  282    HA   ARG 870           HA       ARG 870  -1.560  -7.248  -6.679
  283   1HB   ARG 870          1HB       ARG 870  -2.436  -9.338  -5.317
  284   2HB   ARG 870          2HB       ARG 870  -3.943  -8.394  -5.240
  285   1HG   ARG 870          1HG       ARG 870  -4.202  -9.625  -7.230
  286   2HG   ARG 870          2HG       ARG 870  -3.579  -8.063  -7.813
  287   1HD   ARG 870          1HD       ARG 870  -2.392  -9.979  -8.857
  288   2HD   ARG 870          2HD       ARG 870  -1.300  -8.971  -7.883
  289    HE   ARG 870           HE       ARG 870  -1.050 -10.718  -6.350
  290   1HH1  ARG 870          2HH2      ARG 870  -3.560 -11.428  -8.736
  291   2HH1  ARG 870          1HH2      ARG 870  -3.689 -13.118  -8.300
  292   1HH2  ARG 870          2HH1      ARG 870  -1.220 -12.950  -5.774
  293   2HH2  ARG 870          1HH1      ARG 870  -2.354 -13.985  -6.611
  294    H    TYR 871           H        TYR 871  -3.491  -6.172  -3.862
  295    HA   TYR 871           HA       TYR 871  -5.357  -4.634  -5.399
  296   1HB   TYR 871          1HB       TYR 871  -5.548  -5.496  -2.994
  297   2HB   TYR 871          2HB       TYR 871  -4.511  -4.134  -2.535
  298    HD1  TYR 871           1HD      TYR 871  -7.264  -4.526  -1.442
  299    HD2  TYR 871           2HD      TYR 871  -5.900  -2.452  -4.947
  300    HE1  TYR 871           1HE      TYR 871  -9.251  -3.046  -1.339
  301    HE2  TYR 871           2HE      TYR 871  -7.887  -0.971  -4.845
  302    HH   TYR 871           HH       TYR 871  -9.707  -0.320  -3.583
  303    H    PHE 872           H        PHE 872  -2.859  -3.395  -3.110
  304    HA   PHE 872           HA       PHE 872  -2.776  -0.783  -3.806
  305   1HB   PHE 872          1HB       PHE 872  -1.299  -2.055  -2.177
  306   2HB   PHE 872          2HB       PHE 872  -0.260  -2.454  -3.555
  307    HD1  PHE 872           1HD      PHE 872  -0.337  -0.434  -0.842
  308    HD2  PHE 872           2HD      PHE 872   0.010  -0.093  -5.110
  309    HE1  PHE 872           1HE      PHE 872   0.845   1.729  -0.573
  310    HE2  PHE 872           2HE      PHE 872   1.191   2.071  -4.841
  311    HZ   PHE 872           HZ       PHE 872   1.609   2.982  -2.572
  312    H    VAL 873           H        VAL 873  -0.100  -2.662  -5.213
  313    HA   VAL 873           HA       VAL 873   0.522  -1.126  -7.335
  314    HB   VAL 873           HB       VAL 873   1.848  -2.988  -7.297
  315   1HG1  VAL 873          1HG1      VAL 873   0.459  -5.338  -7.171
  316   2HG1  VAL 873          2HG1      VAL 873   1.016  -4.442  -5.738
  317   3HG1  VAL 873          3HG1      VAL 873  -0.659  -4.254  -6.309
  318   1HG2  VAL 873          1HG2      VAL 873   1.304  -4.524  -9.167
  319   2HG2  VAL 873          2HG2      VAL 873  -0.362  -3.897  -9.193
  320   3HG2  VAL 873          3HG2      VAL 873   0.999  -2.828  -9.613
  321    H    ALA 874           H        ALA 874  -2.371  -3.166  -7.055
  322    HA   ALA 874           HA       ALA 874  -3.194  -3.040  -9.769
  323   1HB   ALA 874          1HB       ALA 874  -4.385  -3.705  -7.131
  324   2HB   ALA 874          2HB       ALA 874  -5.539  -3.185  -8.382
  325   3HB   ALA 874          3HB       ALA 874  -4.472  -4.578  -8.680
  326    H    PHE 875           H        PHE 875  -4.553  -1.196  -6.973
  327    HA   PHE 875           HA       PHE 875  -6.185   0.583  -8.002
  328   1HB   PHE 875          1HB       PHE 875  -3.733   1.388  -6.402
  329   2HB   PHE 875          2HB       PHE 875  -5.205   2.358  -6.582
  330    HD1  PHE 875           1HD      PHE 875  -7.082   2.001  -5.192
  331    HD2  PHE 875           2HD      PHE 875  -3.886  -0.868  -5.250
  332    HE1  PHE 875           1HE      PHE 875  -8.078   0.851  -3.233
  333    HE2  PHE 875           2HE      PHE 875  -4.882  -2.018  -3.291
  334    HZ   PHE 875           HZ       PHE 875  -6.978  -1.158  -2.283
  335    H    ASP 876           H        ASP 876  -2.636   0.816  -8.542
  336    HA   ASP 876           HA       ASP 876  -2.401   1.407 -11.104
  337   1HB   ASP 876          1HB       ASP 876  -3.955   3.602  -9.827
  338   2HB   ASP 876          2HB       ASP 876  -2.661   4.102 -10.937
  339    H    GLY 877           H        GLY 877  -1.357   1.495  -8.025
  340   1HA   GLY 877          1HA       GLY 877   0.877   3.378  -8.421
  341   2HA   GLY 877          2HA       GLY 877   0.486   2.474  -6.940
  342    H    ASP 878           H        ASP 878   2.500   1.542  -6.591
  343    HA   ASP 878           HA       ASP 878   3.095  -0.797  -8.195
  344   1HB   ASP 878          1HB       ASP 878   5.515   0.842  -8.084
  345   2HB   ASP 878          2HB       ASP 878   4.809  -0.054  -9.447
  346    H    LEU 879           H        LEU 879   4.637  -2.177  -7.156
  347    HA   LEU 879           HA       LEU 879   5.393  -1.292  -4.414
  348   1HB   LEU 879          1HB       LEU 879   4.504  -4.101  -5.136
  349   2HB   LEU 879          2HB       LEU 879   4.719  -3.393  -3.517
  350    HG   LEU 879           HG       LEU 879   2.546  -2.836  -5.557
  351   1HD1  LEU 879          1HD1      LEU 879   1.212  -3.888  -4.056
  352   2HD1  LEU 879          2HD1      LEU 879   2.718  -4.462  -3.301
  353   3HD1  LEU 879          3HD1      LEU 879   1.918  -2.996  -2.686
  354   1HD2  LEU 879          1HD2      LEU 879   2.607  -0.651  -4.985
  355   2HD2  LEU 879          2HD2      LEU 879   2.139  -1.149  -3.342
  356   3HD2  LEU 879          3HD2      LEU 879   3.859  -0.947  -3.755
  357    H    VAL 880           H        VAL 880   7.512  -1.510  -3.994
  358    HA   VAL 880           HA       VAL 880   9.125  -3.101  -5.914
  359    HB   VAL 880           HB       VAL 880  10.575  -1.449  -3.977
  360   1HG1  VAL 880          1HG1      VAL 880  11.808  -0.860  -5.896
  361   2HG1  VAL 880          2HG1      VAL 880  11.234  -2.500  -6.281
  362   3HG1  VAL 880          3HG1      VAL 880  10.412  -1.083  -6.977
  363   1HG2  VAL 880          1HG2      VAL 880   9.705   0.617  -5.512
  364   2HG2  VAL 880          2HG2      VAL 880   8.207  -0.339  -5.415
  365   3HG2  VAL 880          3HG2      VAL 880   9.003   0.222  -3.925
  366    H    GLN 881           H        GLN 881  10.401  -4.789  -5.246
  367    HA   GLN 881           HA       GLN 881   9.697  -6.113  -2.818
  368   1HB   GLN 881          1HB       GLN 881  12.157  -6.548  -4.553
  369   2HB   GLN 881          2HB       GLN 881  11.379  -7.724  -3.466
  370   1HG   GLN 881          1HG       GLN 881   9.831  -8.271  -5.016
  371   2HG   GLN 881          2HG       GLN 881   9.482  -6.566  -5.372
  372   1HE2  GLN 881          1HE2      GLN 881  11.476  -9.376  -6.192
  373   2HE2  GLN 881          2HE2      GLN 881  12.092  -8.750  -7.706
  374    H    GLU 882           H        GLU 882  10.534  -6.010  -0.799
  375    HA   GLU 882           HA       GLU 882  11.798  -4.003   0.367
  376   1HB   GLU 882          1HB       GLU 882  11.213  -6.101   1.522
  377   2HB   GLU 882          2HB       GLU 882  12.614  -6.907   0.778
  378   1HG   GLU 882          1HG       GLU 882  13.906  -4.813   1.825
  379   2HG   GLU 882          2HG       GLU 882  12.522  -4.825   2.941
  380    H    PHE 883           H        PHE 883  13.887  -6.717  -0.772
  381    HA   PHE 883           HA       PHE 883  16.250  -5.116  -0.741
  382   1HB   PHE 883          1HB       PHE 883  17.305  -7.012  -1.737
  383   2HB   PHE 883          2HB       PHE 883  16.101  -7.623  -0.589
  384    HD1  PHE 883           1HD      PHE 883  17.021  -7.301  -4.137
  385    HD2  PHE 883           2HD      PHE 883  14.077  -8.752  -1.365
  386    HE1  PHE 883           1HE      PHE 883  15.998  -8.665  -5.937
  387    HE2  PHE 883           2HE      PHE 883  13.054 -10.116  -3.166
  388    HZ   PHE 883           HZ       PHE 883  14.015 -10.073  -5.452
  389    H    ASP 884           H        ASP 884  13.749  -4.279  -2.409
  390    HA   ASP 884           HA       ASP 884  15.341  -3.312  -4.686
  391   1HB   ASP 884          1HB       ASP 884  12.811  -4.972  -4.975
  392   2HB   ASP 884          2HB       ASP 884  13.536  -4.011  -6.283
  393    H    MET 885           H        MET 885  15.128  -1.204  -3.978
  394    HA   MET 885           HA       MET 885  12.437  -0.055  -4.293
  395   1HB   MET 885          1HB       MET 885  13.228   1.280  -2.050
  396   2HB   MET 885          2HB       MET 885  12.141  -0.130  -2.036
  397   1HG   MET 885          1HG       MET 885  14.309  -1.541  -1.951
  398   2HG   MET 885          2HG       MET 885  15.119  -0.029  -1.509
  399   1HE   MET 885          1HE       MET 885  11.403  -1.472   0.037
  400   2HE   MET 885          2HE       MET 885  12.470  -2.501  -0.947
  401   3HE   MET 885          3HE       MET 885  12.375  -2.745   0.813
  402    H    THR 886           H        THR 886  15.945   0.302  -3.794
  403    HA   THR 886           HA       THR 886  16.787   2.712  -3.924
  404    HB   THR 886           HB       THR 886  18.332   2.247  -5.665
  405    HG1  THR 886           1HG      THR 886  17.838   0.793  -7.310
  406   1HG2  THR 886          1HG2      THR 886  18.125   0.567  -3.690
  407   2HG2  THR 886          2HG2      THR 886  17.421  -0.540  -4.893
  408   3HG2  THR 886          3HG2      THR 886  19.079   0.070  -5.109
  409    H    SER 887           H        SER 887  14.908   1.510  -6.761
  410    HA   SER 887           HA       SER 887  14.498   4.308  -7.613
  411   1HB   SER 887          1HB       SER 887  14.492   1.640  -8.869
  412   2HB   SER 887          2HB       SER 887  13.151   2.685  -9.397
  413    HG   SER 887           HG       SER 887  14.523   3.975 -10.337
  414    H    ALA 888           H        ALA 888  13.015   1.927  -5.679
  415    HA   ALA 888           HA       ALA 888  10.291   2.170  -6.256
  416   1HB   ALA 888          1HB       ALA 888  11.107   0.562  -4.646
  417   2HB   ALA 888          2HB       ALA 888  11.748   1.856  -3.605
  418   3HB   ALA 888          3HB       ALA 888   9.990   1.663  -3.804
  419    H    THR 889           H        THR 889   9.402   3.205  -3.596
  420    HA   THR 889           HA       THR 889  10.139   5.972  -3.411
  421    HB   THR 889           HB       THR 889   8.603   5.562  -5.601
  422    HG1  THR 889           1HG      THR 889   7.898   7.765  -5.179
  423   1HG2  THR 889          1HG2      THR 889   6.832   4.654  -3.878
  424   2HG2  THR 889          2HG2      THR 889   6.554   6.378  -3.536
  425   3HG2  THR 889          3HG2      THR 889   6.303   5.746  -5.181
  426    H    HIS 890           H        HIS 890   7.674   3.431  -2.916
  427    HA   HIS 890           HA       HIS 890   7.179   4.603  -0.218
  428   1HB   HIS 890          1HB       HIS 890   5.379   3.255  -2.224
  429   2HB   HIS 890          2HB       HIS 890   4.997   3.184  -0.494
  430    HD1  HIS 890           1HD      HIS 890   5.022   5.621  -3.419
  431    HD2  HIS 890           2HD      HIS 890   4.349   5.525   0.735
  432    HE1  HIS 890           1HE      HIS 890   3.895   7.833  -2.805
  433    H    VAL 891           H        VAL 891   7.131   3.196   1.553
  434    HA   VAL 891           HA       VAL 891   7.703   0.344   1.054
  435    HB   VAL 891           HB       VAL 891   9.613   0.457   2.687
  436   1HG1  VAL 891          1HG1      VAL 891  11.130   1.767   0.984
  437   2HG1  VAL 891          2HG1      VAL 891  10.315   0.276   0.456
  438   3HG1  VAL 891          3HG1      VAL 891   9.642   1.863   0.012
  439   1HG2  VAL 891          1HG2      VAL 891  10.603   2.614   3.203
  440   2HG2  VAL 891          2HG2      VAL 891   9.422   3.453   2.168
  441   3HG2  VAL 891          3HG2      VAL 891   8.886   2.666   3.672
  442    H    LEU 892           H        LEU 892   6.363  -0.798   2.311
  443    HA   LEU 892           HA       LEU 892   4.888   0.487   4.444
  444   1HB   LEU 892          1HB       LEU 892   4.530  -1.714   2.767
  445   2HB   LEU 892          2HB       LEU 892   4.797  -2.440   4.370
  446    HG   LEU 892           HG       LEU 892   3.061  -0.082   4.507
  447   1HD1  LEU 892          1HD1      LEU 892   2.636  -1.993   2.331
  448   2HD1  LEU 892          2HD1      LEU 892   1.266  -1.974   3.467
  449   3HD1  LEU 892          3HD1      LEU 892   1.788  -0.467   2.678
  450   1HD2  LEU 892          1HD2      LEU 892   2.872  -3.018   5.286
  451   2HD2  LEU 892          2HD2      LEU 892   3.224  -1.631   6.345
  452   3HD2  LEU 892          3HD2      LEU 892   1.598  -1.829   5.648
  453    H    GLY 893           H        GLY 893   5.521   0.717   6.504
  454   1HA   GLY 893          1HA       GLY 893   6.819   0.510   8.395
  455   2HA   GLY 893          2HA       GLY 893   6.590  -1.236   8.153
  456    H    SER 894           H        SER 894   8.875   1.216   8.415
  457    HA   SER 894           HA       SER 894  11.186   0.967   8.397
  458   1HB   SER 894          1HB       SER 894  10.656  -1.550   6.768
  459   2HB   SER 894          2HB       SER 894  12.231  -1.036   7.419
  460    HG   SER 894           HG       SER 894   9.889  -1.668   8.897
  461    H    ARG 895           H        ARG 895  12.950   1.265   6.758
  462    HA   ARG 895           HA       ARG 895  11.967   1.877   4.041
  463   1HB   ARG 895          1HB       ARG 895  13.133   4.126   4.196
  464   2HB   ARG 895          2HB       ARG 895  11.634   3.985   5.147
  465   1HG   ARG 895          1HG       ARG 895  12.796   3.819   7.188
  466   2HG   ARG 895          2HG       ARG 895  14.312   3.331   6.395
  467   1HD   ARG 895          1HD       ARG 895  13.667   5.841   5.284
  468   2HD   ARG 895          2HD       ARG 895  13.328   6.002   7.020
  469    HE   ARG 895           HE       ARG 895  15.853   4.705   6.618
  470   1HH1  ARG 895          2HH2      ARG 895  14.232   7.840   6.400
  471   2HH1  ARG 895          1HH2      ARG 895  15.687   8.766   6.691
  472   1HH2  ARG 895          2HH1      ARG 895  17.775   5.929   7.003
  473   2HH2  ARG 895          1HH1      ARG 895  17.707   7.677   7.035
  474    H    ASP 896           H        ASP 896  14.576   1.399   6.392
  475    HA   ASP 896           HA       ASP 896  16.937   1.645   5.417
  476   1HB   ASP 896          1HB       ASP 896  16.768   0.002   7.084
  477   2HB   ASP 896          2HB       ASP 896  15.643  -0.989   6.129
  478    H    LYS 897           H        LYS 897  15.350  -1.259   4.011
  479    HA   LYS 897           HA       LYS 897  16.843  -1.697   1.828
  480   1HB   LYS 897          1HB       LYS 897  14.197  -1.739   0.804
  481   2HB   LYS 897          2HB       LYS 897  15.118  -3.095   1.497
  482   1HG   LYS 897          1HG       LYS 897  13.195  -3.015   2.856
  483   2HG   LYS 897          2HG       LYS 897  14.389  -2.096   3.803
  484   1HD   LYS 897          1HD       LYS 897  13.473  -0.012   2.544
  485   2HD   LYS 897          2HD       LYS 897  12.091  -1.053   2.125
  486   1HE   LYS 897          1HE       LYS 897  12.261  -1.594   4.769
  487   2HE   LYS 897          2HE       LYS 897  12.925   0.055   4.773
  488   1HZ   LYS 897          1HZ       LYS 897  10.433  -0.574   3.391
  489   2HZ   LYS 897          2HZ       LYS 897  10.452  -0.234   5.005
  490   3HZ   LYS 897          3HZ       LYS 897  10.984   0.888   3.919
  491    H    ASN 898           H        ASN 898  14.656   1.068   2.260
  492    HA   ASN 898           HA       ASN 898  16.043   2.499   0.140
  493   1HB   ASN 898          1HB       ASN 898  13.855   0.966  -0.631
  494   2HB   ASN 898          2HB       ASN 898  13.155   2.579  -0.376
  495   1HD2  ASN 898          1HD2      ASN 898  12.858   3.274  -2.463
  496   2HD2  ASN 898          2HD2      ASN 898  14.151   3.453  -3.629
  497    HA   PRO 899           HA       PRO 899  14.694   5.207   3.522
  498   1HB   PRO 899          1HB       PRO 899  16.805   6.923   3.363
  499   2HB   PRO 899          2HB       PRO 899  16.967   5.289   4.086
  500   1HG   PRO 899          1HG       PRO 899  17.612   6.112   1.240
  501   2HG   PRO 899          2HG       PRO 899  18.677   5.236   2.388
  502   1HD   PRO 899          1HD       PRO 899  17.179   3.906   0.539
  503   2HD   PRO 899          2HD       PRO 899  17.363   3.255   2.195
  504    H    ALA 900           H        ALA 900  15.081   5.482   0.131
  505    HA   ALA 900           HA       ALA 900  14.247   8.304   0.032
  506   1HB   ALA 900          1HB       ALA 900  14.527   8.047  -2.382
  507   2HB   ALA 900          2HB       ALA 900  15.957   7.401  -1.542
  508   3HB   ALA 900          3HB       ALA 900  14.732   6.288  -2.197
  509    H    ALA 901           H        ALA 901  12.782   5.334   0.518
  510    HA   ALA 901           HA       ALA 901  10.391   5.933  -1.097
  511   1HB   ALA 901          1HB       ALA 901  10.925   3.645  -1.157
  512   2HB   ALA 901          2HB       ALA 901  11.353   3.602   0.570
  513   3HB   ALA 901          3HB       ALA 901   9.647   3.730   0.079
  514    H    GLN 902           H        GLN 902   8.316   5.108   0.415
  515    HA   GLN 902           HA       GLN 902   8.295   7.126   2.597
  516   1HB   GLN 902          1HB       GLN 902   6.400   6.245   0.532
  517   2HB   GLN 902          2HB       GLN 902   5.681   6.285   2.160
  518   1HG   GLN 902          1HG       GLN 902   7.022   8.537   0.632
  519   2HG   GLN 902          2HG       GLN 902   5.373   8.480   1.294
  520   1HE2  GLN 902          1HE2      GLN 902   6.279   7.207   3.833
  521   2HE2  GLN 902          2HE2      GLN 902   7.037   8.485   4.759
  522    H    GLN 903           H        GLN 903   7.936   6.538   4.685
  523    HA   GLN 903           HA       GLN 903   7.842   3.640   5.231
  524   1HB   GLN 903          1HB       GLN 903   8.579   6.125   6.767
  525   2HB   GLN 903          2HB       GLN 903   8.125   4.649   7.652
  526   1HG   GLN 903          1HG       GLN 903  10.098   3.667   7.180
  527   2HG   GLN 903          2HG       GLN 903   9.936   4.040   5.451
  528   1HE2  GLN 903          1HE2      GLN 903  10.828   5.978   4.607
  529   2HE2  GLN 903          2HE2      GLN 903  11.994   6.923   5.508
  530    H    VAL 904           H        VAL 904   5.539   3.710   4.328
  531    HA   VAL 904           HA       VAL 904   3.567   4.899   6.151
  532    HB   VAL 904           HB       VAL 904   2.221   4.819   4.347
  533   1HG1  VAL 904          1HG1      VAL 904   3.299   4.709   2.229
  534   2HG1  VAL 904          2HG1      VAL 904   4.576   5.219   3.359
  535   3HG1  VAL 904          3HG1      VAL 904   4.497   3.528   2.809
  536   1HG2  VAL 904          1HG2      VAL 904   1.873   2.681   3.058
  537   2HG2  VAL 904          2HG2      VAL 904   3.135   1.926   4.061
  538   3HG2  VAL 904          3HG2      VAL 904   1.628   2.504   4.812
  539    H    SER 905           H        SER 905   1.636   3.384   6.710
  540    HA   SER 905           HA       SER 905   2.736   0.768   7.624
  541   1HB   SER 905          1HB       SER 905   1.993   2.936   9.223
  542   2HB   SER 905          2HB       SER 905   0.576   1.859   9.269
  543    HG   SER 905           HG       SER 905   3.184   1.441  10.160
  544    HA   PRO 906           HA       PRO 906  -0.977  -1.194   6.272
  545   1HB   PRO 906          1HB       PRO 906  -2.239  -2.320   8.408
  546   2HB   PRO 906          2HB       PRO 906  -0.595  -2.832   7.903
  547   1HG   PRO 906          1HG       PRO 906  -1.314  -0.816  10.051
  548   2HG   PRO 906          2HG       PRO 906  -0.226  -2.234  10.209
  549   1HD   PRO 906          1HD       PRO 906   0.750   0.257   9.689
  550   2HD   PRO 906          2HD       PRO 906   1.449  -1.178   8.880
  551    H    GLU 907           H        GLU 907  -1.452   1.120   8.921
  552    HA   GLU 907           HA       GLU 907  -4.297   1.409   8.506
  553   1HB   GLU 907          1HB       GLU 907  -2.191   3.048   9.957
  554   2HB   GLU 907          2HB       GLU 907  -3.916   3.487   9.924
  555   1HG   GLU 907          1HG       GLU 907  -4.529   1.734  11.273
  556   2HG   GLU 907          2HG       GLU 907  -3.272   0.658  10.627
  557    H    TRP 908           H        TRP 908  -1.398   2.678   7.017
  558    HA   TRP 908           HA       TRP 908  -2.462   5.104   5.980
  559   1HB   TRP 908          1HB       TRP 908  -0.069   4.537   6.061
  560   2HB   TRP 908          2HB       TRP 908  -0.329   3.248   4.879
  561    HD1  TRP 908           HD       TRP 908  -0.485   7.085   5.150
  562    HE1  TRP 908           1HE      TRP 908  -0.026   8.121   2.869
  563    HE3  TRP 908           3HE      TRP 908  -0.253   2.805   2.354
  564    HZ2  TRP 908           2HZ      TRP 908   0.393   7.211   0.154
  565    HZ3  TRP 908           3HZ      TRP 908   0.177   2.929  -0.073
  566    HH2  TRP 908           HH       TRP 908   0.501   5.119  -1.186
  567    H    ILE 909           H        ILE 909  -2.056   1.871   4.422
  568    HA   ILE 909           HA       ILE 909  -3.243   2.378   1.987
  569    HB   ILE 909           HB       ILE 909  -3.083  -0.012   3.794
  570   1HG1  ILE 909          1HG1      ILE 909  -2.384  -0.344   0.994
  571   2HG1  ILE 909          2HG1      ILE 909  -1.614   1.120   1.652
  572   1HG2  ILE 909          1HG2      ILE 909  -4.633   0.032   1.171
  573   2HG2  ILE 909          2HG2      ILE 909  -4.350  -1.377   2.222
  574   3HG2  ILE 909          3HG2      ILE 909  -5.386  -0.042   2.782
  575   1HD1  ILE 909          1HD1      ILE 909  -0.112  -0.713   2.088
  576   2HD1  ILE 909          2HD1      ILE 909  -0.879  -0.296   3.639
  577   3HD1  ILE 909          3HD1      ILE 909  -1.432  -1.721   2.727
  578    H    TRP 910           H        TRP 910  -4.984   1.162   4.915
  579    HA   TRP 910           HA       TRP 910  -7.568   1.261   3.920
  580   1HB   TRP 910          1HB       TRP 910  -6.673   2.085   6.697
  581   2HB   TRP 910          2HB       TRP 910  -8.281   1.513   6.235
  582    HD1  TRP 910           HD       TRP 910  -5.650   0.293   8.138
  583    HE1  TRP 910           1HE      TRP 910  -5.325  -2.231   8.043
  584    HE3  TRP 910           3HE      TRP 910  -8.310  -0.705   3.880
  585    HZ2  TRP 910           2HZ      TRP 910  -6.118  -4.427   6.332
  586    HZ3  TRP 910           3HZ      TRP 910  -8.502  -3.021   3.050
  587    HH2  TRP 910           HH       TRP 910  -7.414  -4.889   4.261
  588    H    ALA 911           H        ALA 911  -6.112   3.877   5.940
  589    HA   ALA 911           HA       ALA 911  -8.065   5.801   5.499
  590   1HB   ALA 911          1HB       ALA 911  -5.901   7.372   5.689
  591   2HB   ALA 911          2HB       ALA 911  -6.532   6.463   7.083
  592   3HB   ALA 911          3HB       ALA 911  -5.146   5.831   6.163
  593    H    CYS 912           H        CYS 912  -5.102   5.162   3.558
  594    HA   CYS 912           HA       CYS 912  -5.701   7.199   1.615
  595   1HB   CYS 912          1HB       CYS 912  -3.942   4.749   1.251
  596   2HB   CYS 912          2HB       CYS 912  -3.807   6.328   0.438
  597    HG   CYS 912           HG       CYS 912  -3.995   6.580   3.605
  598    H    ILE 913           H        ILE 913  -6.526   3.786   2.045
  599    HA   ILE 913           HA       ILE 913  -7.296   3.157  -0.592
  600    HB   ILE 913           HB       ILE 913  -8.338   2.226   2.108
  601   1HG1  ILE 913          1HG1      ILE 913  -6.290   1.218   0.101
  602   2HG1  ILE 913          2HG1      ILE 913  -6.044   1.619   1.818
  603   1HG2  ILE 913          1HG2      ILE 913  -9.812   0.841   1.072
  604   2HG2  ILE 913          2HG2      ILE 913  -9.657   1.950  -0.311
  605   3HG2  ILE 913          3HG2      ILE 913  -8.672   0.469  -0.243
  606   1HD1  ILE 913          1HD1      ILE 913  -6.890  -0.382   2.541
  607   2HD1  ILE 913          2HD1      ILE 913  -8.123  -0.440   1.258
  608   3HD1  ILE 913          3HD1      ILE 913  -6.446  -0.920   0.904
  609    H    ARG 914           H        ARG 914  -9.401   4.221   2.148
  610    HA   ARG 914           HA       ARG 914 -11.674   4.653   0.462
  611   1HB   ARG 914          1HB       ARG 914 -11.265   4.433   3.145
  612   2HB   ARG 914          2HB       ARG 914 -11.436   6.198   2.991
  613   1HG   ARG 914          1HG       ARG 914 -13.387   4.404   1.556
  614   2HG   ARG 914          2HG       ARG 914 -13.580   4.670   3.305
  615   1HD   ARG 914          1HD       ARG 914 -13.034   7.122   1.733
  616   2HD   ARG 914          2HD       ARG 914 -14.577   6.330   1.350
  617    HE   ARG 914           HE       ARG 914 -14.035   7.891   3.650
  618   1HH1  ARG 914          2HH2      ARG 914 -15.470   4.789   2.743
  619   2HH1  ARG 914          1HH2      ARG 914 -16.585   4.756   4.090
  620   1HH2  ARG 914          2HH1      ARG 914 -15.509   7.847   5.430
  621   2HH2  ARG 914          1HH1      ARG 914 -16.608   6.499   5.622
  622    H    LYS 915           H        LYS 915  -9.172   6.827   1.854
  623    HA   LYS 915           HA       LYS 915 -10.168   9.286   1.063
  624   1HB   LYS 915          1HB       LYS 915  -7.343   8.188   1.172
  625   2HB   LYS 915          2HB       LYS 915  -7.686   9.893   0.792
  626   1HG   LYS 915          1HG       LYS 915  -8.907   8.569   3.228
  627   2HG   LYS 915          2HG       LYS 915  -7.260   9.241   3.284
  628   1HD   LYS 915          1HD       LYS 915  -8.068  11.440   2.652
  629   2HD   LYS 915          2HD       LYS 915  -9.703  10.803   2.354
  630   1HE   LYS 915          1HE       LYS 915 -10.230  11.116   4.515
  631   2HE   LYS 915          2HE       LYS 915  -8.912  10.028   5.000
  632   1HZ   LYS 915          1HZ       LYS 915  -8.529  12.867   4.376
  633   2HZ   LYS 915          2HZ       LYS 915  -8.780  12.291   5.901
  634   3HZ   LYS 915          3HZ       LYS 915  -7.440  11.832   5.056
  635    H    ARG 916           H        ARG 916  -9.358   6.628  -0.936
  636    HA   ARG 916           HA       ARG 916  -9.392   6.372  -3.211
  637   1HB   ARG 916          1HB       ARG 916 -10.921   8.812  -2.708
  638   2HB   ARG 916          2HB       ARG 916 -10.095   8.862  -4.284
  639   1HG   ARG 916          1HG       ARG 916 -11.247   6.226  -3.772
  640   2HG   ARG 916          2HG       ARG 916 -12.485   7.502  -3.681
  641   1HD   ARG 916          1HD       ARG 916 -10.560   6.962  -5.976
  642   2HD   ARG 916          2HD       ARG 916 -12.325   6.756  -5.985
  643    HE   ARG 916           HE       ARG 916 -11.911   9.424  -5.318
  644   1HH1  ARG 916          2HH2      ARG 916 -11.042   7.261  -7.977
  645   2HH1  ARG 916          1HH2      ARG 916 -11.033   8.526  -9.185
  646   1HH2  ARG 916          2HH1      ARG 916 -11.899  11.095  -6.914
  647   2HH2  ARG 916          1HH1      ARG 916 -11.522  10.712  -8.579
  648    H    ARG 917           H        ARG 917  -7.295   8.194  -1.506
  649    HA   ARG 917           HA       ARG 917  -5.453   8.390  -3.785
  650   1HB   ARG 917          1HB       ARG 917  -5.001  10.816  -2.538
  651   2HB   ARG 917          2HB       ARG 917  -5.885  10.592  -4.067
  652   1HG   ARG 917          1HG       ARG 917  -7.423  10.173  -1.532
  653   2HG   ARG 917          2HG       ARG 917  -6.972  11.847  -1.937
  654   1HD   ARG 917          1HD       ARG 917  -7.838  11.077  -4.359
  655   2HD   ARG 917          2HD       ARG 917  -8.794   9.948  -3.374
  656    HE   ARG 917           HE       ARG 917  -9.191  12.367  -2.133
  657   1HH1  ARG 917          2HH2      ARG 917  -9.500  11.187  -5.451
  658   2HH1  ARG 917          1HH2      ARG 917 -10.797  12.284  -5.866
  659   1HH2  ARG 917          2HH1      ARG 917 -10.906  13.817  -2.681
  660   2HH2  ARG 917          1HH1      ARG 917 -11.599  13.783  -4.287
  661    H    LEU 918           H        LEU 918  -3.382   9.732  -2.576
  662    HA   LEU 918           HA       LEU 918  -2.649   7.809  -0.465
  663   1HB   LEU 918          1HB       LEU 918  -1.129   9.785  -2.190
  664   2HB   LEU 918          2HB       LEU 918  -0.374   8.964  -0.803
  665    HG   LEU 918           HG       LEU 918   0.117   7.406  -2.432
  666   1HD1  LEU 918          1HD1      LEU 918  -1.634   6.503  -0.728
  667   2HD1  LEU 918          2HD1      LEU 918  -2.777   6.573  -2.091
  668   3HD1  LEU 918          3HD1      LEU 918  -1.326   5.547  -2.198
  669   1HD2  LEU 918          1HD2      LEU 918  -2.523   7.931  -3.845
  670   2HD2  LEU 918          2HD2      LEU 918  -1.057   8.886  -4.170
  671   3HD2  LEU 918          3HD2      LEU 918  -1.069   7.135  -4.494
  672    H    VAL 919           H        VAL 919  -2.429   8.328   1.650
  673    HA   VAL 919           HA       VAL 919  -2.896  11.180   2.371
  674    HB   VAL 919           HB       VAL 919  -4.163  10.465   4.140
  675   1HG1  VAL 919          1HG1      VAL 919  -5.050   7.996   3.476
  676   2HG1  VAL 919          2HG1      VAL 919  -5.532   9.460   2.587
  677   3HG1  VAL 919          3HG1      VAL 919  -4.231   8.424   1.955
  678   1HG2  VAL 919          1HG2      VAL 919  -2.014   8.436   4.323
  679   2HG2  VAL 919          2HG2      VAL 919  -2.886   9.293   5.616
  680   3HG2  VAL 919          3HG2      VAL 919  -3.612   7.858   4.853
  681    H    ALA 920           H        ALA 920  -2.087  10.945   5.072
  682    HA   ALA 920           HA       ALA 920   0.753  11.294   4.759
  683   1HB   ALA 920          1HB       ALA 920   0.264  12.561   6.552
  684   2HB   ALA 920          2HB       ALA 920  -1.306  11.750   6.770
  685   3HB   ALA 920          3HB       ALA 920   0.163  11.057   7.498
  686    HA   PRO 921           HA       PRO 921   1.589   6.916   5.221
  687   1HB   PRO 921          1HB       PRO 921   4.230   7.043   4.565
  688   2HB   PRO 921          2HB       PRO 921   2.940   7.263   3.339
  689   1HG   PRO 921          1HG       PRO 921   4.432   9.430   4.846
  690   2HG   PRO 921          2HG       PRO 921   4.209   9.295   3.071
  691   1HD   PRO 921          1HD       PRO 921   2.565  10.844   4.596
  692   2HD   PRO 921          2HD       PRO 921   1.901   9.868   3.250
  693    H    CYS 922           H        CYS 922   2.012   5.907   7.111
  694    HA   CYS 922           HA       CYS 922   4.157   6.855   8.857
  695   1HB   CYS 922          1HB       CYS 922   1.263   7.344   9.402
  696   2HB   CYS 922          2HB       CYS 922   2.237   6.725  10.758
  697    HG   CYS 922           HG       CYS 922   2.224   9.514   9.136
  Start of MODEL   14
    1    H    GLY 835           H        GLY 835 -12.441  -6.398   9.273
    2   1HA   GLY 835          1HA       GLY 835 -13.576  -4.770  10.904
    3   2HA   GLY 835          2HA       GLY 835 -11.912  -4.326  11.345
    4    H    SER 836           H        SER 836 -10.925  -2.745  10.201
    5    HA   SER 836           HA       SER 836 -12.267  -1.156   8.348
    6   1HB   SER 836          1HB       SER 836  -9.483  -1.521   9.281
    7   2HB   SER 836          2HB       SER 836  -9.633  -0.801   7.660
    8    HG   SER 836           HG       SER 836 -11.211   0.090   9.824
    9    H    ALA 837           H        ALA 837  -9.385  -3.065   7.371
   10    HA   ALA 837           HA       ALA 837  -9.697  -3.092   4.686
   11   1HB   ALA 837          1HB       ALA 837  -7.992  -4.325   6.211
   12   2HB   ALA 837          2HB       ALA 837  -9.127  -5.693   6.122
   13   3HB   ALA 837          3HB       ALA 837  -8.390  -5.050   4.635
   14    H    ASP 838           H        ASP 838 -11.110  -5.710   6.740
   15    HA   ASP 838           HA       ASP 838 -12.635  -6.966   4.810
   16   1HB   ASP 838          1HB       ASP 838 -13.473  -6.407   7.680
   17   2HB   ASP 838          2HB       ASP 838 -14.051  -7.731   6.645
   18    H    GLU 839           H        GLU 839 -13.434  -4.017   6.686
   19    HA   GLU 839           HA       GLU 839 -16.071  -3.778   5.520
   20   1HB   GLU 839          1HB       GLU 839 -14.282  -2.114   7.275
   21   2HB   GLU 839          2HB       GLU 839 -15.683  -1.346   6.490
   22   1HG   GLU 839          1HG       GLU 839 -16.066  -2.367   8.826
   23   2HG   GLU 839          2HG       GLU 839 -17.220  -2.812   7.550
   24    H    THR 840           H        THR 840 -12.814  -2.885   4.606
   25    HA   THR 840           HA       THR 840 -13.704  -0.863   2.687
   26    HB   THR 840           HB       THR 840 -10.961  -2.130   2.807
   27    HG1  THR 840           1HG      THR 840 -10.488  -0.791   4.496
   28   1HG2  THR 840          1HG2      THR 840 -11.568  -0.478   1.017
   29   2HG2  THR 840          2HG2      THR 840 -11.931   0.713   2.289
   30   3HG2  THR 840          3HG2      THR 840 -10.271   0.102   2.090
   31    H    LEU 841           H        LEU 841 -12.293  -4.174   2.618
   32    HA   LEU 841           HA       LEU 841 -12.408  -4.400  -0.238
   33   1HB   LEU 841          1HB       LEU 841 -11.968  -6.235   2.098
   34   2HB   LEU 841          2HB       LEU 841 -12.345  -6.953   0.513
   35    HG   LEU 841           HG       LEU 841  -9.828  -6.378   1.222
   36   1HD1  LEU 841          1HD1      LEU 841  -9.459  -6.966  -0.929
   37   2HD1  LEU 841          2HD1      LEU 841 -11.221  -6.887  -1.166
   38   3HD1  LEU 841          3HD1      LEU 841 -10.210  -5.468  -1.530
   39   1HD2  LEU 841          1HD2      LEU 841  -9.608  -4.053  -0.233
   40   2HD2  LEU 841          2HD2      LEU 841 -11.128  -3.775   0.652
   41   3HD2  LEU 841          3HD2      LEU 841  -9.630  -4.131   1.545
   42    H    CYS 842           H        CYS 842 -14.867  -4.069   1.963
   43    HA   CYS 842           HA       CYS 842 -16.725  -6.078   1.315
   44   1HB   CYS 842          1HB       CYS 842 -16.743  -4.068   3.050
   45   2HB   CYS 842          2HB       CYS 842 -17.616  -3.236   1.739
   46    HG   CYS 842           HG       CYS 842 -19.149  -5.509   1.341
   47    H    GLN 843           H        GLN 843 -15.218  -3.937  -0.772
   48    HA   GLN 843           HA       GLN 843 -17.531  -4.018  -2.653
   49   1HB   GLN 843          1HB       GLN 843 -15.233  -2.066  -2.848
   50   2HB   GLN 843          2HB       GLN 843 -16.877  -1.937  -3.518
   51   1HG   GLN 843          1HG       GLN 843 -16.991  -2.255  -0.636
   52   2HG   GLN 843          2HG       GLN 843 -15.927  -0.895  -1.058
   53   1HE2  GLN 843          1HE2      GLN 843 -19.178  -1.993  -0.752
   54   2HE2  GLN 843          2HE2      GLN 843 -19.974  -0.584  -1.419
   55    H    THR 844           H        THR 844 -16.607  -6.283  -2.990
   56    HA   THR 844           HA       THR 844 -15.517  -7.732  -4.386
   57    HB   THR 844           HB       THR 844 -15.905  -5.354  -5.879
   58    HG1  THR 844           1HG      THR 844 -16.338  -6.841  -7.308
   59   1HG2  THR 844          1HG2      THR 844 -13.675  -4.717  -6.062
   60   2HG2  THR 844          2HG2      THR 844 -13.076  -6.385  -5.895
   61   3HG2  THR 844          3HG2      THR 844 -13.797  -5.847  -7.431
   62    H    LYS 845           H        LYS 845 -13.333  -4.890  -4.703
   63    HA   LYS 845           HA       LYS 845 -11.354  -6.210  -2.973
   64   1HB   LYS 845          1HB       LYS 845 -11.138  -5.940  -5.954
   65   2HB   LYS 845          2HB       LYS 845  -9.676  -5.670  -4.974
   66   1HG   LYS 845          1HG       LYS 845 -11.472  -8.127  -4.786
   67   2HG   LYS 845          2HG       LYS 845  -9.933  -8.057  -5.678
   68   1HD   LYS 845          1HD       LYS 845  -8.871  -8.582  -3.759
   69   2HD   LYS 845          2HD       LYS 845  -9.382  -7.007  -3.106
   70   1HE   LYS 845          1HE       LYS 845 -10.219  -8.591  -1.554
   71   2HE   LYS 845          2HE       LYS 845 -11.622  -8.162  -2.555
   72   1HZ   LYS 845          1HZ       LYS 845 -11.751 -10.208  -3.292
   73   2HZ   LYS 845          2HZ       LYS 845 -10.137 -10.325  -3.611
   74   3HZ   LYS 845          3HZ       LYS 845 -10.704 -10.644  -2.095
   75    H    VAL 846           H        VAL 846 -12.986  -3.519  -4.138
   76    HA   VAL 846           HA       VAL 846 -12.641  -1.250  -3.999
   77    HB   VAL 846           HB       VAL 846 -11.117  -0.862  -1.747
   78   1HG1  VAL 846          1HG1      VAL 846 -13.645  -0.406  -2.452
   79   2HG1  VAL 846          2HG1      VAL 846 -13.949  -1.831  -1.430
   80   3HG1  VAL 846          3HG1      VAL 846 -13.159  -0.393  -0.740
   81   1HG2  VAL 846          1HG2      VAL 846 -11.711  -2.711  -0.198
   82   2HG2  VAL 846          2HG2      VAL 846 -12.426  -3.610  -1.557
   83   3HG2  VAL 846          3HG2      VAL 846 -10.677  -3.281  -1.529
   84    H    LEU 847           H        LEU 847 -11.418  -0.119  -5.379
   85    HA   LEU 847           HA       LEU 847  -8.515  -0.024  -4.969
   86   1HB   LEU 847          1HB       LEU 847  -9.575  -0.731  -7.717
   87   2HB   LEU 847          2HB       LEU 847  -7.901  -0.801  -7.117
   88    HG   LEU 847           HG       LEU 847  -9.043  -3.055  -7.288
   89   1HD1  LEU 847          1HD1      LEU 847  -7.426  -3.490  -5.772
   90   2HD1  LEU 847          2HD1      LEU 847  -7.602  -1.877  -5.039
   91   3HD1  LEU 847          3HD1      LEU 847  -8.644  -3.216  -4.503
   92   1HD2  LEU 847          1HD2      LEU 847 -11.114  -1.623  -5.967
   93   2HD2  LEU 847          2HD2      LEU 847 -11.090  -3.351  -6.392
   94   3HD2  LEU 847          3HD2      LEU 847 -10.505  -2.818  -4.798
   95    H    LEU 848           H        LEU 848  -9.214   2.148  -4.338
   96    HA   LEU 848           HA       LEU 848 -10.234   3.837  -6.533
   97   1HB   LEU 848          1HB       LEU 848 -10.106   3.955  -3.573
   98   2HB   LEU 848          2HB       LEU 848  -9.828   5.505  -4.403
   99    HG   LEU 848           HG       LEU 848 -12.091   3.779  -5.364
  100   1HD1  LEU 848          1HD1      LEU 848 -13.057   3.720  -3.319
  101   2HD1  LEU 848          2HD1      LEU 848 -11.812   4.788  -2.627
  102   3HD1  LEU 848          3HD1      LEU 848 -13.227   5.487  -3.452
  103   1HD2  LEU 848          1HD2      LEU 848 -11.110   6.498  -5.624
  104   2HD2  LEU 848          2HD2      LEU 848 -12.400   5.680  -6.538
  105   3HD2  LEU 848          3HD2      LEU 848 -12.781   6.510  -5.010
  106    H    ASP 849           H        ASP 849  -9.128   6.163  -6.459
  107    HA   ASP 849           HA       ASP 849  -6.387   5.702  -7.300
  108   1HB   ASP 849          1HB       ASP 849  -6.442   8.057  -7.913
  109   2HB   ASP 849          2HB       ASP 849  -7.945   7.271  -8.445
  110    H    ILE 850           H        ILE 850  -6.700   4.981  -4.593
  111    HA   ILE 850           HA       ILE 850  -5.990   7.082  -2.795
  112    HB   ILE 850           HB       ILE 850  -4.975   4.421  -2.097
  113   1HG1  ILE 850          1HG1      ILE 850  -6.887   4.047  -3.862
  114   2HG1  ILE 850          2HG1      ILE 850  -6.931   3.145  -2.328
  115   1HG2  ILE 850          1HG2      ILE 850  -5.842   5.030  -0.080
  116   2HG2  ILE 850          2HG2      ILE 850  -5.990   6.640  -0.823
  117   3HG2  ILE 850          3HG2      ILE 850  -7.390   5.542  -0.794
  118   1HD1  ILE 850          1HD1      ILE 850  -8.606   5.489  -3.220
  119   2HD1  ILE 850          2HD1      ILE 850  -9.108   3.981  -2.417
  120   3HD1  ILE 850          3HD1      ILE 850  -8.291   5.257  -1.483
  121    H    PHE 851           H        PHE 851  -3.808   4.313  -3.188
  122    HA   PHE 851           HA       PHE 851  -1.481   5.906  -2.861
  123   1HB   PHE 851          1HB       PHE 851  -1.523   3.232  -4.257
  124   2HB   PHE 851          2HB       PHE 851  -0.291   3.906  -3.177
  125    HD1  PHE 851           1HD      PHE 851  -2.559   1.380  -3.352
  126    HD2  PHE 851           2HD      PHE 851  -1.558   4.669  -0.776
  127    HE1  PHE 851           1HE      PHE 851  -3.594   0.194  -1.435
  128    HE2  PHE 851           2HE      PHE 851  -2.593   3.483   1.141
  129    HZ   PHE 851           HZ       PHE 851  -3.611   1.245   0.811
  130    H    THR 852           H        THR 852  -3.242   6.933  -4.975
  131    HA   THR 852           HA       THR 852  -2.608   6.426  -7.573
  132    HB   THR 852           HB       THR 852  -3.863   8.451  -6.260
  133    HG1  THR 852           1HG      THR 852  -2.880   8.663  -8.912
  134   1HG2  THR 852          1HG2      THR 852  -1.329   9.625  -7.486
  135   2HG2  THR 852          2HG2      THR 852  -2.713  10.560  -6.869
  136   3HG2  THR 852          3HG2      THR 852  -1.725   9.589  -5.751
  137    H    GLY 853           H        GLY 853  -0.625   5.729  -8.226
  138   1HA   GLY 853          1HA       GLY 853   1.557   5.953  -8.930
  139   2HA   GLY 853          2HA       GLY 853   1.483   7.674  -8.487
  140    H    VAL 854           H        VAL 854   0.440   5.994  -5.816
  141    HA   VAL 854           HA       VAL 854   2.884   6.514  -4.371
  142    HB   VAL 854           HB       VAL 854   0.150   5.431  -3.765
  143   1HG1  VAL 854          1HG1      VAL 854   0.750   4.556  -1.671
  144   2HG1  VAL 854          2HG1      VAL 854   2.070   3.974  -2.713
  145   3HG1  VAL 854          3HG1      VAL 854   2.322   5.390  -1.664
  146   1HG2  VAL 854          1HG2      VAL 854   1.976   7.650  -2.789
  147   2HG2  VAL 854          2HG2      VAL 854   0.378   7.789  -3.561
  148   3HG2  VAL 854          3HG2      VAL 854   0.511   7.181  -1.894
  149    H    ARG 855           H        ARG 855   4.643   5.268  -4.672
  150    HA   ARG 855           HA       ARG 855   4.228   2.345  -5.034
  151   1HB   ARG 855          1HB       ARG 855   6.217   2.306  -6.254
  152   2HB   ARG 855          2HB       ARG 855   5.549   3.894  -6.699
  153   1HG   ARG 855          1HG       ARG 855   6.899   4.838  -4.720
  154   2HG   ARG 855          2HG       ARG 855   7.746   3.273  -4.696
  155   1HD   ARG 855          1HD       ARG 855   8.935   3.763  -6.560
  156   2HD   ARG 855          2HD       ARG 855   7.513   4.425  -7.395
  157    HE   ARG 855           HE       ARG 855   8.706   6.096  -5.278
  158   1HH1  ARG 855          2HH2      ARG 855   8.366   5.338  -8.714
  159   2HH1  ARG 855          1HH2      ARG 855   8.924   6.906  -9.255
  160   1HH2  ARG 855          2HH1      ARG 855   9.443   8.167  -5.992
  161   2HH2  ARG 855          1HH1      ARG 855   9.537   8.518  -7.703
  162    H    LEU 856           H        LEU 856   4.109   1.517  -2.983
  163    HA   LEU 856           HA       LEU 856   6.409   2.147  -1.193
  164   1HB   LEU 856          1HB       LEU 856   4.998   2.124   0.657
  165   2HB   LEU 856          2HB       LEU 856   3.948   2.868  -0.573
  166    HG   LEU 856           HG       LEU 856   2.800   0.801  -0.976
  167   1HD1  LEU 856          1HD1      LEU 856   4.257  -0.971  -1.021
  168   2HD1  LEU 856          2HD1      LEU 856   5.239  -0.330   0.318
  169   3HD1  LEU 856          3HD1      LEU 856   3.709  -1.171   0.661
  170   1HD2  LEU 856          1HD2      LEU 856   1.980   0.199   1.296
  171   2HD2  LEU 856          2HD2      LEU 856   3.346   1.089   2.010
  172   3HD2  LEU 856          3HD2      LEU 856   2.103   1.961   1.080
  173    H    TYR 857           H        TYR 857   7.417   0.417  -0.155
  174    HA   TYR 857           HA       TYR 857   7.176  -2.130  -1.517
  175   1HB   TYR 857          1HB       TYR 857   9.346  -1.876  -0.931
  176   2HB   TYR 857          2HB       TYR 857   8.962  -0.815   0.435
  177    HD1  TYR 857           1HD      TYR 857   8.667  -4.419  -0.593
  178    HD2  TYR 857           2HD      TYR 857   9.305  -1.604   2.588
  179    HE1  TYR 857           1HE      TYR 857   9.089  -6.290   0.978
  180    HE2  TYR 857           2HE      TYR 857   9.728  -3.475   4.160
  181    HH   TYR 857           HH       TYR 857   9.264  -6.857   3.254
  182    H    LEU 858           H        LEU 858   5.401  -3.344  -1.114
  183    HA   LEU 858           HA       LEU 858   4.239  -3.389   1.579
  184   1HB   LEU 858          1HB       LEU 858   2.834  -3.314  -0.485
  185   2HB   LEU 858          2HB       LEU 858   3.471  -4.912  -0.941
  186    HG   LEU 858           HG       LEU 858   2.196  -5.998   0.607
  187   1HD1  LEU 858          1HD1      LEU 858   2.744  -3.596   2.392
  188   2HD1  LEU 858          2HD1      LEU 858   1.698  -4.950   2.883
  189   3HD1  LEU 858          3HD1      LEU 858   3.419  -5.238   2.531
  190   1HD2  LEU 858          1HD2      LEU 858   0.510  -3.682   1.282
  191   2HD2  LEU 858          2HD2      LEU 858   0.849  -3.806  -0.461
  192   3HD2  LEU 858          3HD2      LEU 858   0.095  -5.170   0.399
  193    HA   PRO 859           HA       PRO 859   6.901  -6.869   2.530
  194   1HB   PRO 859          1HB       PRO 859   6.352  -6.944   5.198
  195   2HB   PRO 859          2HB       PRO 859   7.347  -5.639   4.473
  196   1HG   PRO 859          1HG       PRO 859   4.377  -5.566   5.074
  197   2HG   PRO 859          2HG       PRO 859   5.617  -4.370   5.572
  198   1HD   PRO 859          1HD       PRO 859   4.098  -3.996   3.340
  199   2HD   PRO 859          2HD       PRO 859   5.836  -3.567   3.338
  200    HA   PRO 860           HA       PRO 860   3.818 -10.027   2.258
  201   1HB   PRO 860          1HB       PRO 860   5.361 -12.213   2.773
  202   2HB   PRO 860          2HB       PRO 860   5.584 -11.225   1.292
  203   1HG   PRO 860          1HG       PRO 860   7.119 -11.005   3.898
  204   2HG   PRO 860          2HG       PRO 860   7.798 -11.171   2.245
  205   1HD   PRO 860          1HD       PRO 860   7.522  -8.732   3.430
  206   2HD   PRO 860          2HD       PRO 860   7.163  -8.941   1.689
  207    H    SER 861           H        SER 861   5.746  -9.346   5.108
  208    HA   SER 861           HA       SER 861   4.313 -11.192   6.839
  209   1HB   SER 861          1HB       SER 861   6.644  -9.502   6.958
  210   2HB   SER 861          2HB       SER 861   5.581  -9.127   8.335
  211    HG   SER 861           HG       SER 861   7.124 -10.943   8.560
  212    H    THR 862           H        THR 862   3.713  -8.092   5.466
  213    HA   THR 862           HA       THR 862   2.213  -6.903   7.579
  214    HB   THR 862           HB       THR 862   2.973  -6.291   4.914
  215    HG1  THR 862           1HG      THR 862   2.790  -4.372   5.766
  216   1HG2  THR 862          1HG2      THR 862   0.747  -5.288   4.154
  217   2HG2  THR 862          2HG2      THR 862   0.871  -7.060   4.041
  218   3HG2  THR 862          3HG2      THR 862  -0.033  -6.315   5.381
  219    HA   PRO 863           HA       PRO 863  -1.439  -9.361   7.531
  220   1HB   PRO 863          1HB       PRO 863  -3.143  -7.673   8.823
  221   2HB   PRO 863          2HB       PRO 863  -1.727  -8.402   9.649
  222   1HG   PRO 863          1HG       PRO 863  -1.892  -5.665   8.355
  223   2HG   PRO 863          2HG       PRO 863  -1.341  -6.051  10.018
  224   1HD   PRO 863          1HD       PRO 863   0.431  -5.744   7.970
  225   2HD   PRO 863          2HD       PRO 863   0.674  -7.025   9.196
  226    H    ASP 864           H        ASP 864  -3.060  -9.698   6.070
  227    HA   ASP 864           HA       ASP 864  -4.644  -9.246   4.460
  228   1HB   ASP 864          1HB       ASP 864  -4.551  -6.858   5.933
  229   2HB   ASP 864          2HB       ASP 864  -4.340  -6.354   4.242
  230    H    PHE 865           H        PHE 865  -1.449  -9.002   4.322
  231    HA   PHE 865           HA       PHE 865  -0.648  -7.504   2.157
  232   1HB   PHE 865          1HB       PHE 865   0.736  -9.029   3.612
  233   2HB   PHE 865          2HB       PHE 865   0.141 -10.392   2.650
  234    HD1  PHE 865           1HD      PHE 865   1.412 -11.108   0.851
  235    HD2  PHE 865           2HD      PHE 865   1.780  -7.041   2.181
  236    HE1  PHE 865           1HE      PHE 865   3.226 -10.733  -0.799
  237    HE2  PHE 865           2HE      PHE 865   3.593  -6.665   0.532
  238    HZ   PHE 865           HZ       PHE 865   4.316  -8.511  -0.959
  239    H    SER 866           H        SER 866  -2.257 -10.719   2.091
  240    HA   SER 866           HA       SER 866  -2.238 -11.586  -0.398
  241   1HB   SER 866          1HB       SER 866  -4.530 -11.116   1.471
  242   2HB   SER 866          2HB       SER 866  -4.911 -11.616  -0.194
  243    HG   SER 866           HG       SER 866  -3.558 -12.980   1.830
  244    H    ARG 867           H        ARG 867  -5.011  -9.400   0.081
  245    HA   ARG 867           HA       ARG 867  -4.938  -8.527  -2.642
  246   1HB   ARG 867          1HB       ARG 867  -6.331  -7.175  -0.304
  247   2HB   ARG 867          2HB       ARG 867  -6.791  -7.134  -2.023
  248   1HG   ARG 867          1HG       ARG 867  -7.902  -9.097  -1.861
  249   2HG   ARG 867          2HG       ARG 867  -6.539  -9.877  -1.023
  250   1HD   ARG 867          1HD       ARG 867  -7.301  -9.241   1.091
  251   2HD   ARG 867          2HD       ARG 867  -8.242  -7.875   0.454
  252    HE   ARG 867           HE       ARG 867 -10.035  -9.300   0.065
  253   1HH1  ARG 867          2HH2      ARG 867  -7.097 -11.139   0.763
  254   2HH1  ARG 867          1HH2      ARG 867  -7.926 -12.673   0.902
  255   1HH2  ARG 867          2HH1      ARG 867 -11.130 -11.327   0.248
  256   2HH2  ARG 867          1HH1      ARG 867 -10.225 -12.780   0.608
  257    H    LEU 868           H        LEU 868  -3.785  -7.145   0.446
  258    HA   LEU 868           HA       LEU 868  -3.229  -4.571  -0.036
  259   1HB   LEU 868          1HB       LEU 868  -1.710  -6.771   1.267
  260   2HB   LEU 868          2HB       LEU 868  -0.778  -5.300   0.895
  261    HG   LEU 868           HG       LEU 868  -3.255  -5.586   2.622
  262   1HD1  LEU 868          1HD1      LEU 868  -1.683  -5.440   4.231
  263   2HD1  LEU 868          2HD1      LEU 868  -0.410  -5.187   3.013
  264   3HD1  LEU 868          3HD1      LEU 868  -1.311  -3.795   3.660
  265   1HD2  LEU 868          1HD2      LEU 868  -3.883  -3.713   1.352
  266   2HD2  LEU 868          2HD2      LEU 868  -2.994  -2.974   2.705
  267   3HD2  LEU 868          3HD2      LEU 868  -2.200  -3.180   1.125
  268    H    ARG 869           H        ARG 869  -1.133  -7.230  -1.290
  269    HA   ARG 869           HA       ARG 869   0.599  -5.595  -2.789
  270   1HB   ARG 869          1HB       ARG 869   0.833  -8.066  -2.226
  271   2HB   ARG 869          2HB       ARG 869  -0.315  -8.391  -3.547
  272   1HG   ARG 869          1HG       ARG 869   1.513  -8.416  -4.894
  273   2HG   ARG 869          2HG       ARG 869   1.489  -6.644  -4.727
  274   1HD   ARG 869          1HD       ARG 869   3.684  -7.201  -4.095
  275   2HD   ARG 869          2HD       ARG 869   2.842  -7.063  -2.537
  276    HE   ARG 869           HE       ARG 869   2.985  -9.390  -2.248
  277   1HH1  ARG 869          2HH2      ARG 869   4.168  -8.361  -5.417
  278   2HH1  ARG 869          1HH2      ARG 869   4.935  -9.891  -5.779
  279   1HH2  ARG 869          2HH1      ARG 869   3.999 -11.410  -2.727
  280   2HH2  ARG 869          1HH1      ARG 869   4.839 -11.629  -4.245
  281    H    ARG 870           H        ARG 870  -1.542  -7.831  -4.542
  282    HA   ARG 870           HA       ARG 870  -1.731  -6.466  -6.894
  283   1HB   ARG 870          1HB       ARG 870  -3.062  -8.614  -5.666
  284   2HB   ARG 870          2HB       ARG 870  -4.357  -7.492  -6.150
  285   1HG   ARG 870          1HG       ARG 870  -3.911  -8.977  -8.018
  286   2HG   ARG 870          2HG       ARG 870  -3.286  -7.363  -8.435
  287   1HD   ARG 870          1HD       ARG 870  -1.438  -8.618  -8.999
  288   2HD   ARG 870          2HD       ARG 870  -1.074  -8.343  -7.282
  289    HE   ARG 870           HE       ARG 870  -2.659 -10.740  -7.781
  290   1HH1  ARG 870          2HH2      ARG 870   0.581  -9.336  -7.600
  291   2HH1  ARG 870          1HH2      ARG 870   1.371 -10.859  -7.258
  292   1HH2  ARG 870          2HH1      ARG 870  -1.616 -12.752  -7.328
  293   2HH2  ARG 870          1HH1      ARG 870   0.118 -12.807  -7.103
  294    H    TYR 871           H        TYR 871  -3.981  -6.041  -4.102
  295    HA   TYR 871           HA       TYR 871  -5.660  -4.112  -5.093
  296   1HB   TYR 871          1HB       TYR 871  -5.606  -5.168  -2.785
  297   2HB   TYR 871          2HB       TYR 871  -4.374  -3.971  -2.351
  298    HD1  TYR 871           1HD      TYR 871  -7.547  -3.696  -4.347
  299    HD2  TYR 871           2HD      TYR 871  -5.321  -2.432  -0.897
  300    HE1  TYR 871           1HE      TYR 871  -9.329  -2.062  -3.796
  301    HE2  TYR 871           2HE      TYR 871  -7.104  -0.798  -0.346
  302    HH   TYR 871           HH       TYR 871  -9.878  -0.716  -1.012
  303    H    PHE 872           H        PHE 872  -2.575  -3.383  -3.353
  304    HA   PHE 872           HA       PHE 872  -2.546  -0.633  -3.804
  305   1HB   PHE 872          1HB       PHE 872  -0.982  -2.140  -2.418
  306   2HB   PHE 872          2HB       PHE 872  -0.076  -2.373  -3.922
  307    HD1  PHE 872           1HD      PHE 872  -0.215  -0.496  -0.990
  308    HD2  PHE 872           2HD      PHE 872   0.399  -0.033  -5.217
  309    HE1  PHE 872           1HE      PHE 872   1.004   1.624  -0.581
  310    HE2  PHE 872           2HE      PHE 872   1.618   2.087  -4.807
  311    HZ   PHE 872           HZ       PHE 872   1.921   2.915  -2.489
  312    H    VAL 873           H        VAL 873   0.017  -2.366  -5.487
  313    HA   VAL 873           HA       VAL 873   0.404  -0.800  -7.617
  314    HB   VAL 873           HB       VAL 873   1.746  -2.594  -7.917
  315   1HG1  VAL 873          1HG1      VAL 873   0.813  -4.973  -7.300
  316   2HG1  VAL 873          2HG1      VAL 873   1.176  -3.817  -5.996
  317   3HG1  VAL 873          3HG1      VAL 873  -0.505  -4.058  -6.529
  318   1HG2  VAL 873          1HG2      VAL 873   1.016  -4.147  -9.615
  319   2HG2  VAL 873          2HG2      VAL 873  -0.694  -3.897  -9.188
  320   3HG2  VAL 873          3HG2      VAL 873   0.232  -2.587  -9.960
  321    H    ALA 874           H        ALA 874  -2.420  -2.909  -7.164
  322    HA   ALA 874           HA       ALA 874  -3.493  -2.773  -9.765
  323   1HB   ALA 874          1HB       ALA 874  -4.475  -4.307  -8.260
  324   2HB   ALA 874          2HB       ALA 874  -4.698  -3.066  -7.003
  325   3HB   ALA 874          3HB       ALA 874  -5.714  -3.045  -8.464
  326    H    PHE 875           H        PHE 875  -4.270  -0.715  -6.896
  327    HA   PHE 875           HA       PHE 875  -6.037   1.057  -7.946
  328   1HB   PHE 875          1HB       PHE 875  -3.579   1.842  -6.346
  329   2HB   PHE 875          2HB       PHE 875  -5.104   2.738  -6.448
  330    HD1  PHE 875           1HD      PHE 875  -4.494   2.401  -3.819
  331    HD2  PHE 875           2HD      PHE 875  -6.000  -0.625  -6.470
  332    HE1  PHE 875           1HE      PHE 875  -5.365   1.132  -1.875
  333    HE2  PHE 875           2HE      PHE 875  -6.871  -1.894  -4.526
  334    HZ   PHE 875           HZ       PHE 875  -6.554  -1.016  -2.228
  335    H    ASP 876           H        ASP 876  -2.490   1.083  -8.500
  336    HA   ASP 876           HA       ASP 876  -2.198   1.731 -11.025
  337   1HB   ASP 876          1HB       ASP 876  -3.657   3.982  -9.727
  338   2HB   ASP 876          2HB       ASP 876  -2.345   4.426 -10.839
  339    H    GLY 877           H        GLY 877  -1.124   1.604  -8.008
  340   1HA   GLY 877          1HA       GLY 877   1.161   3.454  -8.304
  341   2HA   GLY 877          2HA       GLY 877   0.738   2.500  -6.864
  342    H    ASP 878           H        ASP 878   2.667   1.425  -6.534
  343    HA   ASP 878           HA       ASP 878   3.209  -0.806  -8.313
  344   1HB   ASP 878          1HB       ASP 878   4.857   1.673  -8.362
  345   2HB   ASP 878          2HB       ASP 878   5.749   0.140  -8.271
  346    H    LEU 879           H        LEU 879   4.943  -2.212  -7.404
  347    HA   LEU 879           HA       LEU 879   5.424  -1.687  -4.517
  348   1HB   LEU 879          1HB       LEU 879   3.901  -3.889  -5.793
  349   2HB   LEU 879          2HB       LEU 879   5.109  -4.403  -4.592
  350    HG   LEU 879           HG       LEU 879   4.079  -3.218  -2.854
  351   1HD1  LEU 879          1HD1      LEU 879   2.333  -1.427  -3.347
  352   2HD1  LEU 879          2HD1      LEU 879   3.993  -1.026  -3.848
  353   3HD1  LEU 879          3HD1      LEU 879   2.802  -1.556  -5.060
  354   1HD2  LEU 879          1HD2      LEU 879   2.421  -4.774  -3.012
  355   2HD2  LEU 879          2HD2      LEU 879   1.438  -3.414  -3.607
  356   3HD2  LEU 879          3HD2      LEU 879   2.221  -4.519  -4.762
  357    H    VAL 880           H        VAL 880   7.511  -1.949  -3.969
  358    HA   VAL 880           HA       VAL 880   9.254  -3.380  -5.915
  359    HB   VAL 880           HB       VAL 880  10.635  -1.726  -3.954
  360   1HG1  VAL 880          1HG1      VAL 880  10.351  -1.449  -6.974
  361   2HG1  VAL 880          2HG1      VAL 880  11.682  -0.848  -5.956
  362   3HG1  VAL 880          3HG1      VAL 880  11.456  -2.599  -6.183
  363   1HG2  VAL 880          1HG2      VAL 880   9.641   0.358  -5.418
  364   2HG2  VAL 880          2HG2      VAL 880   8.184  -0.652  -5.256
  365   3HG2  VAL 880          3HG2      VAL 880   9.044  -0.090  -3.802
  366    H    GLN 881           H        GLN 881  10.662  -4.963  -5.187
  367    HA   GLN 881           HA       GLN 881   9.902  -6.298  -2.745
  368   1HB   GLN 881          1HB       GLN 881  12.304  -6.777  -4.549
  369   2HB   GLN 881          2HB       GLN 881  11.587  -7.924  -3.392
  370   1HG   GLN 881          1HG       GLN 881   9.996  -8.544  -4.867
  371   2HG   GLN 881          2HG       GLN 881   9.580  -6.854  -5.225
  372   1HE2  GLN 881          1HE2      GLN 881   9.966  -6.162  -7.252
  373   2HE2  GLN 881          2HE2      GLN 881  11.115  -6.871  -8.366
  374    H    GLU 882           H        GLU 882  10.846  -6.259  -0.757
  375    HA   GLU 882           HA       GLU 882  12.097  -4.246   0.403
  376   1HB   GLU 882          1HB       GLU 882  11.682  -6.269   1.638
  377   2HB   GLU 882          2HB       GLU 882  12.872  -7.173   0.671
  378   1HG   GLU 882          1HG       GLU 882  14.303  -4.965   1.628
  379   2HG   GLU 882          2HG       GLU 882  13.282  -5.444   3.002
  380    H    PHE 883           H        PHE 883  14.271  -6.853  -0.809
  381    HA   PHE 883           HA       PHE 883  16.544  -5.138  -0.889
  382   1HB   PHE 883          1HB       PHE 883  17.635  -6.985  -1.988
  383   2HB   PHE 883          2HB       PHE 883  16.584  -7.621  -0.711
  384    HD1  PHE 883           1HD      PHE 883  14.519  -8.833  -1.266
  385    HD2  PHE 883           2HD      PHE 883  17.179  -7.413  -4.326
  386    HE1  PHE 883           1HE      PHE 883  13.408 -10.312  -2.918
  387    HE2  PHE 883           2HE      PHE 883  16.068  -8.892  -5.978
  388    HZ   PHE 883           HZ       PHE 883  14.182 -10.341  -5.274
  389    H    ASP 884           H        ASP 884  14.155  -4.073  -2.298
  390    HA   ASP 884           HA       ASP 884  15.534  -3.133  -4.663
  391   1HB   ASP 884          1HB       ASP 884  13.172  -5.024  -4.915
  392   2HB   ASP 884          2HB       ASP 884  13.675  -3.917  -6.211
  393    H    MET 885           H        MET 885  15.186  -1.057  -3.922
  394    HA   MET 885           HA       MET 885  12.446  -0.063  -4.227
  395   1HB   MET 885          1HB       MET 885  13.128   1.179  -1.868
  396   2HB   MET 885          2HB       MET 885  12.037  -0.220  -2.003
  397   1HG   MET 885          1HG       MET 885  14.067  -1.708  -1.814
  398   2HG   MET 885          2HG       MET 885  15.027  -0.260  -1.464
  399   1HE   MET 885          1HE       MET 885  13.327  -3.203   0.809
  400   2HE   MET 885          2HE       MET 885  11.780  -2.326   0.859
  401   3HE   MET 885          3HE       MET 885  12.535  -2.709  -0.707
  402    H    THR 886           H        THR 886  15.889   0.512  -3.468
  403    HA   THR 886           HA       THR 886  16.627   2.926  -3.458
  404    HB   THR 886           HB       THR 886  18.224   2.667  -5.178
  405    HG1  THR 886           1HG      THR 886  16.529   0.793  -6.453
  406   1HG2  THR 886          1HG2      THR 886  18.097   0.795  -3.426
  407   2HG2  THR 886          2HG2      THR 886  17.322  -0.194  -4.687
  408   3HG2  THR 886          3HG2      THR 886  18.980   0.409  -4.923
  409    H    SER 887           H        SER 887  14.784   1.875  -6.374
  410    HA   SER 887           HA       SER 887  14.253   4.721  -6.989
  411   1HB   SER 887          1HB       SER 887  14.405   2.182  -8.492
  412   2HB   SER 887          2HB       SER 887  13.038   3.223  -8.955
  413    HG   SER 887           HG       SER 887  14.943   4.890  -8.744
  414    H    ALA 888           H        ALA 888  12.834   1.945  -5.496
  415    HA   ALA 888           HA       ALA 888  10.148   2.078  -6.037
  416   1HB   ALA 888          1HB       ALA 888  11.632   1.685  -3.421
  417   2HB   ALA 888          2HB       ALA 888   9.865   1.512  -3.547
  418   3HB   ALA 888          3HB       ALA 888  10.934   0.448  -4.493
  419    H    THR 889           H        THR 889   8.398   3.010  -4.486
  420    HA   THR 889           HA       THR 889   8.967   5.914  -4.247
  421    HB   THR 889           HB       THR 889   7.026   4.848  -5.658
  422    HG1  THR 889           1HG      THR 889   6.883   6.962  -5.503
  423   1HG2  THR 889          1HG2      THR 889   5.009   5.020  -3.790
  424   2HG2  THR 889          2HG2      THR 889   5.728   3.496  -4.363
  425   3HG2  THR 889          3HG2      THR 889   6.302   4.238  -2.850
  426    H    HIS 890           H        HIS 890   7.285   3.220  -2.534
  427    HA   HIS 890           HA       HIS 890   8.015   4.568   0.015
  428   1HB   HIS 890          1HB       HIS 890   5.404   3.111  -0.262
  429   2HB   HIS 890          2HB       HIS 890   5.868   4.394   0.871
  430    HD1  HIS 890           1HD      HIS 890   6.954   6.095  -1.940
  431    HD2  HIS 890           2HD      HIS 890   3.164   4.710  -0.741
  432    HE1  HIS 890           1HE      HIS 890   5.226   7.513  -3.181
  433    H    VAL 891           H        VAL 891   7.514   2.916   1.898
  434    HA   VAL 891           HA       VAL 891   8.041   0.137   1.073
  435    HB   VAL 891           HB       VAL 891   9.912   0.234   2.954
  436   1HG1  VAL 891          1HG1      VAL 891   9.890   0.664   0.031
  437   2HG1  VAL 891          2HG1      VAL 891  11.373   1.242   0.828
  438   3HG1  VAL 891          3HG1      VAL 891  10.868  -0.455   1.010
  439   1HG2  VAL 891          1HG2      VAL 891   9.531   3.087   2.038
  440   2HG2  VAL 891          2HG2      VAL 891   9.864   2.463   3.671
  441   3HG2  VAL 891          3HG2      VAL 891  11.161   2.502   2.452
  442    H    LEU 892           H        LEU 892   6.102  -0.528   1.966
  443    HA   LEU 892           HA       LEU 892   4.973   0.366   4.370
  444   1HB   LEU 892          1HB       LEU 892   4.259  -1.387   2.416
  445   2HB   LEU 892          2HB       LEU 892   4.675  -2.521   3.724
  446    HG   LEU 892           HG       LEU 892   3.159  -0.266   4.768
  447   1HD1  LEU 892          1HD1      LEU 892   2.385  -1.143   2.145
  448   2HD1  LEU 892          2HD1      LEU 892   1.173  -1.734   3.307
  449   3HD1  LEU 892          3HD1      LEU 892   1.547   0.004   3.218
  450   1HD2  LEU 892          1HD2      LEU 892   1.599  -2.437   5.152
  451   2HD2  LEU 892          2HD2      LEU 892   3.125  -3.259   4.747
  452   3HD2  LEU 892          3HD2      LEU 892   3.060  -2.127   6.120
  453    H    GLY 893           H        GLY 893   5.336  -0.021   6.501
  454   1HA   GLY 893          1HA       GLY 893   6.099  -1.248   8.360
  455   2HA   GLY 893          2HA       GLY 893   7.053  -2.290   7.279
  456    H    SER 894           H        SER 894   9.064  -1.476   6.400
  457    HA   SER 894           HA       SER 894  10.193   0.744   8.040
  458   1HB   SER 894          1HB       SER 894  11.416  -1.830   6.997
  459   2HB   SER 894          2HB       SER 894  12.398  -0.465   7.582
  460    HG   SER 894           HG       SER 894  11.883  -2.041   9.208
  461    H    ARG 895           H        ARG 895  12.554   1.136   6.668
  462    HA   ARG 895           HA       ARG 895  11.797   1.635   3.852
  463   1HB   ARG 895          1HB       ARG 895  12.678   3.990   4.100
  464   2HB   ARG 895          2HB       ARG 895  11.141   3.685   4.945
  465   1HG   ARG 895          1HG       ARG 895  12.115   4.387   6.853
  466   2HG   ARG 895          2HG       ARG 895  13.197   2.975   6.769
  467   1HD   ARG 895          1HD       ARG 895  14.721   4.288   5.281
  468   2HD   ARG 895          2HD       ARG 895  13.668   5.703   5.498
  469    HE   ARG 895           HE       ARG 895  14.715   4.448   7.952
  470   1HH1  ARG 895          2HH2      ARG 895  14.967   6.986   5.503
  471   2HH1  ARG 895          1HH2      ARG 895  15.943   8.041   6.500
  472   1HH2  ARG 895          2HH1      ARG 895  16.005   5.842   9.269
  473   2HH2  ARG 895          1HH1      ARG 895  16.534   7.389   8.647
  474    H    ASP 896           H        ASP 896  14.180   1.341   6.445
  475    HA   ASP 896           HA       ASP 896  16.596   1.854   5.720
  476   1HB   ASP 896          1HB       ASP 896  16.449   0.177   7.344
  477   2HB   ASP 896          2HB       ASP 896  15.492  -0.893   6.297
  478    H    LYS 897           H        LYS 897  15.531  -1.199   4.163
  479    HA   LYS 897           HA       LYS 897  17.241  -1.450   2.138
  480   1HB   LYS 897          1HB       LYS 897  14.689  -1.674   0.869
  481   2HB   LYS 897          2HB       LYS 897  15.703  -2.971   1.547
  482   1HG   LYS 897          1HG       LYS 897  13.643  -3.133   2.728
  483   2HG   LYS 897          2HG       LYS 897  14.738  -2.280   3.843
  484   1HD   LYS 897          1HD       LYS 897  13.789  -0.114   2.692
  485   2HD   LYS 897          2HD       LYS 897  12.453  -1.181   2.198
  486   1HE   LYS 897          1HE       LYS 897  12.818  -1.834   4.873
  487   2HE   LYS 897          2HE       LYS 897  13.106  -0.081   4.851
  488   1HZ   LYS 897          1HZ       LYS 897  10.743  -1.023   5.084
  489   2HZ   LYS 897          2HZ       LYS 897  11.011   0.318   4.161
  490   3HZ   LYS 897          3HZ       LYS 897  10.809  -1.152   3.441
  491    H    ASN 898           H        ASN 898  14.736   1.075   2.312
  492    HA   ASN 898           HA       ASN 898  16.225   2.669   0.376
  493   1HB   ASN 898          1HB       ASN 898  14.676   1.054  -0.923
  494   2HB   ASN 898          2HB       ASN 898  13.340   2.032  -0.277
  495   1HD2  ASN 898          1HD2      ASN 898  12.684   2.937  -2.237
  496   2HD2  ASN 898          2HD2      ASN 898  13.672   4.066  -3.140
  497    HA   PRO 899           HA       PRO 899  14.298   5.210   3.598
  498   1HB   PRO 899          1HB       PRO 899  16.228   7.133   3.628
  499   2HB   PRO 899          2HB       PRO 899  16.490   5.519   4.366
  500   1HG   PRO 899          1HG       PRO 899  17.303   6.424   1.589
  501   2HG   PRO 899          2HG       PRO 899  18.343   5.651   2.830
  502   1HD   PRO 899          1HD       PRO 899  17.163   4.190   0.855
  503   2HD   PRO 899          2HD       PRO 899  17.261   3.549   2.523
  504    H    ALA 900           H        ALA 900  15.041   5.599   0.257
  505    HA   ALA 900           HA       ALA 900  13.968   8.314   0.053
  506   1HB   ALA 900          1HB       ALA 900  14.343   7.973  -2.367
  507   2HB   ALA 900          2HB       ALA 900  15.794   7.561  -1.422
  508   3HB   ALA 900          3HB       ALA 900  14.752   6.267  -2.061
  509    H    ALA 901           H        ALA 901  12.663   5.258   0.505
  510    HA   ALA 901           HA       ALA 901  10.275   5.811  -1.162
  511   1HB   ALA 901          1HB       ALA 901  10.571   3.596  -1.522
  512   2HB   ALA 901          2HB       ALA 901  11.637   3.418  -0.108
  513   3HB   ALA 901          3HB       ALA 901   9.870   3.386   0.101
  514    H    GLN 902           H        GLN 902   8.243   6.122  -0.277
  515    HA   GLN 902           HA       GLN 902   8.108   7.329   2.287
  516   1HB   GLN 902          1HB       GLN 902   6.372   6.795   0.045
  517   2HB   GLN 902          2HB       GLN 902   5.530   6.379   1.557
  518   1HG   GLN 902          1HG       GLN 902   6.639   9.027   0.647
  519   2HG   GLN 902          2HG       GLN 902   5.068   8.657   1.392
  520   1HE2  GLN 902          1HE2      GLN 902   6.078   7.032   3.561
  521   2HE2  GLN 902          2HE2      GLN 902   6.899   8.101   4.678
  522    H    GLN 903           H        GLN 903   8.057   6.458   4.270
  523    HA   GLN 903           HA       GLN 903   7.757   3.549   4.525
  524   1HB   GLN 903          1HB       GLN 903   9.347   5.405   5.770
  525   2HB   GLN 903          2HB       GLN 903   8.032   5.218   6.955
  526   1HG   GLN 903          1HG       GLN 903   8.325   2.710   6.744
  527   2HG   GLN 903          2HG       GLN 903   9.773   3.025   5.765
  528   1HE2  GLN 903          1HE2      GLN 903  11.542   2.624   6.973
  529   2HE2  GLN 903          2HE2      GLN 903  11.787   3.162   8.621
  530    H    VAL 904           H        VAL 904   5.452   3.659   3.788
  531    HA   VAL 904           HA       VAL 904   3.565   4.851   5.691
  532    HB   VAL 904           HB       VAL 904   2.118   4.745   3.960
  533   1HG1  VAL 904          1HG1      VAL 904   4.299   3.561   2.235
  534   2HG1  VAL 904          2HG1      VAL 904   3.131   4.845   1.845
  535   3HG1  VAL 904          3HG1      VAL 904   4.498   5.186   2.933
  536   1HG2  VAL 904          1HG2      VAL 904   1.981   2.574   2.539
  537   2HG2  VAL 904          2HG2      VAL 904   3.084   1.879   3.750
  538   3HG2  VAL 904          3HG2      VAL 904   1.484   2.480   4.246
  539    H    SER 905           H        SER 905   1.566   3.244   6.115
  540    HA   SER 905           HA       SER 905   2.708   0.673   7.095
  541   1HB   SER 905          1HB       SER 905   1.977   1.047   9.220
  542   2HB   SER 905          2HB       SER 905   2.103   2.757   8.743
  543    HG   SER 905           HG       SER 905  -0.099   2.641   8.113
  544    HA   PRO 906           HA       PRO 906  -0.964  -1.330   5.704
  545   1HB   PRO 906          1HB       PRO 906  -2.174  -2.539   7.825
  546   2HB   PRO 906          2HB       PRO 906  -0.525  -2.999   7.289
  547   1HG   PRO 906          1HG       PRO 906  -1.265  -1.056   9.495
  548   2HG   PRO 906          2HG       PRO 906  -0.142  -2.450   9.605
  549   1HD   PRO 906          1HD       PRO 906   0.769   0.076   9.137
  550   2HD   PRO 906          2HD       PRO 906   1.492  -1.322   8.284
  551    H    GLU 907           H        GLU 907  -1.529   0.795   8.516
  552    HA   GLU 907           HA       GLU 907  -4.360   1.065   8.079
  553   1HB   GLU 907          1HB       GLU 907  -2.314   2.722   9.599
  554   2HB   GLU 907          2HB       GLU 907  -4.064   3.049   9.616
  555   1HG   GLU 907          1HG       GLU 907  -4.174   1.582  11.332
  556   2HG   GLU 907          2HG       GLU 907  -3.923   0.315  10.112
  557    H    TRP 908           H        TRP 908  -1.491   2.479   6.665
  558    HA   TRP 908           HA       TRP 908  -2.676   4.908   5.724
  559   1HB   TRP 908          1HB       TRP 908  -0.269   4.588   5.876
  560   2HB   TRP 908          2HB       TRP 908  -0.342   3.251   4.721
  561    HD1  TRP 908           HD       TRP 908  -0.750   7.064   4.893
  562    HE1  TRP 908           1HE      TRP 908  -0.302   8.080   2.601
  563    HE3  TRP 908           3HE      TRP 908  -0.249   2.751   2.183
  564    HZ2  TRP 908           2HZ      TRP 908   0.212   7.145  -0.089
  565    HZ3  TRP 908           3HZ      TRP 908   0.219   2.854  -0.238
  566    HH2  TRP 908           HH       TRP 908   0.451   5.036  -1.386
  567    H    ILE 909           H        ILE 909  -1.948   1.798   4.037
  568    HA   ILE 909           HA       ILE 909  -3.042   2.311   1.573
  569    HB   ILE 909           HB       ILE 909  -2.768  -0.105   3.302
  570   1HG1  ILE 909          1HG1      ILE 909  -2.116  -0.410   0.506
  571   2HG1  ILE 909          2HG1      ILE 909  -1.470   1.143   1.089
  572   1HG2  ILE 909          1HG2      ILE 909  -4.041  -1.527   1.844
  573   2HG2  ILE 909          2HG2      ILE 909  -5.114  -0.178   2.288
  574   3HG2  ILE 909          3HG2      ILE 909  -4.326  -0.201   0.692
  575   1HD1  ILE 909          1HD1      ILE 909  -0.717  -1.636   1.835
  576   2HD1  ILE 909          2HD1      ILE 909   0.262  -0.149   1.834
  577   3HD1  ILE 909          3HD1      ILE 909  -0.839  -0.490   3.191
  578    H    TRP 910           H        TRP 910  -4.857   1.023   4.421
  579    HA   TRP 910           HA       TRP 910  -7.397   1.043   3.215
  580   1HB   TRP 910          1HB       TRP 910  -6.851   1.686   6.117
  581   2HB   TRP 910          2HB       TRP 910  -8.260   0.872   5.423
  582    HD1  TRP 910           HD       TRP 910  -5.578   0.031   7.511
  583    HE1  TRP 910           1HE      TRP 910  -4.805  -2.388   7.325
  584    HE3  TRP 910           3HE      TRP 910  -7.738  -1.163   3.027
  585    HZ2  TRP 910           2HZ      TRP 910  -5.084  -4.584   5.460
  586    HZ3  TRP 910           3HZ      TRP 910  -7.462  -3.424   2.080
  587    HH2  TRP 910           HH       TRP 910  -6.141  -5.142   3.280
  588    H    ALA 911           H        ALA 911  -6.189   3.469   5.600
  589    HA   ALA 911           HA       ALA 911  -8.164   5.371   5.256
  590   1HB   ALA 911          1HB       ALA 911  -6.692   5.886   6.960
  591   2HB   ALA 911          2HB       ALA 911  -5.258   5.454   5.998
  592   3HB   ALA 911          3HB       ALA 911  -6.098   6.995   5.701
  593    H    CYS 912           H        CYS 912  -5.413   4.622   3.151
  594    HA   CYS 912           HA       CYS 912  -5.665   6.979   1.513
  595   1HB   CYS 912          1HB       CYS 912  -4.415   4.271   0.896
  596   2HB   CYS 912          2HB       CYS 912  -4.124   5.795   0.022
  597    HG   CYS 912           HG       CYS 912  -2.544   4.588   2.285
  598    H    ILE 913           H        ILE 913  -6.022   3.618   0.326
  599    HA   ILE 913           HA       ILE 913  -7.587   4.086  -1.854
  600    HB   ILE 913           HB       ILE 913  -6.799   1.869  -1.346
  601   1HG1  ILE 913          1HG1      ILE 913  -9.840   1.908  -1.134
  602   2HG1  ILE 913          2HG1      ILE 913  -8.919   2.058  -2.650
  603   1HG2  ILE 913          1HG2      ILE 913  -7.816   2.500   1.259
  604   2HG2  ILE 913          2HG2      ILE 913  -8.640   1.027   0.695
  605   3HG2  ILE 913          3HG2      ILE 913  -6.862   1.082   0.764
  606   1HD1  ILE 913          1HD1      ILE 913  -8.474  -0.168  -2.727
  607   2HD1  ILE 913          2HD1      ILE 913  -8.091  -0.238  -0.990
  608   3HD1  ILE 913          3HD1      ILE 913  -9.784  -0.327  -1.533
  609    H    ARG 914           H        ARG 914  -8.707   3.850   1.542
  610    HA   ARG 914           HA       ARG 914 -11.492   4.081   0.916
  611   1HB   ARG 914          1HB       ARG 914 -10.280   3.281   3.088
  612   2HB   ARG 914          2HB       ARG 914 -10.241   5.012   3.503
  613   1HG   ARG 914          1HG       ARG 914 -12.846   3.949   2.502
  614   2HG   ARG 914          2HG       ARG 914 -12.333   3.393   4.113
  615   1HD   ARG 914          1HD       ARG 914 -11.777   5.974   4.450
  616   2HD   ARG 914          2HD       ARG 914 -12.981   6.171   3.158
  617    HE   ARG 914           HE       ARG 914 -14.649   5.589   4.650
  618   1HH1  ARG 914          2HH2      ARG 914 -11.485   4.661   5.926
  619   2HH1  ARG 914          1HH2      ARG 914 -12.100   4.210   7.500
  620   1HH2  ARG 914          2HH1      ARG 914 -15.461   4.993   6.730
  621   2HH2  ARG 914          1HH1      ARG 914 -14.366   4.399   7.959
  622    H    LYS 915           H        LYS 915  -8.842   6.373   1.277
  623    HA   LYS 915           HA       LYS 915 -10.699   8.655   1.407
  624   1HB   LYS 915          1HB       LYS 915  -7.695   8.303   1.556
  625   2HB   LYS 915          2HB       LYS 915  -8.435   9.910   1.353
  626   1HG   LYS 915          1HG       LYS 915  -9.355   8.011   3.531
  627   2HG   LYS 915          2HG       LYS 915  -7.967   9.098   3.774
  628   1HD   LYS 915          1HD       LYS 915  -9.314  11.049   3.425
  629   2HD   LYS 915          2HD       LYS 915 -10.669  10.085   2.791
  630   1HE   LYS 915          1HE       LYS 915 -11.443  10.305   4.933
  631   2HE   LYS 915          2HE       LYS 915 -10.378   8.911   5.214
  632   1HZ   LYS 915          1HZ       LYS 915  -8.645  10.533   5.780
  633   2HZ   LYS 915          2HZ       LYS 915  -9.770  11.736   5.705
  634   3HZ   LYS 915          3HZ       LYS 915  -9.924  10.533   6.822
  635    H    ARG 916           H        ARG 916  -9.309   6.647  -0.945
  636    HA   ARG 916           HA       ARG 916  -9.256   6.782  -3.231
  637   1HB   ARG 916          1HB       ARG 916 -11.062   9.072  -2.502
  638   2HB   ARG 916          2HB       ARG 916 -10.477   8.939  -4.178
  639   1HG   ARG 916          1HG       ARG 916 -12.578   7.732  -4.013
  640   2HG   ARG 916          2HG       ARG 916 -11.267   6.540  -4.183
  641   1HD   ARG 916          1HD       ARG 916 -12.771   5.799  -2.420
  642   2HD   ARG 916          2HD       ARG 916 -11.232   6.301  -1.687
  643    HE   ARG 916           HE       ARG 916 -12.599   8.581  -1.450
  644   1HH1  ARG 916          2HH2      ARG 916 -13.635   5.241  -0.926
  645   2HH1  ARG 916          1HH2      ARG 916 -14.814   5.654   0.298
  646   1HH2  ARG 916          2HH1      ARG 916 -14.157   9.127   0.167
  647   2HH2  ARG 916          1HH1      ARG 916 -15.112   7.870   0.921
  648    H    ARG 917           H        ARG 917  -7.718   8.839  -1.131
  649    HA   ARG 917           HA       ARG 917  -5.879   9.726  -3.261
  650   1HB   ARG 917          1HB       ARG 917  -5.965  11.952  -1.636
  651   2HB   ARG 917          2HB       ARG 917  -6.789  11.799  -3.206
  652   1HG   ARG 917          1HG       ARG 917  -8.179  10.674  -0.799
  653   2HG   ARG 917          2HG       ARG 917  -8.119  12.446  -0.959
  654   1HD   ARG 917          1HD       ARG 917  -8.895  12.046  -3.402
  655   2HD   ARG 917          2HD       ARG 917  -9.322  10.410  -2.855
  656    HE   ARG 917           HE       ARG 917 -10.412  12.376  -1.072
  657   1HH1  ARG 917          2HH2      ARG 917 -10.802  10.964  -4.290
  658   2HH1  ARG 917          1HH2      ARG 917 -12.520  11.282  -4.371
  659   1HH2  ARG 917          2HH1      ARG 917 -12.682  12.795  -1.179
  660   2HH2  ARG 917          1HH1      ARG 917 -13.592  12.325  -2.596
  661    H    LEU 918           H        LEU 918  -3.914   9.051  -2.658
  662    HA   LEU 918           HA       LEU 918  -3.125   7.806  -0.404
  663   1HB   LEU 918          1HB       LEU 918  -1.678   9.755  -2.196
  664   2HB   LEU 918          2HB       LEU 918  -0.845   9.048  -0.790
  665    HG   LEU 918           HG       LEU 918  -0.456   7.204  -2.029
  666   1HD1  LEU 918          1HD1      LEU 918  -2.477   5.774  -2.634
  667   2HD1  LEU 918          2HD1      LEU 918  -2.375   6.256  -0.923
  668   3HD1  LEU 918          3HD1      LEU 918  -3.497   7.097  -2.019
  669   1HD2  LEU 918          1HD2      LEU 918  -2.357   8.510  -4.014
  670   2HD2  LEU 918          2HD2      LEU 918  -0.578   8.481  -4.068
  671   3HD2  LEU 918          3HD2      LEU 918  -1.502   6.984  -4.343
  672    H    VAL 919           H        VAL 919  -3.093   8.205   1.724
  673    HA   VAL 919           HA       VAL 919  -3.427  11.007   2.615
  674    HB   VAL 919           HB       VAL 919  -4.443  10.144   4.504
  675   1HG1  VAL 919          1HG1      VAL 919  -5.055   8.839   2.051
  676   2HG1  VAL 919          2HG1      VAL 919  -5.098   7.587   3.316
  677   3HG1  VAL 919          3HG1      VAL 919  -6.113   9.041   3.467
  678   1HG2  VAL 919          1HG2      VAL 919  -2.357   8.825   5.108
  679   2HG2  VAL 919          2HG2      VAL 919  -3.891   8.032   5.542
  680   3HG2  VAL 919          3HG2      VAL 919  -2.989   7.499   4.103
  681    H    ALA 920           H        ALA 920  -2.384  10.850   5.174
  682    HA   ALA 920           HA       ALA 920   0.406  11.262   4.659
  683   1HB   ALA 920          1HB       ALA 920  -0.773  10.835   7.406
  684   2HB   ALA 920          2HB       ALA 920   0.512  11.955   6.895
  685   3HB   ALA 920          3HB       ALA 920  -1.183  12.290   6.466
  686    HA   PRO 921           HA       PRO 921   1.433   6.915   4.989
  687   1HB   PRO 921          1HB       PRO 921   4.014   7.150   4.147
  688   2HB   PRO 921          2HB       PRO 921   2.631   7.340   3.021
  689   1HG   PRO 921          1HG       PRO 921   4.149   9.538   4.455
  690   2HG   PRO 921          2HG       PRO 921   3.804   9.421   2.699
  691   1HD   PRO 921          1HD       PRO 921   2.220  10.885   4.364
  692   2HD   PRO 921          2HD       PRO 921   1.496   9.905   3.053
  693    H    CYS 922           H        CYS 922   2.063   5.875   6.807
  694    HA   CYS 922           HA       CYS 922   2.650   6.921   9.206
  695   1HB   CYS 922          1HB       CYS 922   2.458   4.578   9.113
  696   2HB   CYS 922          2HB       CYS 922   3.720   4.429   7.864
  697    HG   CYS 922           HG       CYS 922   4.335   3.502  10.372
  Start of MODEL   15
    1    H    GLY 835           H        GLY 835 -11.520  -3.804  11.149
    2   1HA   GLY 835          1HA       GLY 835 -13.819  -2.200  11.319
    3   2HA   GLY 835          2HA       GLY 835 -12.714  -1.663  12.604
    4    H    SER 836           H        SER 836 -12.802  -2.441   9.088
    5    HA   SER 836           HA       SER 836 -11.939  -0.103   8.034
    6   1HB   SER 836          1HB       SER 836  -9.690  -1.489   9.440
    7   2HB   SER 836          2HB       SER 836  -9.342  -0.750   7.858
    8    HG   SER 836           HG       SER 836 -10.779   1.006   9.097
    9    H    ALA 837           H        ALA 837  -9.559  -2.594   7.459
   10    HA   ALA 837           HA       ALA 837  -9.914  -2.921   4.790
   11   1HB   ALA 837          1HB       ALA 837  -8.787  -4.991   4.981
   12   2HB   ALA 837          2HB       ALA 837  -8.268  -4.076   6.417
   13   3HB   ALA 837          3HB       ALA 837  -9.512  -5.339   6.569
   14    H    ASP 838           H        ASP 838 -11.416  -5.249   7.108
   15    HA   ASP 838           HA       ASP 838 -13.090  -6.570   5.387
   16   1HB   ASP 838          1HB       ASP 838 -13.938  -5.614   8.141
   17   2HB   ASP 838          2HB       ASP 838 -14.457  -7.087   7.294
   18    H    GLU 839           H        GLU 839 -13.577  -3.332   6.821
   19    HA   GLU 839           HA       GLU 839 -16.242  -3.041   5.731
   20   1HB   GLU 839          1HB       GLU 839 -14.392  -1.555   7.430
   21   2HB   GLU 839          2HB       GLU 839 -15.193  -0.493   6.247
   22   1HG   GLU 839          1HG       GLU 839 -17.072  -2.422   7.359
   23   2HG   GLU 839          2HG       GLU 839 -16.283  -1.492   8.651
   24    H    THR 840           H        THR 840 -12.945  -2.446   4.633
   25    HA   THR 840           HA       THR 840 -13.864  -0.810   2.374
   26    HB   THR 840           HB       THR 840 -11.079  -1.920   2.725
   27    HG1  THR 840           1HG      THR 840 -10.740  -0.028   4.044
   28   1HG2  THR 840          1HG2      THR 840 -11.847  -0.546   0.715
   29   2HG2  THR 840          2HG2      THR 840 -12.076   0.815   1.839
   30   3HG2  THR 840          3HG2      THR 840 -10.455   0.116   1.605
   31    H    LEU 841           H        LEU 841 -12.254  -3.989   2.916
   32    HA   LEU 841           HA       LEU 841 -12.349  -4.759   0.164
   33   1HB   LEU 841          1HB       LEU 841 -11.779  -6.048   2.799
   34   2HB   LEU 841          2HB       LEU 841 -12.211  -7.122   1.447
   35    HG   LEU 841           HG       LEU 841  -9.720  -5.724   1.939
   36   1HD1  LEU 841          1HD1      LEU 841  -9.997  -7.192  -0.592
   37   2HD1  LEU 841          2HD1      LEU 841  -8.964  -7.540   0.816
   38   3HD1  LEU 841          3HD1      LEU 841 -10.656  -8.093   0.795
   39   1HD2  LEU 841          1HD2      LEU 841  -9.409  -4.754  -0.313
   40   2HD2  LEU 841          2HD2      LEU 841 -11.098  -5.141  -0.718
   41   3HD2  LEU 841          3HD2      LEU 841 -10.739  -3.942   0.547
   42    H    CYS 842           H        CYS 842 -14.830  -4.211   2.334
   43    HA   CYS 842           HA       CYS 842 -16.576  -6.384   2.033
   44   1HB   CYS 842          1HB       CYS 842 -16.653  -3.897   3.227
   45   2HB   CYS 842          2HB       CYS 842 -17.849  -3.721   1.919
   46    HG   CYS 842           HG       CYS 842 -19.091  -4.402   4.094
   47    H    GLN 843           H        GLN 843 -15.246  -4.402  -0.375
   48    HA   GLN 843           HA       GLN 843 -17.504  -5.037  -2.217
   49   1HB   GLN 843          1HB       GLN 843 -15.429  -2.924  -2.775
   50   2HB   GLN 843          2HB       GLN 843 -17.106  -3.044  -3.358
   51   1HG   GLN 843          1HG       GLN 843 -17.150  -2.942  -0.488
   52   2HG   GLN 843          2HG       GLN 843 -16.113  -1.624  -1.075
   53   1HE2  GLN 843          1HE2      GLN 843 -19.368  -2.899  -0.871
   54   2HE2  GLN 843          2HE2      GLN 843 -20.183  -1.535  -1.607
   55    H    THR 844           H        THR 844 -16.453  -7.212  -2.335
   56    HA   THR 844           HA       THR 844 -15.192  -8.734  -3.486
   57    HB   THR 844           HB       THR 844 -15.696  -6.580  -5.274
   58    HG1  THR 844           1HG      THR 844 -16.329  -8.653  -5.680
   59   1HG2  THR 844          1HG2      THR 844 -13.508  -5.854  -5.534
   60   2HG2  THR 844          2HG2      THR 844 -12.820  -7.437  -5.102
   61   3HG2  THR 844          3HG2      THR 844 -13.526  -7.185  -6.716
   62    H    LYS 845           H        LYS 845 -13.257  -5.743  -4.035
   63    HA   LYS 845           HA       LYS 845 -11.246  -6.625  -2.110
   64   1HB   LYS 845          1HB       LYS 845 -11.053  -7.408  -4.859
   65   2HB   LYS 845          2HB       LYS 845  -9.809  -6.174  -4.547
   66   1HG   LYS 845          1HG       LYS 845  -8.776  -8.233  -3.953
   67   2HG   LYS 845          2HG       LYS 845  -9.273  -7.515  -2.402
   68   1HD   LYS 845          1HD       LYS 845 -11.352  -9.179  -3.699
   69   2HD   LYS 845          2HD       LYS 845  -9.892 -10.075  -3.215
   70   1HE   LYS 845          1HE       LYS 845 -10.074  -9.248  -0.937
   71   2HE   LYS 845          2HE       LYS 845 -11.420  -8.179  -1.389
   72   1HZ   LYS 845          1HZ       LYS 845 -11.494 -11.104  -1.588
   73   2HZ   LYS 845          2HZ       LYS 845 -12.102 -10.242  -0.321
   74   3HZ   LYS 845          3HZ       LYS 845 -12.748 -10.061  -1.827
   75    H    VAL 846           H        VAL 846 -13.038  -4.314  -3.658
   76    HA   VAL 846           HA       VAL 846 -12.779  -2.046  -4.053
   77    HB   VAL 846           HB       VAL 846 -11.617  -1.030  -1.860
   78   1HG1  VAL 846          1HG1      VAL 846 -14.194  -2.524  -1.416
   79   2HG1  VAL 846          2HG1      VAL 846 -13.774  -0.843  -1.008
   80   3HG1  VAL 846          3HG1      VAL 846 -14.130  -1.287  -2.695
   81   1HG2  VAL 846          1HG2      VAL 846 -11.432  -2.500  -0.063
   82   2HG2  VAL 846          2HG2      VAL 846 -12.569  -3.672  -0.770
   83   3HG2  VAL 846          3HG2      VAL 846 -10.909  -3.551  -1.401
   84    H    LEU 847           H        LEU 847 -11.492  -0.900  -5.367
   85    HA   LEU 847           HA       LEU 847  -8.611  -0.756  -4.816
   86   1HB   LEU 847          1HB       LEU 847  -9.538  -1.633  -7.562
   87   2HB   LEU 847          2HB       LEU 847  -7.894  -1.659  -6.880
   88    HG   LEU 847           HG       LEU 847  -9.035  -3.924  -6.970
   89   1HD1  LEU 847          1HD1      LEU 847  -8.736  -3.960  -4.184
   90   2HD1  LEU 847          2HD1      LEU 847  -7.452  -4.234  -5.385
   91   3HD1  LEU 847          3HD1      LEU 847  -7.709  -2.606  -4.713
   92   1HD2  LEU 847          1HD2      LEU 847 -11.117  -4.165  -6.140
   93   2HD2  LEU 847          2HD2      LEU 847 -10.590  -3.544  -4.557
   94   3HD2  LEU 847          3HD2      LEU 847 -11.151  -2.415  -5.813
   95    H    LEU 848           H        LEU 848  -9.604   1.424  -4.327
   96    HA   LEU 848           HA       LEU 848 -10.504   2.981  -6.623
   97   1HB   LEU 848          1HB       LEU 848 -10.272   3.301  -3.685
   98   2HB   LEU 848          2HB       LEU 848 -10.002   4.788  -4.626
   99    HG   LEU 848           HG       LEU 848 -12.344   2.977  -5.253
  100   1HD1  LEU 848          1HD1      LEU 848 -11.898   4.386  -2.773
  101   2HD1  LEU 848          2HD1      LEU 848 -13.209   5.189  -3.670
  102   3HD1  LEU 848          3HD1      LEU 848 -13.327   3.456  -3.283
  103   1HD2  LEU 848          1HD2      LEU 848 -12.894   4.656  -6.662
  104   2HD2  LEU 848          2HD2      LEU 848 -12.681   5.880  -5.387
  105   3HD2  LEU 848          3HD2      LEU 848 -11.281   5.338  -6.343
  106    H    ASP 849           H        ASP 849  -9.380   5.285  -6.776
  107    HA   ASP 849           HA       ASP 849  -6.662   4.733  -7.647
  108   1HB   ASP 849          1HB       ASP 849  -8.070   7.416  -7.511
  109   2HB   ASP 849          2HB       ASP 849  -6.744   6.925  -8.587
  110    H    ILE 850           H        ILE 850  -6.641   4.169  -5.000
  111    HA   ILE 850           HA       ILE 850  -5.981   6.463  -3.372
  112    HB   ILE 850           HB       ILE 850  -4.919   3.890  -2.469
  113   1HG1  ILE 850          1HG1      ILE 850  -6.766   3.187  -4.099
  114   2HG1  ILE 850          2HG1      ILE 850  -6.964   2.638  -2.417
  115   1HG2  ILE 850          1HG2      ILE 850  -5.881   6.179  -1.347
  116   2HG2  ILE 850          2HG2      ILE 850  -7.329   5.148  -1.249
  117   3HG2  ILE 850          3HG2      ILE 850  -5.808   4.621  -0.489
  118   1HD1  ILE 850          1HD1      ILE 850  -8.241   5.009  -2.237
  119   2HD1  ILE 850          2HD1      ILE 850  -8.518   4.676  -3.964
  120   3HD1  ILE 850          3HD1      ILE 850  -9.071   3.515  -2.733
  121    H    PHE 851           H        PHE 851  -3.723   3.849  -3.140
  122    HA   PHE 851           HA       PHE 851  -1.446   5.444  -3.236
  123   1HB   PHE 851          1HB       PHE 851  -1.364   2.638  -4.298
  124   2HB   PHE 851          2HB       PHE 851  -0.246   3.461  -3.198
  125    HD1  PHE 851           1HD      PHE 851  -2.637   0.949  -3.377
  126    HD2  PHE 851           2HD      PHE 851  -1.492   4.272  -0.908
  127    HE1  PHE 851           1HE      PHE 851  -3.778  -0.097  -1.440
  128    HE2  PHE 851           2HE      PHE 851  -2.633   3.226   1.029
  129    HZ   PHE 851           HZ       PHE 851  -3.776   1.041   0.763
  130    H    THR 852           H        THR 852  -2.815   6.603  -5.255
  131    HA   THR 852           HA       THR 852  -2.490   5.682  -7.860
  132    HB   THR 852           HB       THR 852  -2.072   8.349  -8.172
  133    HG1  THR 852           1HG      THR 852  -2.440   9.384  -6.391
  134   1HG2  THR 852          1HG2      THR 852  -4.773   8.229  -7.503
  135   2HG2  THR 852          2HG2      THR 852  -4.076   7.814  -9.087
  136   3HG2  THR 852          3HG2      THR 852  -4.373   6.537  -7.883
  137    H    GLY 853           H        GLY 853  -0.715   4.931  -8.849
  138   1HA   GLY 853          1HA       GLY 853   1.500   4.649  -9.407
  139   2HA   GLY 853          2HA       GLY 853   1.558   6.426  -9.408
  140    H    VAL 854           H        VAL 854   0.660   4.851  -6.434
  141    HA   VAL 854           HA       VAL 854   2.931   5.972  -5.060
  142    HB   VAL 854           HB       VAL 854   0.529   4.313  -4.366
  143   1HG1  VAL 854          1HG1      VAL 854   1.518   4.276  -1.972
  144   2HG1  VAL 854          2HG1      VAL 854   2.134   3.072  -3.130
  145   3HG1  VAL 854          3HG1      VAL 854   3.094   4.524  -2.760
  146   1HG2  VAL 854          1HG2      VAL 854   1.806   6.933  -3.534
  147   2HG2  VAL 854          2HG2      VAL 854   0.187   6.648  -4.216
  148   3HG2  VAL 854          3HG2      VAL 854   0.543   6.170  -2.539
  149    H    ARG 855           H        ARG 855   4.571   4.800  -3.894
  150    HA   ARG 855           HA       ARG 855   5.141   2.125  -5.085
  151   1HB   ARG 855          1HB       ARG 855   6.994   4.435  -4.404
  152   2HB   ARG 855          2HB       ARG 855   7.570   2.782  -4.729
  153   1HG   ARG 855          1HG       ARG 855   6.296   2.883  -6.928
  154   2HG   ARG 855          2HG       ARG 855   6.026   4.613  -6.607
  155   1HD   ARG 855          1HD       ARG 855   8.803   3.405  -6.519
  156   2HD   ARG 855          2HD       ARG 855   8.082   3.946  -8.050
  157    HE   ARG 855           HE       ARG 855   9.238   5.608  -6.032
  158   1HH1  ARG 855          2HH2      ARG 855   6.492   5.413  -8.251
  159   2HH1  ARG 855          1HH2      ARG 855   6.314   7.147  -8.399
  160   1HH2  ARG 855          2HH1      ARG 855   9.002   7.898  -6.228
  161   2HH2  ARG 855          1HH1      ARG 855   7.745   8.564  -7.246
  162    H    LEU 856           H        LEU 856   3.586   2.024  -2.920
  163    HA   LEU 856           HA       LEU 856   5.112   2.070  -0.450
  164   1HB   LEU 856          1HB       LEU 856   2.777   2.538  -0.289
  165   2HB   LEU 856          2HB       LEU 856   2.348   1.095  -1.238
  166    HG   LEU 856           HG       LEU 856   2.370   1.203   1.513
  167   1HD1  LEU 856          1HD1      LEU 856   1.363  -0.732   0.920
  168   2HD1  LEU 856          2HD1      LEU 856   2.280  -0.814  -0.604
  169   3HD1  LEU 856          3HD1      LEU 856   2.984  -1.468   0.894
  170   1HD2  LEU 856          1HD2      LEU 856   4.382   0.648   2.406
  171   2HD2  LEU 856          2HD2      LEU 856   4.724  -0.530   1.116
  172   3HD2  LEU 856          3HD2      LEU 856   5.065   1.197   0.856
  173    H    TYR 857           H        TYR 857   6.593   0.573   0.054
  174    HA   TYR 857           HA       TYR 857   6.691  -1.967  -1.335
  175   1HB   TYR 857          1HB       TYR 857   8.820  -1.433  -0.811
  176   2HB   TYR 857          2HB       TYR 857   8.332  -0.402   0.545
  177    HD1  TYR 857           1HD      TYR 857   7.672  -4.045  -0.022
  178    HD2  TYR 857           2HD      TYR 857   9.692  -1.069   2.327
  179    HE1  TYR 857           1HE      TYR 857   8.402  -5.799   1.572
  180    HE2  TYR 857           2HE      TYR 857  10.421  -2.823   3.921
  181    HH   TYR 857           HH       TYR 857   9.819  -5.104   4.642
  182    H    LEU 858           H        LEU 858   4.984  -3.305  -0.894
  183    HA   LEU 858           HA       LEU 858   3.979  -3.594   1.825
  184   1HB   LEU 858          1HB       LEU 858   2.546  -3.726  -0.230
  185   2HB   LEU 858          2HB       LEU 858   3.384  -5.234  -0.667
  186    HG   LEU 858           HG       LEU 858   2.249  -6.445   0.885
  187   1HD1  LEU 858          1HD1      LEU 858   2.630  -4.024   2.688
  188   2HD1  LEU 858          2HD1      LEU 858   1.749  -5.484   3.198
  189   3HD1  LEU 858          3HD1      LEU 858   3.473  -5.589   2.769
  190   1HD2  LEU 858          1HD2      LEU 858   0.418  -4.203   1.588
  191   2HD2  LEU 858          2HD2      LEU 858   0.614  -4.521  -0.152
  192   3HD2  LEU 858          3HD2      LEU 858   0.048  -5.815   0.932
  193    HA   PRO 859           HA       PRO 859   7.166  -6.637   2.676
  194   1HB   PRO 859          1HB       PRO 859   6.740  -6.766   5.364
  195   2HB   PRO 859          2HB       PRO 859   7.508  -5.339   4.596
  196   1HG   PRO 859          1HG       PRO 859   4.584  -5.687   5.316
  197   2HG   PRO 859          2HG       PRO 859   5.659  -4.322   5.761
  198   1HD   PRO 859          1HD       PRO 859   4.014  -4.188   3.592
  199   2HD   PRO 859          2HD       PRO 859   5.671  -3.514   3.517
  200    HA   PRO 860           HA       PRO 860   4.615 -10.239   2.587
  201   1HB   PRO 860          1HB       PRO 860   6.447 -12.149   3.234
  202   2HB   PRO 860          2HB       PRO 860   6.557 -11.212   1.709
  203   1HG   PRO 860          1HG       PRO 860   7.987 -10.644   4.321
  204   2HG   PRO 860          2HG       PRO 860   8.718 -10.789   2.689
  205   1HD   PRO 860          1HD       PRO 860   8.065  -8.362   3.744
  206   2HD   PRO 860          2HD       PRO 860   7.779  -8.705   2.011
  207    H    SER 861           H        SER 861   6.307  -9.092   5.420
  208    HA   SER 861           HA       SER 861   5.095 -11.054   7.217
  209   1HB   SER 861          1HB       SER 861   7.248  -9.153   7.287
  210   2HB   SER 861          2HB       SER 861   6.123  -8.784   8.616
  211    HG   SER 861           HG       SER 861   7.780 -10.415   9.048
  212    H    THR 862           H        THR 862   4.205  -8.086   5.710
  213    HA   THR 862           HA       THR 862   2.523  -7.027   7.773
  214    HB   THR 862           HB       THR 862   3.117  -6.529   4.928
  215    HG1  THR 862           1HG      THR 862   2.773  -4.385   5.762
  216   1HG2  THR 862          1HG2      THR 862   1.037  -5.437   4.383
  217   2HG2  THR 862          2HG2      THR 862   0.632  -7.086   4.916
  218   3HG2  THR 862          3HG2      THR 862   0.397  -5.710   6.021
  219    HA   PRO 863           HA       PRO 863  -0.835  -9.874   7.526
  220   1HB   PRO 863          1HB       PRO 863  -2.713  -8.442   8.885
  221   2HB   PRO 863          2HB       PRO 863  -1.244  -9.080   9.693
  222   1HG   PRO 863          1HG       PRO 863  -1.658  -6.298   8.562
  223   2HG   PRO 863          2HG       PRO 863  -1.094  -6.730  10.210
  224   1HD   PRO 863          1HD       PRO 863   0.665  -6.127   8.218
  225   2HD   PRO 863          2HD       PRO 863   1.017  -7.452   9.369
  226    H    ASP 864           H        ASP 864  -2.798 -10.163   6.365
  227    HA   ASP 864           HA       ASP 864  -4.362  -9.744   4.741
  228   1HB   ASP 864          1HB       ASP 864  -3.958  -7.179   6.031
  229   2HB   ASP 864          2HB       ASP 864  -4.245  -6.956   4.291
  230    H    PHE 865           H        PHE 865  -1.148  -9.474   4.496
  231    HA   PHE 865           HA       PHE 865  -0.352  -8.072   2.316
  232   1HB   PHE 865          1HB       PHE 865   0.860  -9.878   3.727
  233   2HB   PHE 865          2HB       PHE 865   0.267 -11.022   2.511
  234    HD1  PHE 865           1HD      PHE 865   1.808 -11.593   0.895
  235    HD2  PHE 865           2HD      PHE 865   1.867  -7.611   2.506
  236    HE1  PHE 865           1HE      PHE 865   3.728 -11.028  -0.570
  237    HE2  PHE 865           2HE      PHE 865   3.786  -7.047   1.041
  238    HZ   PHE 865           HZ       PHE 865   4.717  -8.755  -0.497
  239    H    SER 866           H        SER 866  -2.088 -11.229   2.179
  240    HA   SER 866           HA       SER 866  -2.237 -11.903  -0.376
  241   1HB   SER 866          1HB       SER 866  -4.142 -11.883   1.819
  242   2HB   SER 866          2HB       SER 866  -4.976 -11.693   0.258
  243    HG   SER 866           HG       SER 866  -4.668 -13.877   0.713
  244    H    ARG 867           H        ARG 867  -4.849  -9.653   0.610
  245    HA   ARG 867           HA       ARG 867  -5.064  -8.609  -2.067
  246   1HB   ARG 867          1HB       ARG 867  -6.203  -7.389   0.467
  247   2HB   ARG 867          2HB       ARG 867  -6.849  -7.302  -1.190
  248   1HG   ARG 867          1HG       ARG 867  -7.945  -9.263  -0.947
  249   2HG   ARG 867          2HG       ARG 867  -6.485 -10.072  -0.328
  250   1HD   ARG 867          1HD       ARG 867  -7.041  -9.695   1.865
  251   2HD   ARG 867          2HD       ARG 867  -7.806  -8.131   1.513
  252    HE   ARG 867           HE       ARG 867  -9.841  -9.203   1.302
  253   1HH1  ARG 867          2HH2      ARG 867  -7.203 -11.544   1.051
  254   2HH1  ARG 867          1HH2      ARG 867  -8.260 -12.939   1.041
  255   1HH2  ARG 867          2HH1      ARG 867 -11.236 -11.045   1.289
  256   2HH2  ARG 867          1HH1      ARG 867 -10.559 -12.654   1.177
  257    H    LEU 868           H        LEU 868  -3.665  -7.443   1.019
  258    HA   LEU 868           HA       LEU 868  -3.100  -4.844   0.598
  259   1HB   LEU 868          1HB       LEU 868  -1.645  -7.102   1.839
  260   2HB   LEU 868          2HB       LEU 868  -0.623  -5.707   1.413
  261    HG   LEU 868           HG       LEU 868  -2.557  -5.979   3.571
  262   1HD1  LEU 868          1HD1      LEU 868  -1.373  -3.407   3.543
  263   2HD1  LEU 868          2HD1      LEU 868  -0.818  -4.838   4.444
  264   3HD1  LEU 868          3HD1      LEU 868  -0.169  -4.502   2.821
  265   1HD2  LEU 868          1HD2      LEU 868  -4.058  -4.919   1.852
  266   2HD2  LEU 868          2HD2      LEU 868  -3.762  -3.883   3.268
  267   3HD2  LEU 868          3HD2      LEU 868  -2.905  -3.568   1.740
  268    H    ARG 869           H        ARG 869  -1.241  -7.547  -0.890
  269    HA   ARG 869           HA       ARG 869   0.469  -5.817  -2.407
  270   1HB   ARG 869          1HB       ARG 869   0.870  -8.251  -1.763
  271   2HB   ARG 869          2HB       ARG 869  -0.284  -8.689  -3.046
  272   1HG   ARG 869          1HG       ARG 869   1.246  -8.312  -4.668
  273   2HG   ARG 869          2HG       ARG 869   1.690  -6.734  -3.974
  274   1HD   ARG 869          1HD       ARG 869   3.602  -8.328  -3.985
  275   2HD   ARG 869          2HD       ARG 869   3.151  -7.827  -2.341
  276    HE   ARG 869           HE       ARG 869   2.392  -9.995  -1.885
  277   1HH1  ARG 869          2HH2      ARG 869   3.265  -9.597  -5.288
  278   2HH1  ARG 869          1HH2      ARG 869   3.233 -11.310  -5.638
  279   1HH2  ARG 869          2HH1      ARG 869   2.350 -12.259  -2.348
  280   2HH2  ARG 869          1HH1      ARG 869   2.712 -12.828  -3.962
  281    H    ARG 870           H        ARG 870  -1.672  -8.232  -3.935
  282    HA   ARG 870           HA       ARG 870  -1.998  -7.066  -6.366
  283   1HB   ARG 870          1HB       ARG 870  -3.372  -9.022  -4.798
  284   2HB   ARG 870          2HB       ARG 870  -4.598  -7.974  -5.549
  285   1HG   ARG 870          1HG       ARG 870  -4.003  -9.857  -7.042
  286   2HG   ARG 870          2HG       ARG 870  -3.524  -8.299  -7.757
  287   1HD   ARG 870          1HD       ARG 870  -1.399  -9.017  -7.884
  288   2HD   ARG 870          2HD       ARG 870  -1.361  -9.198  -6.117
  289    HE   ARG 870           HE       ARG 870  -2.687 -11.458  -7.109
  290   1HH1  ARG 870          2HH2      ARG 870   0.482  -9.918  -7.398
  291   2HH1  ARG 870          1HH2      ARG 870   1.339 -11.419  -7.665
  292   1HH2  ARG 870          2HH1      ARG 870  -1.555 -13.441  -7.462
  293   2HH2  ARG 870          1HH1      ARG 870   0.178 -13.428  -7.702
  294    H    TYR 871           H        TYR 871  -4.236  -6.459  -3.593
  295    HA   TYR 871           HA       TYR 871  -5.874  -4.557  -4.673
  296   1HB   TYR 871          1HB       TYR 871  -5.842  -5.475  -2.314
  297   2HB   TYR 871          2HB       TYR 871  -4.574  -4.295  -1.946
  298    HD1  TYR 871           1HD      TYR 871  -5.496  -2.691  -0.539
  299    HD2  TYR 871           2HD      TYR 871  -7.719  -3.993  -3.975
  300    HE1  TYR 871           1HE      TYR 871  -7.226  -0.978  -0.068
  301    HE2  TYR 871           2HE      TYR 871  -9.449  -2.280  -3.505
  302    HH   TYR 871           HH       TYR 871  -9.961  -0.391  -2.255
  303    H    PHE 872           H        PHE 872  -2.836  -3.706  -2.907
  304    HA   PHE 872           HA       PHE 872  -2.776  -1.007  -3.582
  305   1HB   PHE 872          1HB       PHE 872  -1.275  -2.326  -2.003
  306   2HB   PHE 872          2HB       PHE 872  -0.342  -2.805  -3.431
  307    HD1  PHE 872           1HD      PHE 872  -0.312  -0.632  -0.773
  308    HD2  PHE 872           2HD      PHE 872   0.103  -0.590  -5.048
  309    HE1  PHE 872           1HE      PHE 872   0.988   1.475  -0.626
  310    HE2  PHE 872           2HE      PHE 872   1.403   1.517  -4.902
  311    HZ   PHE 872           HZ       PHE 872   1.846   2.549  -2.691
  312    H    VAL 873           H        VAL 873  -0.146  -2.846  -5.023
  313    HA   VAL 873           HA       VAL 873   0.338  -1.479  -7.250
  314    HB   VAL 873           HB       VAL 873   1.635  -3.365  -7.189
  315   1HG1  VAL 873          1HG1      VAL 873   0.590  -5.672  -6.763
  316   2HG1  VAL 873          2HG1      VAL 873   0.522  -4.517  -5.411
  317   3HG1  VAL 873          3HG1      VAL 873  -0.924  -4.806  -6.407
  318   1HG2  VAL 873          1HG2      VAL 873  -0.458  -4.731  -8.865
  319   2HG2  VAL 873          2HG2      VAL 873   0.208  -3.181  -9.432
  320   3HG2  VAL 873          3HG2      VAL 873   1.291  -4.564  -9.150
  321    H    ALA 874           H        ALA 874  -2.508  -3.591  -6.819
  322    HA   ALA 874           HA       ALA 874  -3.491  -3.539  -9.449
  323   1HB   ALA 874          1HB       ALA 874  -4.829  -3.690  -6.732
  324   2HB   ALA 874          2HB       ALA 874  -5.755  -3.784  -8.250
  325   3HB   ALA 874          3HB       ALA 874  -4.513  -5.007  -7.888
  326    H    PHE 875           H        PHE 875  -4.386  -1.370  -6.698
  327    HA   PHE 875           HA       PHE 875  -6.112   0.361  -7.824
  328   1HB   PHE 875          1HB       PHE 875  -3.621   1.206  -6.307
  329   2HB   PHE 875          2HB       PHE 875  -5.118   2.140  -6.466
  330    HD1  PHE 875           1HD      PHE 875  -4.541   1.987  -3.826
  331    HD2  PHE 875           2HD      PHE 875  -6.080  -1.209  -6.248
  332    HE1  PHE 875           1HE      PHE 875  -5.440   0.882  -1.796
  333    HE2  PHE 875           2HE      PHE 875  -6.979  -2.314  -4.218
  334    HZ   PHE 875           HZ       PHE 875  -6.659  -1.269  -1.992
  335    H    ASP 876           H        ASP 876  -2.547   0.512  -8.330
  336    HA   ASP 876           HA       ASP 876  -2.310   0.948 -10.942
  337   1HB   ASP 876          1HB       ASP 876  -3.774   3.245  -9.752
  338   2HB   ASP 876          2HB       ASP 876  -2.450   3.664 -10.861
  339    H    GLY 877           H        GLY 877  -1.144   0.891  -7.995
  340   1HA   GLY 877          1HA       GLY 877   1.151   2.715  -8.457
  341   2HA   GLY 877          2HA       GLY 877   0.715   1.936  -6.920
  342    H    ASP 878           H        ASP 878   2.727   0.962  -6.560
  343    HA   ASP 878           HA       ASP 878   3.140  -1.533  -7.995
  344   1HB   ASP 878          1HB       ASP 878   4.341   0.624  -9.153
  345   2HB   ASP 878          2HB       ASP 878   5.595   0.135  -7.992
  346    H    LEU 879           H        LEU 879   4.650  -2.919  -6.895
  347    HA   LEU 879           HA       LEU 879   5.412  -1.922  -4.191
  348   1HB   LEU 879          1HB       LEU 879   4.583  -4.774  -4.766
  349   2HB   LEU 879          2HB       LEU 879   4.666  -3.927  -3.203
  350    HG   LEU 879           HG       LEU 879   2.628  -3.607  -5.425
  351   1HD1  LEU 879          1HD1      LEU 879   1.371  -4.791  -3.978
  352   2HD1  LEU 879          2HD1      LEU 879   2.743  -4.873  -2.847
  353   3HD1  LEU 879          3HD1      LEU 879   1.591  -3.520  -2.752
  354   1HD2  LEU 879          1HD2      LEU 879   2.519  -1.392  -5.014
  355   2HD2  LEU 879          2HD2      LEU 879   2.071  -1.770  -3.333
  356   3HD2  LEU 879          3HD2      LEU 879   3.780  -1.526  -3.764
  357    H    VAL 880           H        VAL 880   7.556  -1.960  -3.918
  358    HA   VAL 880           HA       VAL 880   9.164  -3.714  -5.680
  359    HB   VAL 880           HB       VAL 880  10.626  -1.933  -3.879
  360   1HG1  VAL 880          1HG1      VAL 880  11.281  -3.092  -6.110
  361   2HG1  VAL 880          2HG1      VAL 880  10.373  -1.780  -6.897
  362   3HG1  VAL 880          3HG1      VAL 880  11.782  -1.400  -5.878
  363   1HG2  VAL 880          1HG2      VAL 880   8.982  -0.312  -3.876
  364   2HG2  VAL 880          2HG2      VAL 880   9.728   0.061  -5.448
  365   3HG2  VAL 880          3HG2      VAL 880   8.239  -0.912  -5.378
  366    H    GLN 881           H        GLN 881  10.397  -5.379  -4.916
  367    HA   GLN 881           HA       GLN 881   9.738  -6.551  -2.421
  368   1HB   GLN 881          1HB       GLN 881  12.264  -7.026  -4.042
  369   2HB   GLN 881          2HB       GLN 881  11.430  -8.166  -2.958
  370   1HG   GLN 881          1HG       GLN 881   9.995  -8.789  -4.584
  371   2HG   GLN 881          2HG       GLN 881   9.622  -7.100  -4.989
  372   1HE2  GLN 881          1HE2      GLN 881  10.474  -6.201  -6.821
  373   2HE2  GLN 881          2HE2      GLN 881  11.627  -7.000  -7.868
  374    H    GLU 882           H        GLU 882  10.529  -6.304  -0.397
  375    HA   GLU 882           HA       GLU 882  11.726  -4.192   0.661
  376   1HB   GLU 882          1HB       GLU 882  11.148  -6.203   1.953
  377   2HB   GLU 882          2HB       GLU 882  12.560  -7.054   1.281
  378   1HG   GLU 882          1HG       GLU 882  13.759  -4.794   2.209
  379   2HG   GLU 882          2HG       GLU 882  12.419  -4.931   3.368
  380    H    PHE 883           H        PHE 883  13.881  -6.939  -0.254
  381    HA   PHE 883           HA       PHE 883  16.219  -5.301  -0.270
  382   1HB   PHE 883          1HB       PHE 883  17.332  -7.237  -1.075
  383   2HB   PHE 883          2HB       PHE 883  16.068  -7.811   0.026
  384    HD1  PHE 883           1HD      PHE 883  14.069  -8.954  -0.837
  385    HD2  PHE 883           2HD      PHE 883  17.242  -7.700  -3.447
  386    HE1  PHE 883           1HE      PHE 883  13.180 -10.424  -2.625
  387    HE2  PHE 883           2HE      PHE 883  16.353  -9.170  -5.235
  388    HZ   PHE 883           HZ       PHE 883  14.321 -10.532  -4.824
  389    H    ASP 884           H        ASP 884  13.689  -4.756  -2.106
  390    HA   ASP 884           HA       ASP 884  15.344  -3.895  -4.401
  391   1HB   ASP 884          1HB       ASP 884  12.773  -5.507  -4.602
  392   2HB   ASP 884          2HB       ASP 884  13.576  -4.699  -5.966
  393    H    MET 885           H        MET 885  15.147  -1.759  -3.646
  394    HA   MET 885           HA       MET 885  12.488  -0.581  -4.160
  395   1HB   MET 885          1HB       MET 885  13.223   0.857  -1.969
  396   2HB   MET 885          2HB       MET 885  12.132  -0.548  -1.908
  397   1HG   MET 885          1HG       MET 885  14.276  -1.963  -1.677
  398   2HG   MET 885          2HG       MET 885  15.101  -0.436  -1.326
  399   1HE   MET 885          1HE       MET 885  12.358  -2.784  -0.652
  400   2HE   MET 885          2HE       MET 885  12.237  -2.919   1.119
  401   3HE   MET 885          3HE       MET 885  11.324  -1.657   0.258
  402    H    THR 886           H        THR 886  15.989  -0.276  -3.621
  403    HA   THR 886           HA       THR 886  16.882   2.114  -3.834
  404    HB   THR 886           HB       THR 886  18.465   1.527  -5.484
  405    HG1  THR 886           1HG      THR 886  17.913  -0.125  -7.041
  406   1HG2  THR 886          1HG2      THR 886  19.092  -0.685  -4.888
  407   2HG2  THR 886          2HG2      THR 886  18.141  -0.107  -3.499
  408   3HG2  THR 886          3HG2      THR 886  17.399  -1.201  -4.692
  409    H    SER 887           H        SER 887  15.019   0.822  -6.640
  410    HA   SER 887           HA       SER 887  14.687   3.586  -7.628
  411   1HB   SER 887          1HB       SER 887  14.615   0.855  -8.761
  412   2HB   SER 887          2HB       SER 887  13.351   1.944  -9.381
  413    HG   SER 887           HG       SER 887  15.338   3.465  -9.434
  414    H    ALA 888           H        ALA 888  13.103   1.274  -5.664
  415    HA   ALA 888           HA       ALA 888  10.407   1.534  -6.281
  416   1HB   ALA 888          1HB       ALA 888  11.846   1.346  -3.613
  417   2HB   ALA 888          2HB       ALA 888  10.076   1.246  -3.772
  418   3HB   ALA 888          3HB       ALA 888  11.110   0.028  -4.556
  419    H    THR 889           H        THR 889   9.263   2.737  -3.917
  420    HA   THR 889           HA       THR 889  10.081   5.534  -3.895
  421    HB   THR 889           HB       THR 889   8.422   4.818  -5.962
  422    HG1  THR 889           1HG      THR 889   9.117   6.815  -6.050
  423   1HG2  THR 889          1HG2      THR 889   6.164   5.266  -5.426
  424   2HG2  THR 889          2HG2      THR 889   6.723   4.263  -4.066
  425   3HG2  THR 889          3HG2      THR 889   6.590   6.028  -3.874
  426    H    HIS 890           H        HIS 890   7.634   3.040  -3.114
  427    HA   HIS 890           HA       HIS 890   7.255   4.414  -0.494
  428   1HB   HIS 890          1HB       HIS 890   5.339   2.987  -2.333
  429   2HB   HIS 890          2HB       HIS 890   5.018   3.074  -0.591
  430    HD1  HIS 890           1HD      HIS 890   5.007   5.251  -3.711
  431    HD2  HIS 890           2HD      HIS 890   4.517   5.539   0.459
  432    HE1  HIS 890           1HE      HIS 890   3.990   7.551  -3.247
  433    H    VAL 891           H        VAL 891   7.060   3.069   1.364
  434    HA   VAL 891           HA       VAL 891   7.655   0.201   1.001
  435    HB   VAL 891           HB       VAL 891   9.495   0.399   2.719
  436   1HG1  VAL 891          1HG1      VAL 891  11.092   1.577   1.004
  437   2HG1  VAL 891          2HG1      VAL 891  10.269   0.074   0.523
  438   3HG1  VAL 891          3HG1      VAL 891   9.646   1.647  -0.032
  439   1HG2  VAL 891          1HG2      VAL 891  10.509   2.630   3.032
  440   2HG2  VAL 891          2HG2      VAL 891   9.226   3.359   2.035
  441   3HG2  VAL 891          3HG2      VAL 891   8.824   2.618   3.603
  442    H    LEU 892           H        LEU 892   6.360  -0.940   2.312
  443    HA   LEU 892           HA       LEU 892   4.776   0.441   4.321
  444   1HB   LEU 892          1HB       LEU 892   4.485  -1.831   2.717
  445   2HB   LEU 892          2HB       LEU 892   4.673  -2.482   4.363
  446    HG   LEU 892           HG       LEU 892   2.939  -0.107   4.268
  447   1HD1  LEU 892          1HD1      LEU 892   2.390  -2.501   2.510
  448   2HD1  LEU 892          2HD1      LEU 892   1.038  -1.666   3.311
  449   3HD1  LEU 892          3HD1      LEU 892   2.094  -0.775   2.189
  450   1HD2  LEU 892          1HD2      LEU 892   2.543  -2.981   5.208
  451   2HD2  LEU 892          2HD2      LEU 892   3.178  -1.645   6.199
  452   3HD2  LEU 892          3HD2      LEU 892   1.498  -1.598   5.613
  453    H    GLY 893           H        GLY 893   5.369   0.766   6.379
  454   1HA   GLY 893          1HA       GLY 893   6.552   0.592   8.342
  455   2HA   GLY 893          2HA       GLY 893   6.414  -1.165   8.106
  456    H    SER 894           H        SER 894   8.573   1.379   8.462
  457    HA   SER 894           HA       SER 894  10.882   1.315   8.483
  458   1HB   SER 894          1HB       SER 894  10.310  -1.438   7.388
  459   2HB   SER 894          2HB       SER 894  11.965  -0.783   7.344
  460    HG   SER 894           HG       SER 894  11.615  -1.887   9.277
  461    H    ARG 895           H        ARG 895  12.724   1.451   6.847
  462    HA   ARG 895           HA       ARG 895  11.777   1.853   4.078
  463   1HB   ARG 895          1HB       ARG 895  12.916   4.106   4.061
  464   2HB   ARG 895          2HB       ARG 895  11.436   4.037   5.048
  465   1HG   ARG 895          1HG       ARG 895  12.640   4.018   7.075
  466   2HG   ARG 895          2HG       ARG 895  14.145   3.490   6.284
  467   1HD   ARG 895          1HD       ARG 895  14.772   5.622   5.934
  468   2HD   ARG 895          2HD       ARG 895  13.235   5.982   5.119
  469    HE   ARG 895           HE       ARG 895  13.114   5.898   8.049
  470   1HH1  ARG 895          2HH2      ARG 895  13.564   7.835   5.126
  471   2HH1  ARG 895          1HH2      ARG 895  13.132   9.345   5.895
  472   1HH2  ARG 895          2HH1      ARG 895  12.542   7.894   9.065
  473   2HH2  ARG 895          1HH1      ARG 895  12.549   9.379   8.141
  474    H    ASP 896           H        ASP 896  14.362   1.570   6.490
  475    HA   ASP 896           HA       ASP 896  16.732   1.732   5.534
  476   1HB   ASP 896          1HB       ASP 896  16.538   0.214   7.312
  477   2HB   ASP 896          2HB       ASP 896  15.424  -0.842   6.416
  478    H    LYS 897           H        LYS 897  15.169  -1.269   4.321
  479    HA   LYS 897           HA       LYS 897  16.682  -1.873   2.199
  480   1HB   LYS 897          1HB       LYS 897  14.052  -1.954   1.134
  481   2HB   LYS 897          2HB       LYS 897  14.947  -3.270   1.931
  482   1HG   LYS 897          1HG       LYS 897  13.022  -3.089   3.266
  483   2HG   LYS 897          2HG       LYS 897  14.196  -2.087   4.151
  484   1HD   LYS 897          1HD       LYS 897  13.285  -0.118   2.720
  485   2HD   LYS 897          2HD       LYS 897  11.919  -1.200   2.356
  486   1HE   LYS 897          1HE       LYS 897  12.027  -1.536   5.031
  487   2HE   LYS 897          2HE       LYS 897  12.698   0.106   4.932
  488   1HZ   LYS 897          1HZ       LYS 897  10.214  -0.171   5.123
  489   2HZ   LYS 897          2HZ       LYS 897  10.781   0.885   3.989
  490   3HZ   LYS 897          3HZ       LYS 897  10.240  -0.605   3.532
  491    H    ASN 898           H        ASN 898  14.498   0.928   2.377
  492    HA   ASN 898           HA       ASN 898  15.952   2.202   0.203
  493   1HB   ASN 898          1HB       ASN 898  13.752   0.628  -0.498
  494   2HB   ASN 898          2HB       ASN 898  13.097   2.278  -0.427
  495   1HD2  ASN 898          1HD2      ASN 898  12.927   2.863  -2.547
  496   2HD2  ASN 898          2HD2      ASN 898  14.255   2.855  -3.687
  497    HA   PRO 899           HA       PRO 899  14.515   5.151   3.336
  498   1HB   PRO 899          1HB       PRO 899  16.627   6.856   3.103
  499   2HB   PRO 899          2HB       PRO 899  16.773   5.281   3.947
  500   1HG   PRO 899          1HG       PRO 899  17.487   5.894   1.065
  501   2HG   PRO 899          2HG       PRO 899  18.524   5.107   2.300
  502   1HD   PRO 899          1HD       PRO 899  17.074   3.641   0.518
  503   2HD   PRO 899          2HD       PRO 899  17.217   3.114   2.222
  504    H    ALA 900           H        ALA 900  15.005   5.187  -0.058
  505    HA   ALA 900           HA       ALA 900  14.173   7.988  -0.388
  506   1HB   ALA 900          1HB       ALA 900  15.856   7.191  -1.913
  507   2HB   ALA 900          2HB       ALA 900  14.890   5.752  -2.318
  508   3HB   ALA 900          3HB       ALA 900  14.345   7.365  -2.838
  509    H    ALA 901           H        ALA 901  12.678   5.082   0.312
  510    HA   ALA 901           HA       ALA 901  10.329   5.536  -1.405
  511   1HB   ALA 901          1HB       ALA 901  10.777   3.445   0.756
  512   2HB   ALA 901          2HB       ALA 901   9.553   3.422  -0.536
  513   3HB   ALA 901          3HB       ALA 901  11.277   3.241  -0.940
  514    H    GLN 902           H        GLN 902   8.437   4.508   0.562
  515    HA   GLN 902           HA       GLN 902   8.343   6.812   2.450
  516   1HB   GLN 902          1HB       GLN 902   6.325   5.798   0.475
  517   2HB   GLN 902          2HB       GLN 902   5.738   6.411   2.039
  518   1HG   GLN 902          1HG       GLN 902   7.490   7.887   0.034
  519   2HG   GLN 902          2HG       GLN 902   5.800   8.251   0.444
  520   1HE2  GLN 902          1HE2      GLN 902   6.081   7.755   3.308
  521   2HE2  GLN 902          2HE2      GLN 902   7.006   9.087   3.966
  522    H    GLN 903           H        GLN 903   7.934   6.288   4.535
  523    HA   GLN 903           HA       GLN 903   7.629   3.432   5.162
  524   1HB   GLN 903          1HB       GLN 903   8.229   5.937   6.759
  525   2HB   GLN 903          2HB       GLN 903   7.878   4.379   7.545
  526   1HG   GLN 903          1HG       GLN 903   9.961   3.644   7.121
  527   2HG   GLN 903          2HG       GLN 903   9.765   3.982   5.388
  528   1HE2  GLN 903          1HE2      GLN 903  10.493   5.968   4.517
  529   2HE2  GLN 903          2HE2      GLN 903  11.556   7.035   5.409
  530    H    VAL 904           H        VAL 904   5.385   3.659   4.053
  531    HA   VAL 904           HA       VAL 904   3.356   4.916   5.760
  532    HB   VAL 904           HB       VAL 904   2.090   4.878   3.890
  533   1HG1  VAL 904          1HG1      VAL 904   3.321   4.975   1.895
  534   2HG1  VAL 904          2HG1      VAL 904   4.580   5.246   3.123
  535   3HG1  VAL 904          3HG1      VAL 904   4.395   3.640   2.377
  536   1HG2  VAL 904          1HG2      VAL 904   3.009   1.990   3.654
  537   2HG2  VAL 904          2HG2      VAL 904   1.406   2.595   4.135
  538   3HG2  VAL 904          3HG2      VAL 904   1.951   2.762   2.448
  539    H    SER 905           H        SER 905   1.331   3.510   6.202
  540    HA   SER 905           HA       SER 905   2.189   0.785   7.045
  541   1HB   SER 905          1HB       SER 905   1.717   2.942   8.755
  542   2HB   SER 905          2HB       SER 905   0.188   2.031   8.782
  543    HG   SER 905           HG       SER 905   2.673   1.352   9.737
  544    HA   PRO 906           HA       PRO 906  -1.753  -0.705   5.726
  545   1HB   PRO 906          1HB       PRO 906  -3.126  -1.707   7.856
  546   2HB   PRO 906          2HB       PRO 906  -1.559  -2.404   7.329
  547   1HG   PRO 906          1HG       PRO 906  -2.016  -0.352   9.514
  548   2HG   PRO 906          2HG       PRO 906  -1.105  -1.892   9.640
  549   1HD   PRO 906          1HD       PRO 906   0.160   0.472   9.150
  550   2HD   PRO 906          2HD       PRO 906   0.676  -1.024   8.313
  551    H    GLU 907           H        GLU 907  -1.908   1.629   8.388
  552    HA   GLU 907           HA       GLU 907  -4.703   2.249   8.076
  553   1HB   GLU 907          1HB       GLU 907  -2.379   3.758   9.330
  554   2HB   GLU 907          2HB       GLU 907  -4.084   4.256   9.448
  555   1HG   GLU 907          1HG       GLU 907  -4.666   2.427  10.774
  556   2HG   GLU 907          2HG       GLU 907  -3.315   1.436  10.182
  557    H    TRP 908           H        TRP 908  -1.690   3.323   6.564
  558    HA   TRP 908           HA       TRP 908  -2.748   5.716   5.395
  559   1HB   TRP 908          1HB       TRP 908  -0.366   5.348   5.660
  560   2HB   TRP 908          2HB       TRP 908  -0.437   3.905   4.639
  561    HD1  TRP 908           HD       TRP 908  -0.617   7.722   4.445
  562    HE1  TRP 908           1HE      TRP 908  -0.085   8.494   2.077
  563    HE3  TRP 908           3HE      TRP 908  -0.416   3.159   2.134
  564    HZ2  TRP 908           2HZ      TRP 908   0.373   7.287  -0.514
  565    HZ3  TRP 908           3HZ      TRP 908   0.070   3.011  -0.281
  566    HH2  TRP 908           HH       TRP 908   0.465   5.060  -1.616
  567    H    ILE 909           H        ILE 909  -2.366   2.338   4.231
  568    HA   ILE 909           HA       ILE 909  -3.270   2.725   1.600
  569    HB   ILE 909           HB       ILE 909  -3.103   0.456   3.533
  570   1HG1  ILE 909          1HG1      ILE 909  -2.390  -0.104   0.794
  571   2HG1  ILE 909          2HG1      ILE 909  -1.719   1.479   1.254
  572   1HG2  ILE 909          1HG2      ILE 909  -4.639   0.240   0.912
  573   2HG2  ILE 909          2HG2      ILE 909  -4.350  -1.051   2.102
  574   3HG2  ILE 909          3HG2      ILE 909  -5.415   0.315   2.512
  575   1HD1  ILE 909          1HD1      ILE 909  -0.075   0.375   2.338
  576   2HD1  ILE 909          2HD1      ILE 909  -1.305  -0.182   3.498
  577   3HD1  ILE 909          3HD1      ILE 909  -0.891  -1.188   2.089
  578    H    TRP 910           H        TRP 910  -5.143   1.873   4.564
  579    HA   TRP 910           HA       TRP 910  -7.675   1.828   3.284
  580   1HB   TRP 910          1HB       TRP 910  -7.112   2.626   6.148
  581   2HB   TRP 910          2HB       TRP 910  -8.579   1.883   5.497
  582    HD1  TRP 910           HD       TRP 910  -5.841   0.995   7.561
  583    HE1  TRP 910           1HE      TRP 910  -5.297  -1.493   7.547
  584    HE3  TRP 910           3HE      TRP 910  -8.394  -0.364   3.339
  585    HZ2  TRP 910           2HZ      TRP 910  -5.892  -3.802   5.907
  586    HZ3  TRP 910           3HZ      TRP 910  -8.382  -2.713   2.583
  587    HH2  TRP 910           HH       TRP 910  -7.139  -4.440   3.852
  588    H    ALA 911           H        ALA 911  -6.194   4.402   5.342
  589    HA   ALA 911           HA       ALA 911  -8.165   6.347   4.895
  590   1HB   ALA 911          1HB       ALA 911  -6.379   6.493   6.603
  591   2HB   ALA 911          2HB       ALA 911  -5.174   6.731   5.315
  592   3HB   ALA 911          3HB       ALA 911  -6.437   7.954   5.589
  593    H    CYS 912           H        CYS 912  -5.427   5.308   2.900
  594    HA   CYS 912           HA       CYS 912  -5.536   7.541   1.083
  595   1HB   CYS 912          1HB       CYS 912  -4.356   4.743   0.899
  596   2HB   CYS 912          2HB       CYS 912  -4.154   5.988  -0.360
  597    HG   CYS 912           HG       CYS 912  -2.272   6.988   0.607
  598    H    ILE 913           H        ILE 913  -6.158   4.091   0.279
  599    HA   ILE 913           HA       ILE 913  -7.642   4.479  -2.001
  600    HB   ILE 913           HB       ILE 913  -6.979   2.271  -1.295
  601   1HG1  ILE 913          1HG1      ILE 913 -10.016   2.491  -1.149
  602   2HG1  ILE 913          2HG1      ILE 913  -9.066   2.475  -2.655
  603   1HG2  ILE 913          1HG2      ILE 913  -7.140   1.641   0.862
  604   2HG2  ILE 913          2HG2      ILE 913  -7.974   3.170   1.229
  605   3HG2  ILE 913          3HG2      ILE 913  -8.915   1.730   0.773
  606   1HD1  ILE 913          1HD1      ILE 913  -8.455   0.273  -0.756
  607   2HD1  ILE 913          2HD1      ILE 913 -10.088   0.230  -1.461
  608   3HD1  ILE 913          3HD1      ILE 913  -8.659   0.232  -2.523
  609    H    ARG 914           H        ARG 914  -8.780   4.614   1.391
  610    HA   ARG 914           HA       ARG 914 -11.549   4.934   0.728
  611   1HB   ARG 914          1HB       ARG 914 -10.567   4.207   2.953
  612   2HB   ARG 914          2HB       ARG 914 -10.105   5.906   3.219
  613   1HG   ARG 914          1HG       ARG 914 -12.735   6.163   2.443
  614   2HG   ARG 914          2HG       ARG 914 -12.774   4.624   3.337
  615   1HD   ARG 914          1HD       ARG 914 -11.232   6.077   5.022
  616   2HD   ARG 914          2HD       ARG 914 -12.191   7.390   4.305
  617    HE   ARG 914           HE       ARG 914 -13.845   5.163   5.123
  618   1HH1  ARG 914          2HH2      ARG 914 -12.095   8.021   6.251
  619   2HH1  ARG 914          1HH2      ARG 914 -13.122   8.268   7.646
  620   1HH2  ARG 914          2HH1      ARG 914 -15.200   5.489   6.966
  621   2HH2  ARG 914          1HH1      ARG 914 -14.892   6.823   8.054
  622    H    LYS 915           H        LYS 915  -8.778   7.099   0.875
  623    HA   LYS 915           HA       LYS 915 -10.530   9.472   0.747
  624   1HB   LYS 915          1HB       LYS 915  -7.538   9.045   1.022
  625   2HB   LYS 915          2HB       LYS 915  -8.259  10.650   0.750
  626   1HG   LYS 915          1HG       LYS 915  -9.190   8.815   2.985
  627   2HG   LYS 915          2HG       LYS 915  -7.851   9.967   3.201
  628   1HD   LYS 915          1HD       LYS 915  -9.264  11.844   2.765
  629   2HD   LYS 915          2HD       LYS 915 -10.562  10.812   2.120
  630   1HE   LYS 915          1HE       LYS 915 -11.426  11.016   4.219
  631   2HE   LYS 915          2HE       LYS 915 -10.258   9.734   4.609
  632   1HZ   LYS 915          1HZ       LYS 915  -8.692  11.521   5.152
  633   2HZ   LYS 915          2HZ       LYS 915  -9.905  12.623   4.967
  634   3HZ   LYS 915          3HZ       LYS 915 -10.009  11.471   6.143
  635    H    ARG 916           H        ARG 916  -9.474   7.170  -1.370
  636    HA   ARG 916           HA       ARG 916  -9.143   7.098  -3.635
  637   1HB   ARG 916          1HB       ARG 916 -11.319   8.783  -3.104
  638   2HB   ARG 916          2HB       ARG 916 -10.338   9.682  -4.287
  639   1HG   ARG 916          1HG       ARG 916 -10.820   6.742  -4.732
  640   2HG   ARG 916          2HG       ARG 916 -12.128   7.892  -5.098
  641   1HD   ARG 916          1HD       ARG 916  -9.280   8.103  -6.156
  642   2HD   ARG 916          2HD       ARG 916 -10.649   7.427  -7.066
  643    HE   ARG 916           HE       ARG 916 -10.156  10.260  -6.432
  644   1HH1  ARG 916          2HH2      ARG 916 -12.370   7.773  -7.620
  645   2HH1  ARG 916          1HH2      ARG 916 -13.399   8.902  -8.472
  646   1HH2  ARG 916          2HH1      ARG 916 -11.515  11.752  -7.558
  647   2HH2  ARG 916          1HH1      ARG 916 -12.912  11.171  -8.436
  648    H    ARG 917           H        ARG 917  -7.525   9.124  -1.691
  649    HA   ARG 917           HA       ARG 917  -5.696   9.918  -3.855
  650   1HB   ARG 917          1HB       ARG 917  -5.792  12.206  -3.494
  651   2HB   ARG 917          2HB       ARG 917  -7.500  11.766  -3.249
  652   1HG   ARG 917          1HG       ARG 917  -7.008  13.093  -1.360
  653   2HG   ARG 917          2HG       ARG 917  -6.819  11.431  -0.752
  654   1HD   ARG 917          1HD       ARG 917  -4.696  11.904  -0.186
  655   2HD   ARG 917          2HD       ARG 917  -4.323  12.182  -1.901
  656    HE   ARG 917           HE       ARG 917  -4.914  14.222   0.148
  657   1HH1  ARG 917          2HH2      ARG 917  -4.366  13.395  -3.246
  658   2HH1  ARG 917          1HH2      ARG 917  -3.983  15.033  -3.725
  659   1HH2  ARG 917          2HH1      ARG 917  -4.408  16.386  -0.486
  660   2HH2  ARG 917          1HH1      ARG 917  -4.007  16.739  -2.151
  661    H    LEU 918           H        LEU 918  -3.712   9.323  -3.230
  662    HA   LEU 918           HA       LEU 918  -3.007   8.160  -0.853
  663   1HB   LEU 918          1HB       LEU 918  -1.407   9.862  -2.785
  664   2HB   LEU 918          2HB       LEU 918  -0.651   9.048  -1.394
  665    HG   LEU 918           HG       LEU 918  -0.431   7.341  -2.921
  666   1HD1  LEU 918          1HD1      LEU 918  -1.955   6.484  -1.186
  667   2HD1  LEU 918          2HD1      LEU 918  -3.358   7.071  -2.111
  668   3HD1  LEU 918          3HD1      LEU 918  -2.346   5.760  -2.764
  669   1HD2  LEU 918          1HD2      LEU 918  -1.548   8.888  -4.678
  670   2HD2  LEU 918          2HD2      LEU 918  -1.664   7.131  -4.938
  671   3HD2  LEU 918          3HD2      LEU 918  -3.055   8.027  -4.281
  672    H    VAL 919           H        VAL 919  -3.040   8.803   1.210
  673    HA   VAL 919           HA       VAL 919  -3.082  11.697   1.789
  674    HB   VAL 919           HB       VAL 919  -4.266  11.139   3.654
  675   1HG1  VAL 919          1HG1      VAL 919  -5.804   9.494   3.131
  676   2HG1  VAL 919          2HG1      VAL 919  -5.015   9.658   1.545
  677   3HG1  VAL 919          3HG1      VAL 919  -4.551   8.331   2.636
  678   1HG2  VAL 919          1HG2      VAL 919  -3.624   8.586   4.550
  679   2HG2  VAL 919          2HG2      VAL 919  -2.072   9.192   3.925
  680   3HG2  VAL 919          3HG2      VAL 919  -2.944  10.105   5.180
  681    H    ALA 920           H        ALA 920  -2.045  11.617   4.407
  682    HA   ALA 920           HA       ALA 920   0.765  11.810   3.837
  683   1HB   ALA 920          1HB       ALA 920  -1.068  12.615   5.881
  684   2HB   ALA 920          2HB       ALA 920   0.248  11.701   6.657
  685   3HB   ALA 920          3HB       ALA 920   0.623  13.121   5.651
  686    HA   PRO 921           HA       PRO 921   1.495   7.444   4.502
  687   1HB   PRO 921          1HB       PRO 921   4.088   7.438   3.667
  688   2HB   PRO 921          2HB       PRO 921   2.726   7.640   2.518
  689   1HG   PRO 921          1HG       PRO 921   4.388   9.827   3.801
  690   2HG   PRO 921          2HG       PRO 921   4.042   9.606   2.055
  691   1HD   PRO 921          1HD       PRO 921   2.557  11.294   3.597
  692   2HD   PRO 921          2HD       PRO 921   1.772  10.273   2.354
  693    H    CYS 922           H        CYS 922   2.041   6.502   6.398
  694    HA   CYS 922           HA       CYS 922   4.364   7.273   7.911
  695   1HB   CYS 922          1HB       CYS 922   2.928   7.927   9.962
  696   2HB   CYS 922          2HB       CYS 922   3.139   9.149   8.684
  697    HG   CYS 922           HG       CYS 922   0.676   6.978   9.067
  Start of MODEL   16
    1    H    GLY 835           H        GLY 835 -15.992  -1.432  10.176
    2   1HA   GLY 835          1HA       GLY 835 -13.627  -0.691  11.705
    3   2HA   GLY 835          2HA       GLY 835 -13.467  -2.230  10.829
    4    H    SER 836           H        SER 836 -11.782  -1.194   9.543
    5    HA   SER 836           HA       SER 836 -12.812   0.820   7.614
    6   1HB   SER 836          1HB       SER 836  -9.988  -0.029   8.367
    7   2HB   SER 836          2HB       SER 836 -10.390   1.172   7.116
    8    HG   SER 836           HG       SER 836 -10.012   2.224   9.056
    9    H    ALA 837           H        ALA 837 -10.685  -2.099   7.714
   10    HA   ALA 837           HA       ALA 837 -10.587  -2.581   4.969
   11   1HB   ALA 837          1HB       ALA 837 -10.835  -4.844   6.949
   12   2HB   ALA 837          2HB       ALA 837  -9.759  -4.691   5.539
   13   3HB   ALA 837          3HB       ALA 837  -9.431  -3.751   7.015
   14    H    ASP 838           H        ASP 838 -13.016  -3.691   7.378
   15    HA   ASP 838           HA       ASP 838 -14.576  -5.143   5.453
   16   1HB   ASP 838          1HB       ASP 838 -16.037  -5.536   7.227
   17   2HB   ASP 838          2HB       ASP 838 -14.491  -5.279   8.065
   18    H    GLU 839           H        GLU 839 -14.051  -1.820   5.950
   19    HA   GLU 839           HA       GLU 839 -16.745  -1.000   5.115
   20   1HB   GLU 839          1HB       GLU 839 -14.339   0.248   6.270
   21   2HB   GLU 839          2HB       GLU 839 -15.117   1.233   5.008
   22   1HG   GLU 839          1HG       GLU 839 -16.961  -0.065   6.950
   23   2HG   GLU 839          2HG       GLU 839 -15.911   1.202   7.621
   24    H    THR 840           H        THR 840 -13.673  -1.829   3.714
   25    HA   THR 840           HA       THR 840 -14.672  -0.833   1.090
   26    HB   THR 840           HB       THR 840 -12.737   0.257   0.682
   27    HG1  THR 840           1HG      THR 840 -10.741  -0.884   1.750
   28   1HG2  THR 840          1HG2      THR 840 -12.308  -0.303   3.649
   29   2HG2  THR 840          2HG2      THR 840 -11.477   0.962   2.712
   30   3HG2  THR 840          3HG2      THR 840 -13.238   1.049   2.960
   31    H    LEU 841           H        LEU 841 -11.795  -2.742   2.062
   32    HA   LEU 841           HA       LEU 841 -11.726  -4.552   0.045
   33   1HB   LEU 841          1HB       LEU 841 -10.200  -4.406   2.060
   34   2HB   LEU 841          2HB       LEU 841 -11.412  -5.347   2.962
   35    HG   LEU 841           HG       LEU 841  -9.962  -6.211   0.424
   36   1HD1  LEU 841          1HD1      LEU 841  -8.431  -6.644   2.105
   37   2HD1  LEU 841          2HD1      LEU 841  -9.686  -6.775   3.360
   38   3HD1  LEU 841          3HD1      LEU 841  -9.419  -8.120   2.226
   39   1HD2  LEU 841          1HD2      LEU 841 -12.073  -7.204   0.206
   40   2HD2  LEU 841          2HD2      LEU 841 -11.183  -8.435   1.133
   41   3HD2  LEU 841          3HD2      LEU 841 -12.305  -7.332   1.966
   42    H    CYS 842           H        CYS 842 -14.249  -4.234   2.415
   43    HA   CYS 842           HA       CYS 842 -15.356  -6.760   2.592
   44   1HB   CYS 842          1HB       CYS 842 -17.597  -5.427   2.561
   45   2HB   CYS 842          2HB       CYS 842 -16.401  -5.045   3.824
   46    HG   CYS 842           HG       CYS 842 -17.657  -2.908   2.713
   47    H    GLN 843           H        GLN 843 -14.617  -5.122  -0.256
   48    HA   GLN 843           HA       GLN 843 -16.690  -6.647  -1.763
   49   1HB   GLN 843          1HB       GLN 843 -15.154  -4.378  -2.985
   50   2HB   GLN 843          2HB       GLN 843 -16.822  -4.919  -3.289
   51   1HG   GLN 843          1HG       GLN 843 -16.386  -4.025  -0.520
   52   2HG   GLN 843          2HG       GLN 843 -16.074  -2.749  -1.716
   53   1HE2  GLN 843          1HE2      GLN 843 -17.854  -1.462  -1.655
   54   2HE2  GLN 843          2HE2      GLN 843 -19.500  -2.024  -1.851
   55    H    THR 844           H        THR 844 -14.009  -7.532  -0.673
   56    HA   THR 844           HA       THR 844 -12.339  -8.917  -1.411
   57    HB   THR 844           HB       THR 844 -14.330  -8.973  -3.545
   58    HG1  THR 844           1HG      THR 844 -14.198 -10.888  -2.733
   59   1HG2  THR 844          1HG2      THR 844 -11.397  -8.966  -4.237
   60   2HG2  THR 844          2HG2      THR 844 -12.483 -10.084  -5.098
   61   3HG2  THR 844          3HG2      THR 844 -12.779  -8.330  -5.161
   62    H    LYS 845           H        LYS 845 -10.817  -7.243  -0.952
   63    HA   LYS 845           HA       LYS 845  -9.140  -5.768  -1.461
   64   1HB   LYS 845          1HB       LYS 845  -9.190  -6.801  -4.298
   65   2HB   LYS 845          2HB       LYS 845  -7.795  -6.350  -3.288
   66   1HG   LYS 845          1HG       LYS 845  -9.622  -8.670  -2.578
   67   2HG   LYS 845          2HG       LYS 845  -8.204  -8.871  -3.634
   68   1HD   LYS 845          1HD       LYS 845  -7.176  -9.274  -1.611
   69   2HD   LYS 845          2HD       LYS 845  -7.037  -7.500  -1.623
   70   1HE   LYS 845          1HE       LYS 845  -8.047  -7.696   0.421
   71   2HE   LYS 845          2HE       LYS 845  -9.522  -7.754  -0.569
   72   1HZ   LYS 845          1HZ       LYS 845  -8.019 -10.126   0.278
   73   2HZ   LYS 845          2HZ       LYS 845  -9.331  -9.529   1.079
   74   3HZ   LYS 845          3HZ       LYS 845  -9.492 -10.089  -0.464
   75    H    VAL 846           H        VAL 846 -12.110  -5.731  -3.162
   76    HA   VAL 846           HA       VAL 846 -13.028  -4.173  -4.652
   77    HB   VAL 846           HB       VAL 846 -13.735  -2.372  -3.372
   78   1HG1  VAL 846          1HG1      VAL 846 -13.353  -4.782  -2.051
   79   2HG1  VAL 846          2HG1      VAL 846 -12.619  -3.606  -0.935
   80   3HG1  VAL 846          3HG1      VAL 846 -14.315  -3.415  -1.440
   81   1HG2  VAL 846          1HG2      VAL 846 -11.751  -1.072  -3.229
   82   2HG2  VAL 846          2HG2      VAL 846 -12.178  -1.417  -1.535
   83   3HG2  VAL 846          3HG2      VAL 846 -10.884  -2.343  -2.333
   84    H    LEU 847           H        LEU 847  -9.948  -2.892  -3.283
   85    HA   LEU 847           HA       LEU 847  -8.153  -1.951  -4.372
   86   1HB   LEU 847          1HB       LEU 847  -9.649  -2.249  -6.993
   87   2HB   LEU 847          2HB       LEU 847  -7.891  -2.173  -6.722
   88    HG   LEU 847           HG       LEU 847  -8.496  -4.490  -7.133
   89   1HD1  LEU 847          1HD1      LEU 847  -6.972  -3.708  -5.092
   90   2HD1  LEU 847          2HD1      LEU 847  -8.278  -4.442  -4.132
   91   3HD1  LEU 847          3HD1      LEU 847  -7.385  -5.425  -5.318
   92   1HD2  LEU 847          1HD2      LEU 847 -10.933  -4.083  -6.414
   93   2HD2  LEU 847          2HD2      LEU 847 -10.217  -5.644  -5.944
   94   3HD2  LEU 847          3HD2      LEU 847 -10.368  -4.337  -4.745
   95    H    LEU 848           H        LEU 848  -9.361  -0.559  -7.115
   96    HA   LEU 848           HA       LEU 848 -10.618   1.431  -7.464
   97   1HB   LEU 848          1HB       LEU 848 -10.970   1.147  -4.710
   98   2HB   LEU 848          2HB       LEU 848 -10.099   2.691  -4.871
   99    HG   LEU 848           HG       LEU 848 -12.486   2.014  -6.619
  100   1HD1  LEU 848          1HD1      LEU 848 -13.532   1.914  -4.533
  101   2HD1  LEU 848          2HD1      LEU 848 -12.371   3.035  -3.783
  102   3HD1  LEU 848          3HD1      LEU 848 -13.625   3.657  -4.882
  103   1HD2  LEU 848          1HD2      LEU 848 -10.786   4.405  -5.980
  104   2HD2  LEU 848          2HD2      LEU 848 -11.477   3.885  -7.535
  105   3HD2  LEU 848          3HD2      LEU 848 -12.511   4.677  -6.322
  106    H    ASP 849           H        ASP 849  -9.847   3.620  -7.888
  107    HA   ASP 849           HA       ASP 849  -7.012   3.664  -8.356
  108   1HB   ASP 849          1HB       ASP 849  -9.037   5.928  -8.494
  109   2HB   ASP 849          2HB       ASP 849  -7.442   5.877  -9.276
  110    H    ILE 850           H        ILE 850  -6.813   3.158  -5.834
  111    HA   ILE 850           HA       ILE 850  -6.795   5.650  -4.259
  112    HB   ILE 850           HB       ILE 850  -5.716   3.155  -3.086
  113   1HG1  ILE 850          1HG1      ILE 850  -7.992   2.970  -4.787
  114   2HG1  ILE 850          2HG1      ILE 850  -7.389   1.750  -3.639
  115   1HG2  ILE 850          1HG2      ILE 850  -6.381   5.364  -1.943
  116   2HG2  ILE 850          2HG2      ILE 850  -8.069   4.881  -2.238
  117   3HG2  ILE 850          3HG2      ILE 850  -7.019   3.870  -1.216
  118   1HD1  ILE 850          1HD1      ILE 850  -9.647   3.676  -3.370
  119   2HD1  ILE 850          2HD1      ILE 850  -9.440   2.054  -2.666
  120   3HD1  ILE 850          3HD1      ILE 850  -8.639   3.457  -1.919
  121    H    PHE 851           H        PHE 851  -4.413   3.156  -3.672
  122    HA   PHE 851           HA       PHE 851  -2.241   4.872  -3.478
  123   1HB   PHE 851          1HB       PHE 851  -2.088   2.031  -4.520
  124   2HB   PHE 851          2HB       PHE 851  -0.869   2.914  -3.585
  125    HD1  PHE 851           1HD      PHE 851  -4.014   1.026  -3.449
  126    HD2  PHE 851           2HD      PHE 851  -1.153   3.282  -1.174
  127    HE1  PHE 851           1HE      PHE 851  -4.973   0.122  -1.348
  128    HE2  PHE 851           2HE      PHE 851  -2.112   2.378   0.928
  129    HZ   PHE 851           HZ       PHE 851  -4.022   0.798   0.840
  130    H    THR 852           H        THR 852  -4.034   5.003  -6.056
  131    HA   THR 852           HA       THR 852  -2.982   4.438  -8.409
  132    HB   THR 852           HB       THR 852  -4.580   6.465  -7.513
  133    HG1  THR 852           1HG      THR 852  -4.993   5.817  -9.489
  134   1HG2  THR 852          1HG2      THR 852  -3.563   8.563  -8.476
  135   2HG2  THR 852          2HG2      THR 852  -2.733   7.969  -7.018
  136   3HG2  THR 852          3HG2      THR 852  -2.020   7.689  -8.625
  137    H    GLY 853           H        GLY 853  -0.925   4.034  -8.987
  138   1HA   GLY 853          1HA       GLY 853   1.346   4.294  -9.235
  139   2HA   GLY 853          2HA       GLY 853   0.979   6.024  -9.415
  140    H    VAL 854           H        VAL 854   1.144   3.542  -6.793
  141    HA   VAL 854           HA       VAL 854   2.641   5.551  -5.176
  142    HB   VAL 854           HB       VAL 854   0.347   3.727  -4.455
  143   1HG1  VAL 854          1HG1      VAL 854   1.012   4.298  -2.027
  144   2HG1  VAL 854          2HG1      VAL 854   1.962   3.035  -2.845
  145   3HG1  VAL 854          3HG1      VAL 854   2.622   4.680  -2.683
  146   1HG2  VAL 854          1HG2      VAL 854   0.652   6.282  -3.071
  147   2HG2  VAL 854          2HG2      VAL 854   0.706   6.492  -4.838
  148   3HG2  VAL 854          3HG2      VAL 854  -0.694   5.697  -4.079
  149    H    ARG 855           H        ARG 855   4.688   4.891  -4.932
  150    HA   ARG 855           HA       ARG 855   5.405   2.098  -5.334
  151   1HB   ARG 855          1HB       ARG 855   6.905   4.655  -4.719
  152   2HB   ARG 855          2HB       ARG 855   7.715   3.071  -4.688
  153   1HG   ARG 855          1HG       ARG 855   6.204   4.293  -7.037
  154   2HG   ARG 855          2HG       ARG 855   7.965   4.066  -6.911
  155   1HD   ARG 855          1HD       ARG 855   7.812   1.913  -7.562
  156   2HD   ARG 855          2HD       ARG 855   6.541   1.581  -6.365
  157    HE   ARG 855           HE       ARG 855   5.100   2.865  -8.218
  158   1HH1  ARG 855          2HH2      ARG 855   7.613   0.403  -8.568
  159   2HH1  ARG 855          1HH2      ARG 855   6.945  -0.266 -10.040
  160   1HH2  ARG 855          2HH1      ARG 855   4.217   1.981 -10.163
  161   2HH2  ARG 855          1HH1      ARG 855   5.009   0.634 -10.949
  162    H    LEU 856           H        LEU 856   3.649   1.986  -3.313
  163    HA   LEU 856           HA       LEU 856   4.958   2.268  -0.728
  164   1HB   LEU 856          1HB       LEU 856   2.575   2.624  -0.856
  165   2HB   LEU 856          2HB       LEU 856   2.327   1.043  -1.636
  166    HG   LEU 856           HG       LEU 856   2.098   1.487   1.065
  167   1HD1  LEU 856          1HD1      LEU 856   3.150  -1.186   0.556
  168   2HD1  LEU 856          2HD1      LEU 856   1.487  -0.683   0.943
  169   3HD1  LEU 856          3HD1      LEU 856   2.049  -0.674  -0.746
  170   1HD2  LEU 856          1HD2      LEU 856   4.731   1.837   0.838
  171   2HD2  LEU 856          2HD2      LEU 856   4.042   0.958   2.223
  172   3HD2  LEU 856          3HD2      LEU 856   4.738   0.058   0.855
  173    H    TYR 857           H        TYR 857   6.410   0.862   0.042
  174    HA   TYR 857           HA       TYR 857   6.708  -1.761  -1.198
  175   1HB   TYR 857          1HB       TYR 857   8.791  -1.073  -0.660
  176   2HB   TYR 857          2HB       TYR 857   8.214   0.013   0.615
  177    HD1  TYR 857           1HD      TYR 857   9.630  -0.492   2.422
  178    HD2  TYR 857           2HD      TYR 857   7.662  -3.672   0.308
  179    HE1  TYR 857           1HE      TYR 857  10.390  -2.107   4.144
  180    HE2  TYR 857           2HE      TYR 857   8.421  -5.287   2.030
  181    HH   TYR 857           HH       TYR 857  10.257  -4.264   4.915
  182    H    LEU 858           H        LEU 858   5.235  -3.287  -0.680
  183    HA   LEU 858           HA       LEU 858   3.994  -3.331   1.959
  184   1HB   LEU 858          1HB       LEU 858   2.989  -3.960  -0.383
  185   2HB   LEU 858          2HB       LEU 858   3.778  -5.529  -0.095
  186    HG   LEU 858           HG       LEU 858   1.838  -6.013   1.011
  187   1HD1  LEU 858          1HD1      LEU 858   2.681  -4.141   3.213
  188   2HD1  LEU 858          2HD1      LEU 858   2.143  -5.835   3.310
  189   3HD1  LEU 858          3HD1      LEU 858   3.785  -5.454   2.737
  190   1HD2  LEU 858          1HD2      LEU 858   1.144  -3.510   0.261
  191   2HD2  LEU 858          2HD2      LEU 858   0.149  -4.490   1.364
  192   3HD2  LEU 858          3HD2      LEU 858   1.255  -3.258   2.019
  193    HA   PRO 859           HA       PRO 859   7.393  -5.839   3.478
  194   1HB   PRO 859          1HB       PRO 859   6.738  -5.655   6.116
  195   2HB   PRO 859          2HB       PRO 859   7.421  -4.264   5.213
  196   1HG   PRO 859          1HG       PRO 859   4.495  -4.848   5.750
  197   2HG   PRO 859          2HG       PRO 859   5.377  -3.321   6.075
  198   1HD   PRO 859          1HD       PRO 859   3.934  -3.669   3.789
  199   2HD   PRO 859          2HD       PRO 859   5.512  -2.825   3.746
  200    HA   PRO 860           HA       PRO 860   5.184  -9.666   3.644
  201   1HB   PRO 860          1HB       PRO 860   7.192 -11.307   4.480
  202   2HB   PRO 860          2HB       PRO 860   7.228 -10.513   2.872
  203   1HG   PRO 860          1HG       PRO 860   8.554  -9.555   5.424
  204   2HG   PRO 860          2HG       PRO 860   9.320  -9.778   3.817
  205   1HD   PRO 860          1HD       PRO 860   8.408  -7.342   4.631
  206   2HD   PRO 860          2HD       PRO 860   8.182  -7.876   2.938
  207    H    SER 861           H        SER 861   6.616  -8.020   6.345
  208    HA   SER 861           HA       SER 861   5.613  -9.940   8.324
  209   1HB   SER 861          1HB       SER 861   7.548  -7.802   8.224
  210   2HB   SER 861          2HB       SER 861   6.383  -7.484   9.532
  211    HG   SER 861           HG       SER 861   7.533 -10.034   9.147
  212    H    THR 862           H        THR 862   4.394  -7.349   6.466
  213    HA   THR 862           HA       THR 862   2.594  -6.236   8.427
  214    HB   THR 862           HB       THR 862   3.256  -5.889   5.593
  215    HG1  THR 862           1HG      THR 862   2.646  -3.768   6.188
  216   1HG2  THR 862          1HG2      THR 862   0.385  -5.314   6.394
  217   2HG2  THR 862          2HG2      THR 862   1.115  -5.249   4.772
  218   3HG2  THR 862          3HG2      THR 862   0.845  -6.820   5.564
  219    HA   PRO 863           HA       PRO 863  -0.500  -9.367   8.376
  220   1HB   PRO 863          1HB       PRO 863  -2.595  -7.959   9.402
  221   2HB   PRO 863          2HB       PRO 863  -1.134  -8.326  10.376
  222   1HG   PRO 863          1HG       PRO 863  -1.723  -5.784   8.832
  223   2HG   PRO 863          2HG       PRO 863  -1.240  -5.924  10.554
  224   1HD   PRO 863          1HD       PRO 863   0.593  -5.427   8.599
  225   2HD   PRO 863          2HD       PRO 863   0.984  -6.536   9.949
  226    H    ASP 864           H        ASP 864  -2.234 -10.056   7.082
  227    HA   ASP 864           HA       ASP 864  -3.586 -10.101   5.237
  228   1HB   ASP 864          1HB       ASP 864  -3.910  -7.414   6.386
  229   2HB   ASP 864          2HB       ASP 864  -4.257  -7.476   4.644
  230    H    PHE 865           H        PHE 865  -0.556  -9.352   5.184
  231    HA   PHE 865           HA       PHE 865   0.165  -7.689   3.142
  232   1HB   PHE 865          1HB       PHE 865   1.688  -9.107   4.492
  233   2HB   PHE 865          2HB       PHE 865   1.169 -10.524   3.563
  234    HD1  PHE 865           1HD      PHE 865   1.198  -7.746   1.400
  235    HD2  PHE 865           2HD      PHE 865   3.827 -10.521   3.360
  236    HE1  PHE 865           1HE      PHE 865   2.949  -7.282  -0.293
  237    HE2  PHE 865           2HE      PHE 865   5.579 -10.057   1.666
  238    HZ   PHE 865           HZ       PHE 865   5.140  -8.437  -0.160
  239    H    SER 866           H        SER 866  -0.962 -11.091   2.737
  240    HA   SER 866           HA       SER 866  -0.826 -11.649   0.162
  241   1HB   SER 866          1HB       SER 866  -2.890 -12.024   2.186
  242   2HB   SER 866          2HB       SER 866  -3.592 -11.937   0.553
  243    HG   SER 866           HG       SER 866  -2.970 -14.040   0.944
  244    H    ARG 867           H        ARG 867  -3.887  -9.975   0.950
  245    HA   ARG 867           HA       ARG 867  -4.169  -8.891  -1.654
  246   1HB   ARG 867          1HB       ARG 867  -5.829  -7.341  -0.372
  247   2HB   ARG 867          2HB       ARG 867  -6.145  -9.092  -0.402
  248   1HG   ARG 867          1HG       ARG 867  -4.398  -8.634   1.792
  249   2HG   ARG 867          2HG       ARG 867  -5.647  -7.370   1.876
  250   1HD   ARG 867          1HD       ARG 867  -6.276  -9.484   3.081
  251   2HD   ARG 867          2HD       ARG 867  -7.416  -9.030   1.795
  252    HE   ARG 867           HE       ARG 867  -5.832 -10.696   0.429
  253   1HH1  ARG 867          2HH2      ARG 867  -7.149 -10.958   3.700
  254   2HH1  ARG 867          1HH2      ARG 867  -7.213 -12.706   3.681
  255   1HH2  ARG 867          2HH1      ARG 867  -5.917 -13.005   0.405
  256   2HH2  ARG 867          1HH1      ARG 867  -6.511 -13.873   1.803
  257    H    LEU 868           H        LEU 868  -2.992  -7.446   1.423
  258    HA   LEU 868           HA       LEU 868  -2.654  -4.838   0.863
  259   1HB   LEU 868          1HB       LEU 868  -0.816  -6.846   2.151
  260   2HB   LEU 868          2HB       LEU 868  -0.269  -5.166   1.941
  261    HG   LEU 868           HG       LEU 868  -2.041  -6.224   3.937
  262   1HD1  LEU 868          1HD1      LEU 868  -0.766  -3.611   3.183
  263   2HD1  LEU 868          2HD1      LEU 868  -2.063  -3.586   4.401
  264   3HD1  LEU 868          3HD1      LEU 868  -0.603  -4.566   4.676
  265   1HD2  LEU 868          1HD2      LEU 868  -4.040  -4.964   3.638
  266   2HD2  LEU 868          2HD2      LEU 868  -3.335  -4.009   2.313
  267   3HD2  LEU 868          3HD2      LEU 868  -3.739  -5.723   2.057
  268    H    ARG 869           H        ARG 869  -0.509  -7.439  -0.397
  269    HA   ARG 869           HA       ARG 869   1.036  -5.577  -1.992
  270   1HB   ARG 869          1HB       ARG 869   1.536  -8.033  -0.993
  271   2HB   ARG 869          2HB       ARG 869   0.992  -8.495  -2.624
  272   1HG   ARG 869          1HG       ARG 869   2.602  -6.651  -3.475
  273   2HG   ARG 869          2HG       ARG 869   3.307  -6.697  -1.841
  274   1HD   ARG 869          1HD       ARG 869   2.964  -9.399  -2.754
  275   2HD   ARG 869          2HD       ARG 869   3.782  -8.480  -4.036
  276    HE   ARG 869           HE       ARG 869   4.989  -9.410  -1.672
  277   1HH1  ARG 869          2HH2      ARG 869   4.642  -6.391  -3.480
  278   2HH1  ARG 869          1HH2      ARG 869   6.177  -5.740  -2.953
  279   1HH2  ARG 869          2HH1      ARG 869   7.017  -8.549  -0.976
  280   2HH2  ARG 869          1HH1      ARG 869   7.532  -6.970  -1.525
  281    H    ARG 870           H        ARG 870  -0.631  -8.507  -3.206
  282    HA   ARG 870           HA       ARG 870  -0.977  -7.831  -5.800
  283   1HB   ARG 870          1HB       ARG 870  -2.044  -9.733  -4.090
  284   2HB   ARG 870          2HB       ARG 870  -3.488  -8.861  -4.659
  285   1HG   ARG 870          1HG       ARG 870  -3.120 -10.582  -6.271
  286   2HG   ARG 870          2HG       ARG 870  -2.501  -9.094  -7.025
  287   1HD   ARG 870          1HD       ARG 870  -0.811 -10.728  -7.398
  288   2HD   ARG 870          2HD       ARG 870  -0.213  -9.736  -6.051
  289    HE   ARG 870           HE       ARG 870  -1.581 -11.803  -4.823
  290   1HH1  ARG 870          2HH2      ARG 870   1.048 -11.535  -7.172
  291   2HH1  ARG 870          1HH2      ARG 870   1.830 -13.018  -6.672
  292   1HH2  ARG 870          2HH1      ARG 870  -0.548 -13.762  -4.162
  293   2HH2  ARG 870          1HH1      ARG 870   0.920 -14.287  -4.956
  294    H    TYR 871           H        TYR 871  -3.425  -7.005  -3.270
  295    HA   TYR 871           HA       TYR 871  -5.128  -5.468  -4.808
  296   1HB   TYR 871          1HB       TYR 871  -5.170  -6.121  -2.295
  297   2HB   TYR 871          2HB       TYR 871  -4.283  -4.608  -2.041
  298    HD1  TYR 871           1HD      TYR 871  -5.986  -3.573  -4.694
  299    HD2  TYR 871           2HD      TYR 871  -6.860  -4.984  -0.732
  300    HE1  TYR 871           1HE      TYR 871  -8.124  -2.316  -4.718
  301    HE2  TYR 871           2HE      TYR 871  -8.998  -3.728  -0.756
  302    HH   TYR 871           HH       TYR 871 -10.323  -2.256  -1.903
  303    H    PHE 872           H        PHE 872  -2.417  -4.123  -2.829
  304    HA   PHE 872           HA       PHE 872  -2.495  -1.515  -3.717
  305   1HB   PHE 872          1HB       PHE 872  -0.942  -2.718  -2.025
  306   2HB   PHE 872          2HB       PHE 872   0.112  -3.008  -3.420
  307    HD1  PHE 872           1HD      PHE 872  -0.323  -0.928  -0.712
  308    HD2  PHE 872           2HD      PHE 872   0.326  -0.714  -4.952
  309    HE1  PHE 872           1HE      PHE 872   0.645   1.340  -0.449
  310    HE2  PHE 872           2HE      PHE 872   1.294   1.554  -4.690
  311    HZ   PHE 872           HZ       PHE 872   1.454   2.581  -2.438
  312    H    VAL 873           H        VAL 873   0.276  -3.339  -4.951
  313    HA   VAL 873           HA       VAL 873   0.779  -2.037  -7.236
  314    HB   VAL 873           HB       VAL 873   2.135  -3.906  -6.729
  315   1HG1  VAL 873          1HG1      VAL 873   1.327  -5.848  -5.891
  316   2HG1  VAL 873          2HG1      VAL 873  -0.272  -5.066  -5.900
  317   3HG1  VAL 873          3HG1      VAL 873   0.234  -6.074  -7.277
  318   1HG2  VAL 873          1HG2      VAL 873   1.627  -3.506  -9.199
  319   2HG2  VAL 873          2HG2      VAL 873   2.216  -5.137  -8.795
  320   3HG2  VAL 873          3HG2      VAL 873   0.483  -4.866  -9.097
  321    H    ALA 874           H        ALA 874  -1.991  -4.200  -6.712
  322    HA   ALA 874           HA       ALA 874  -2.849  -4.430  -9.395
  323   1HB   ALA 874          1HB       ALA 874  -5.177  -4.565  -8.099
  324   2HB   ALA 874          2HB       ALA 874  -3.970  -5.867  -7.976
  325   3HB   ALA 874          3HB       ALA 874  -4.106  -4.655  -6.680
  326    H    PHE 875           H        PHE 875  -4.371  -2.333  -6.883
  327    HA   PHE 875           HA       PHE 875  -6.011  -0.752  -8.194
  328   1HB   PHE 875          1HB       PHE 875  -3.707   0.362  -6.560
  329   2HB   PHE 875          2HB       PHE 875  -5.238   1.188  -6.894
  330    HD1  PHE 875           1HD      PHE 875  -7.352   0.366  -5.885
  331    HD2  PHE 875           2HD      PHE 875  -3.540  -1.331  -4.868
  332    HE1  PHE 875           1HE      PHE 875  -8.352  -0.669  -3.865
  333    HE2  PHE 875           2HE      PHE 875  -4.539  -2.366  -2.848
  334    HZ   PHE 875           HZ       PHE 875  -6.945  -2.035  -2.346
  335    H    ASP 876           H        ASP 876  -2.449  -0.457  -8.563
  336    HA   ASP 876           HA       ASP 876  -2.036  -0.110 -11.124
  337   1HB   ASP 876          1HB       ASP 876  -3.792   2.137 -10.236
  338   2HB   ASP 876          2HB       ASP 876  -2.474   2.536 -11.360
  339    H    GLY 877           H        GLY 877  -1.250   0.399  -8.017
  340   1HA   GLY 877          1HA       GLY 877   0.797   2.458  -8.358
  341   2HA   GLY 877          2HA       GLY 877   0.476   1.489  -6.901
  342    H    ASP 878           H        ASP 878   2.533   0.746  -6.462
  343    HA   ASP 878           HA       ASP 878   3.518  -1.383  -8.193
  344   1HB   ASP 878          1HB       ASP 878   5.265   1.046  -7.656
  345   2HB   ASP 878          2HB       ASP 878   5.714  -0.414  -8.565
  346    H    LEU 879           H        LEU 879   4.747  -2.861  -7.049
  347    HA   LEU 879           HA       LEU 879   5.241  -2.165  -4.191
  348   1HB   LEU 879          1HB       LEU 879   4.388  -4.807  -5.438
  349   2HB   LEU 879          2HB       LEU 879   4.832  -4.582  -3.729
  350    HG   LEU 879           HG       LEU 879   2.284  -4.195  -4.898
  351   1HD1  LEU 879          1HD1      LEU 879   1.650  -3.605  -2.629
  352   2HD1  LEU 879          2HD1      LEU 879   2.918  -4.851  -2.543
  353   3HD1  LEU 879          3HD1      LEU 879   3.324  -3.145  -2.234
  354   1HD2  LEU 879          1HD2      LEU 879   2.995  -2.010  -5.731
  355   2HD2  LEU 879          2HD2      LEU 879   1.888  -1.778  -4.357
  356   3HD2  LEU 879          3HD2      LEU 879   3.642  -1.576  -4.131
  357    H    VAL 880           H        VAL 880   7.338  -2.143  -3.664
  358    HA   VAL 880           HA       VAL 880   9.208  -3.705  -5.378
  359    HB   VAL 880           HB       VAL 880  10.417  -1.701  -3.629
  360   1HG1  VAL 880          1HG1      VAL 880  10.389  -1.436  -6.599
  361   2HG1  VAL 880          2HG1      VAL 880  11.761  -1.423  -5.465
  362   3HG1  VAL 880          3HG1      VAL 880  11.027  -2.969  -5.958
  363   1HG2  VAL 880          1HG2      VAL 880   8.000  -0.991  -5.238
  364   2HG2  VAL 880          2HG2      VAL 880   8.678  -0.206  -3.791
  365   3HG2  VAL 880          3HG2      VAL 880   9.403   0.094  -5.389
  366    H    GLN 881           H        GLN 881  10.503  -5.230  -4.457
  367    HA   GLN 881           HA       GLN 881   9.832  -6.230  -1.873
  368   1HB   GLN 881          1HB       GLN 881  12.380  -6.775  -3.433
  369   2HB   GLN 881          2HB       GLN 881  11.550  -7.846  -2.278
  370   1HG   GLN 881          1HG       GLN 881  10.094  -8.583  -3.847
  371   2HG   GLN 881          2HG       GLN 881   9.800  -6.941  -4.461
  372   1HE2  GLN 881          1HE2      GLN 881  11.789  -9.853  -4.733
  373   2HE2  GLN 881          2HE2      GLN 881  12.552  -9.435  -6.253
  374    H    GLU 882           H        GLU 882  10.622  -5.793   0.120
  375    HA   GLU 882           HA       GLU 882  11.740  -3.575   1.012
  376   1HB   GLU 882          1HB       GLU 882  11.276  -5.526   2.442
  377   2HB   GLU 882          2HB       GLU 882  12.731  -6.339   1.817
  378   1HG   GLU 882          1HG       GLU 882  13.842  -3.998   2.573
  379   2HG   GLU 882          2HG       GLU 882  12.484  -4.042   3.718
  380    H    PHE 883           H        PHE 883  14.015  -6.273   0.254
  381    HA   PHE 883           HA       PHE 883  16.265  -4.517   0.078
  382   1HB   PHE 883          1HB       PHE 883  17.462  -6.463  -0.648
  383   2HB   PHE 883          2HB       PHE 883  16.315  -6.965   0.605
  384    HD1  PHE 883           1HD      PHE 883  17.212  -7.181  -2.949
  385    HD2  PHE 883           2HD      PHE 883  14.342  -8.311   0.040
  386    HE1  PHE 883           1HE      PHE 883  16.277  -8.884  -4.491
  387    HE2  PHE 883           2HE      PHE 883  13.407 -10.014  -1.501
  388    HZ   PHE 883           HZ       PHE 883  14.374 -10.300  -3.767
  389    H    ASP 884           H        ASP 884  13.683  -4.287  -1.765
  390    HA   ASP 884           HA       ASP 884  15.268  -3.552  -4.157
  391   1HB   ASP 884          1HB       ASP 884  12.759  -5.269  -4.143
  392   2HB   ASP 884          2HB       ASP 884  13.477  -4.540  -5.596
  393    H    MET 885           H        MET 885  15.015  -1.366  -3.562
  394    HA   MET 885           HA       MET 885  12.313  -0.318  -4.130
  395   1HB   MET 885          1HB       MET 885  13.039   1.318  -2.076
  396   2HB   MET 885          2HB       MET 885  11.984  -0.102  -1.886
  397   1HG   MET 885          1HG       MET 885  14.161  -1.445  -1.569
  398   2HG   MET 885          2HG       MET 885  14.957   0.124  -1.360
  399   1HE   MET 885          1HE       MET 885  12.314  -2.240  -0.454
  400   2HE   MET 885          2HE       MET 885  12.269  -2.268   1.325
  401   3HE   MET 885          3HE       MET 885  11.252  -1.116   0.427
  402    H    THR 886           H        THR 886  15.805   0.169  -3.634
  403    HA   THR 886           HA       THR 886  16.587   2.572  -4.077
  404    HB   THR 886           HB       THR 886  18.216   1.897  -5.651
  405    HG1  THR 886           1HG      THR 886  17.797   0.143  -7.069
  406   1HG2  THR 886          1HG2      THR 886  18.018   0.498  -3.509
  407   2HG2  THR 886          2HG2      THR 886  17.249  -0.752  -4.515
  408   3HG2  THR 886          3HG2      THR 886  18.923  -0.246  -4.849
  409    H    SER 887           H        SER 887  14.870   0.908  -6.782
  410    HA   SER 887           HA       SER 887  14.423   3.526  -8.060
  411   1HB   SER 887          1HB       SER 887  14.458   0.686  -8.869
  412   2HB   SER 887          2HB       SER 887  13.143   1.635  -9.602
  413    HG   SER 887           HG       SER 887  14.912   1.906 -10.885
  414    H    ALA 888           H        ALA 888  12.908   1.432  -5.826
  415    HA   ALA 888           HA       ALA 888  10.195   1.591  -6.511
  416   1HB   ALA 888          1HB       ALA 888  10.910   0.179  -4.707
  417   2HB   ALA 888          2HB       ALA 888  11.616   1.556  -3.825
  418   3HB   ALA 888          3HB       ALA 888   9.849   1.421  -3.998
  419    H    THR 889           H        THR 889   9.226   2.933  -4.029
  420    HA   THR 889           HA       THR 889   9.974   5.711  -4.189
  421    HB   THR 889           HB       THR 889   8.435   5.017  -6.296
  422    HG1  THR 889           1HG      THR 889   7.906   7.188  -6.343
  423   1HG2  THR 889          1HG2      THR 889   6.412   5.968  -4.241
  424   2HG2  THR 889          2HG2      THR 889   6.112   5.330  -5.875
  425   3HG2  THR 889          3HG2      THR 889   6.665   4.239  -4.582
  426    H    HIS 890           H        HIS 890   7.528   3.242  -3.347
  427    HA   HIS 890           HA       HIS 890   7.032   4.761  -0.828
  428   1HB   HIS 890          1HB       HIS 890   5.256   3.120  -2.621
  429   2HB   HIS 890          2HB       HIS 890   4.885   3.255  -0.893
  430    HD1  HIS 890           1HD      HIS 890   4.899   5.343  -4.090
  431    HD2  HIS 890           2HD      HIS 890   4.113   5.679   0.031
  432    HE1  HIS 890           1HE      HIS 890   3.694   7.572  -3.751
  433    H    VAL 891           H        VAL 891   6.925   3.575   1.123
  434    HA   VAL 891           HA       VAL 891   7.620   0.712   1.011
  435    HB   VAL 891           HB       VAL 891   9.484   1.113   2.661
  436   1HG1  VAL 891          1HG1      VAL 891   9.545   2.137  -0.185
  437   2HG1  VAL 891          2HG1      VAL 891  11.011   2.196   0.823
  438   3HG1  VAL 891          3HG1      VAL 891  10.227   0.634   0.481
  439   1HG2  VAL 891          1HG2      VAL 891   8.740   3.382   3.364
  440   2HG2  VAL 891          2HG2      VAL 891  10.425   3.386   2.788
  441   3HG2  VAL 891          3HG2      VAL 891   9.124   3.997   1.738
  442    H    LEU 892           H        LEU 892   6.342  -0.326   2.418
  443    HA   LEU 892           HA       LEU 892   4.737   1.164   4.309
  444   1HB   LEU 892          1HB       LEU 892   4.509  -1.242   2.960
  445   2HB   LEU 892          2HB       LEU 892   4.860  -1.761   4.627
  446    HG   LEU 892           HG       LEU 892   3.003   0.430   4.736
  447   1HD1  LEU 892          1HD1      LEU 892   2.685  -1.274   2.402
  448   2HD1  LEU 892          2HD1      LEU 892   1.308  -1.479   3.511
  449   3HD1  LEU 892          3HD1      LEU 892   1.725   0.140   2.900
  450   1HD2  LEU 892          1HD2      LEU 892   2.675  -2.560   5.238
  451   2HD2  LEU 892          2HD2      LEU 892   3.293  -1.372   6.411
  452   3HD2  LEU 892          3HD2      LEU 892   1.605  -1.278   5.854
  453    H    GLY 893           H        GLY 893   5.284   1.724   6.330
  454   1HA   GLY 893          1HA       GLY 893   6.550   1.889   8.248
  455   2HA   GLY 893          2HA       GLY 893   6.422   0.116   8.271
  456    H    SER 894           H        SER 894   8.565   2.705   8.203
  457    HA   SER 894           HA       SER 894  10.883   2.601   8.254
  458   1HB   SER 894          1HB       SER 894  10.563  -0.171   7.040
  459   2HB   SER 894          2HB       SER 894  12.069   0.536   7.671
  460    HG   SER 894           HG       SER 894  10.062   0.733   9.469
  461    H    ARG 895           H        ARG 895  12.692   2.641   6.595
  462    HA   ARG 895           HA       ARG 895  11.719   2.799   3.811
  463   1HB   ARG 895          1HB       ARG 895  12.815   5.066   3.602
  464   2HB   ARG 895          2HB       ARG 895  11.337   5.048   4.593
  465   1HG   ARG 895          1HG       ARG 895  12.564   5.164   6.625
  466   2HG   ARG 895          2HG       ARG 895  14.087   4.701   5.828
  467   1HD   ARG 895          1HD       ARG 895  13.204   6.996   4.452
  468   2HD   ARG 895          2HD       ARG 895  12.901   7.344   6.168
  469    HE   ARG 895           HE       ARG 895  15.518   6.209   5.797
  470   1HH1  ARG 895          2HH2      ARG 895  13.618   9.163   5.387
  471   2HH1  ARG 895          1HH2      ARG 895  14.994  10.232   5.539
  472   1HH2  ARG 895          2HH1      ARG 895  17.336   7.623   5.998
  473   2HH2  ARG 895          1HH1      ARG 895  17.113   9.354   5.887
  474    H    ASP 896           H        ASP 896  14.332   2.796   6.215
  475    HA   ASP 896           HA       ASP 896  16.688   2.920   5.227
  476   1HB   ASP 896          1HB       ASP 896  16.495   1.556   7.143
  477   2HB   ASP 896          2HB       ASP 896  15.464   0.374   6.309
  478    H    LYS 897           H        LYS 897  15.168  -0.202   4.289
  479    HA   LYS 897           HA       LYS 897  16.690  -0.950   2.212
  480   1HB   LYS 897          1HB       LYS 897  14.048  -1.202   1.198
  481   2HB   LYS 897          2HB       LYS 897  14.997  -2.418   2.088
  482   1HG   LYS 897          1HG       LYS 897  13.076  -2.179   3.427
  483   2HG   LYS 897          2HG       LYS 897  14.240  -1.088   4.215
  484   1HD   LYS 897          1HD       LYS 897  13.267   0.746   2.650
  485   2HD   LYS 897          2HD       LYS 897  11.919  -0.388   2.396
  486   1HE   LYS 897          1HE       LYS 897  12.106  -0.504   5.097
  487   2HE   LYS 897          2HE       LYS 897  12.695   1.152   4.833
  488   1HZ   LYS 897          1HZ       LYS 897  10.721   1.747   3.860
  489   2HZ   LYS 897          2HZ       LYS 897  10.237   0.194   3.583
  490   3HZ   LYS 897          3HZ       LYS 897  10.238   0.797   5.119
  491    H    ASN 898           H        ASN 898  14.465   1.815   2.199
  492    HA   ASN 898           HA       ASN 898  15.838   2.932  -0.101
  493   1HB   ASN 898          1HB       ASN 898  13.740   1.217  -0.682
  494   2HB   ASN 898          2HB       ASN 898  12.957   2.812  -0.672
  495   1HD2  ASN 898          1HD2      ASN 898  12.640   2.971  -2.903
  496   2HD2  ASN 898          2HD2      ASN 898  13.963   3.131  -4.039
  497    HA   PRO 899           HA       PRO 899  14.315   6.084   2.785
  498   1HB   PRO 899          1HB       PRO 899  16.372   7.829   2.403
  499   2HB   PRO 899          2HB       PRO 899  16.568   6.335   3.376
  500   1HG   PRO 899          1HG       PRO 899  17.260   6.727   0.451
  501   2HG   PRO 899          2HG       PRO 899  18.322   6.079   1.743
  502   1HD   PRO 899          1HD       PRO 899  16.917   4.424   0.095
  503   2HD   PRO 899          2HD       PRO 899  17.079   4.046   1.837
  504    H    ALA 900           H        ALA 900  14.801   5.851  -0.601
  505    HA   ALA 900           HA       ALA 900  13.874   8.588  -1.158
  506   1HB   ALA 900          1HB       ALA 900  14.239   6.393  -3.201
  507   2HB   ALA 900          2HB       ALA 900  14.456   8.150  -3.385
  508   3HB   ALA 900          3HB       ALA 900  15.653   7.196  -2.477
  509    H    ALA 901           H        ALA 901  12.490   5.678  -0.245
  510    HA   ALA 901           HA       ALA 901  10.134   5.904  -1.992
  511   1HB   ALA 901          1HB       ALA 901   9.420   3.853  -0.915
  512   2HB   ALA 901          2HB       ALA 901  11.140   3.692  -1.346
  513   3HB   ALA 901          3HB       ALA 901  10.672   4.025   0.339
  514    H    GLN 902           H        GLN 902   8.237   5.009   0.005
  515    HA   GLN 902           HA       GLN 902   8.025   7.493   1.644
  516   1HB   GLN 902          1HB       GLN 902   6.159   6.189  -0.251
  517   2HB   GLN 902          2HB       GLN 902   5.439   6.637   1.314
  518   1HG   GLN 902          1HG       GLN 902   6.889   8.436  -0.661
  519   2HG   GLN 902          2HG       GLN 902   5.199   8.546  -0.122
  520   1HE2  GLN 902          1HE2      GLN 902   5.954   7.888   2.706
  521   2HE2  GLN 902          2HE2      GLN 902   6.657   9.356   3.352
  522    H    GLN 903           H        GLN 903   7.678   7.222   3.790
  523    HA   GLN 903           HA       GLN 903   7.623   4.456   4.791
  524   1HB   GLN 903          1HB       GLN 903   8.185   7.187   5.933
  525   2HB   GLN 903          2HB       GLN 903   7.750   5.851   7.027
  526   1HG   GLN 903          1HG       GLN 903   9.790   4.919   6.809
  527   2HG   GLN 903          2HG       GLN 903   9.681   4.969   5.036
  528   1HE2  GLN 903          1HE2      GLN 903  10.345   6.925   3.913
  529   2HE2  GLN 903          2HE2      GLN 903  11.499   8.012   4.655
  530    H    VAL 904           H        VAL 904   5.349   4.353   3.741
  531    HA   VAL 904           HA       VAL 904   3.254   5.693   5.286
  532    HB   VAL 904           HB       VAL 904   1.994   5.256   3.470
  533   1HG1  VAL 904          1HG1      VAL 904   3.178   4.882   1.441
  534   2HG1  VAL 904          2HG1      VAL 904   4.374   5.628   2.529
  535   3HG1  VAL 904          3HG1      VAL 904   4.401   3.871   2.246
  536   1HG2  VAL 904          1HG2      VAL 904   1.951   2.876   2.478
  537   2HG2  VAL 904          2HG2      VAL 904   3.020   2.420   3.827
  538   3HG2  VAL 904          3HG2      VAL 904   1.390   3.055   4.158
  539    H    SER 905           H        SER 905   1.345   4.177   5.969
  540    HA   SER 905           HA       SER 905   2.491   1.789   7.334
  541   1HB   SER 905          1HB       SER 905   1.641   4.155   8.558
  542   2HB   SER 905          2HB       SER 905   0.257   3.050   8.737
  543    HG   SER 905           HG       SER 905   2.627   3.025  10.002
  544    HA   PRO 906           HA       PRO 906  -1.103  -0.473   6.156
  545   1HB   PRO 906          1HB       PRO 906  -2.329  -1.405   8.404
  546   2HB   PRO 906          2HB       PRO 906  -0.660  -1.895   7.965
  547   1HG   PRO 906          1HG       PRO 906  -1.488   0.317   9.867
  548   2HG   PRO 906          2HG       PRO 906  -0.337  -1.021  10.189
  549   1HD   PRO 906          1HD       PRO 906   0.529   1.437   9.390
  550   2HD   PRO 906          2HD       PRO 906   1.299  -0.048   8.753
  551    H    GLU 907           H        GLU 907  -1.723   2.076   8.556
  552    HA   GLU 907           HA       GLU 907  -4.569   2.192   8.062
  553   1HB   GLU 907          1HB       GLU 907  -2.537   3.932   9.473
  554   2HB   GLU 907          2HB       GLU 907  -4.210   4.488   9.231
  555   1HG   GLU 907          1HG       GLU 907  -4.532   3.400  11.223
  556   2HG   GLU 907          2HG       GLU 907  -4.712   1.997  10.148
  557    H    TRP 908           H        TRP 908  -1.708   3.393   6.478
  558    HA   TRP 908           HA       TRP 908  -2.881   5.673   5.203
  559   1HB   TRP 908          1HB       TRP 908  -0.477   5.377   5.405
  560   2HB   TRP 908          2HB       TRP 908  -0.548   3.885   4.458
  561    HD1  TRP 908           HD       TRP 908  -0.931   7.683   4.071
  562    HE1  TRP 908           1HE      TRP 908  -0.479   8.350   1.655
  563    HE3  TRP 908           3HE      TRP 908  -0.471   3.017   2.017
  564    HZ2  TRP 908           2HZ      TRP 908   0.023   7.029  -0.870
  565    HZ3  TRP 908           3HZ      TRP 908  -0.007   2.762  -0.393
  566    HH2  TRP 908           HH       TRP 908   0.242   4.752  -1.847
  567    H    ILE 909           H        ILE 909  -2.715   2.201   4.446
  568    HA   ILE 909           HA       ILE 909  -3.703   2.461   1.758
  569    HB   ILE 909           HB       ILE 909  -3.298   0.239   3.745
  570   1HG1  ILE 909          1HG1      ILE 909  -2.490  -0.097   0.943
  571   2HG1  ILE 909          2HG1      ILE 909  -1.829   1.390   1.664
  572   1HG2  ILE 909          1HG2      ILE 909  -4.846   0.031   1.127
  573   2HG2  ILE 909          2HG2      ILE 909  -4.290  -1.348   2.105
  574   3HG2  ILE 909          3HG2      ILE 909  -5.508  -0.226   2.759
  575   1HD1  ILE 909          1HD1      ILE 909  -0.216  -0.197   2.271
  576   2HD1  ILE 909          2HD1      ILE 909  -1.270  -0.180   3.705
  577   3HD1  ILE 909          3HD1      ILE 909  -1.424  -1.483   2.503
  578    H    TRP 910           H        TRP 910  -5.182   2.044   4.974
  579    HA   TRP 910           HA       TRP 910  -7.822   1.497   3.988
  580   1HB   TRP 910          1HB       TRP 910  -6.940   2.693   6.632
  581   2HB   TRP 910          2HB       TRP 910  -8.507   1.949   6.285
  582    HD1  TRP 910           HD       TRP 910  -5.775   1.148   8.245
  583    HE1  TRP 910           1HE      TRP 910  -5.236  -1.336   8.403
  584    HE3  TRP 910           3HE      TRP 910  -8.364  -0.500   4.149
  585    HZ2  TRP 910           2HZ      TRP 910  -5.848  -3.754   6.934
  586    HZ3  TRP 910           3HZ      TRP 910  -8.362  -2.896   3.561
  587    HH2  TRP 910           HH       TRP 910  -7.113  -4.532   4.939
  588    H    ALA 911           H        ALA 911  -6.259   4.468   5.310
  589    HA   ALA 911           HA       ALA 911  -8.521   6.139   4.754
  590   1HB   ALA 911          1HB       ALA 911  -6.838   6.704   6.448
  591   2HB   ALA 911          2HB       ALA 911  -5.582   6.803   5.191
  592   3HB   ALA 911          3HB       ALA 911  -6.918   7.979   5.208
  593    H    CYS 912           H        CYS 912  -5.602   5.190   2.958
  594    HA   CYS 912           HA       CYS 912  -5.890   7.131   0.867
  595   1HB   CYS 912          1HB       CYS 912  -3.752   6.106   1.175
  596   2HB   CYS 912          2HB       CYS 912  -4.447   4.468   1.099
  597    HG   CYS 912           HG       CYS 912  -4.946   6.628  -1.308
  598    H    ILE 913           H        ILE 913  -6.598   3.587   0.964
  599    HA   ILE 913           HA       ILE 913  -7.758   3.234  -1.486
  600    HB   ILE 913           HB       ILE 913  -8.849   2.170   1.149
  601   1HG1  ILE 913          1HG1      ILE 913  -6.741   0.959  -0.682
  602   2HG1  ILE 913          2HG1      ILE 913  -6.344   1.916   0.765
  603   1HG2  ILE 913          1HG2      ILE 913 -10.391   1.484  -0.459
  604   2HG2  ILE 913          2HG2      ILE 913  -9.179   1.463  -1.762
  605   3HG2  ILE 913          3HG2      ILE 913  -9.203   0.161  -0.549
  606   1HD1  ILE 913          1HD1      ILE 913  -8.324  -0.324   1.055
  607   2HD1  ILE 913          2HD1      ILE 913  -6.604  -0.746   0.880
  608   3HD1  ILE 913          3HD1      ILE 913  -7.133   0.297   2.222
  609    H    ARG 914           H        ARG 914  -9.640   4.145   1.464
  610    HA   ARG 914           HA       ARG 914 -12.044   4.703   0.110
  611   1HB   ARG 914          1HB       ARG 914 -11.309   4.580   2.696
  612   2HB   ARG 914          2HB       ARG 914 -11.303   6.349   2.494
  613   1HG   ARG 914          1HG       ARG 914 -13.627   4.671   1.509
  614   2HG   ARG 914          2HG       ARG 914 -13.533   5.203   3.205
  615   1HD   ARG 914          1HD       ARG 914 -12.984   7.304   1.176
  616   2HD   ARG 914          2HD       ARG 914 -14.648   6.683   1.193
  617    HE   ARG 914           HE       ARG 914 -14.119   7.148   3.848
  618   1HH1  ARG 914          2HH2      ARG 914 -13.868   9.062   0.885
  619   2HH1  ARG 914          1HH2      ARG 914 -14.183  10.588   1.682
  620   1HH2  ARG 914          2HH1      ARG 914 -14.534   9.164   4.900
  621   2HH2  ARG 914          1HH1      ARG 914 -14.563  10.645   3.970
  622    H    LYS 915           H        LYS 915  -9.548   7.041   1.283
  623    HA   LYS 915           HA       LYS 915 -10.590   9.371   0.252
  624   1HB   LYS 915          1HB       LYS 915  -7.725   8.389   0.447
  625   2HB   LYS 915          2HB       LYS 915  -8.140  10.050  -0.042
  626   1HG   LYS 915          1HG       LYS 915  -9.261   8.807   2.490
  627   2HG   LYS 915          2HG       LYS 915  -7.684   9.632   2.473
  628   1HD   LYS 915          1HD       LYS 915  -8.666  11.707   1.804
  629   2HD   LYS 915          2HD       LYS 915 -10.211  10.926   1.390
  630   1HE   LYS 915          1HE       LYS 915 -10.606  11.934   3.498
  631   2HE   LYS 915          2HE       LYS 915 -10.315  10.221   3.870
  632   1HZ   LYS 915          1HZ       LYS 915  -7.894  11.107   4.056
  633   2HZ   LYS 915          2HZ       LYS 915  -8.660  12.526   4.402
  634   3HZ   LYS 915          3HZ       LYS 915  -8.943  11.189   5.326
  635    H    ARG 916           H        ARG 916  -9.467   6.598  -1.501
  636    HA   ARG 916           HA       ARG 916  -9.364   6.147  -3.741
  637   1HB   ARG 916          1HB       ARG 916 -11.357   8.275  -3.455
  638   2HB   ARG 916          2HB       ARG 916 -10.559   8.305  -5.046
  639   1HG   ARG 916          1HG       ARG 916 -12.214   6.748  -5.485
  640   2HG   ARG 916          2HG       ARG 916 -10.948   5.658  -4.870
  641   1HD   ARG 916          1HD       ARG 916 -13.180   5.246  -3.819
  642   2HD   ARG 916          2HD       ARG 916 -11.932   5.702  -2.640
  643    HE   ARG 916           HE       ARG 916 -13.225   8.072  -3.464
  644   1HH1  ARG 916          2HH2      ARG 916 -13.946   5.060  -1.758
  645   2HH1  ARG 916          1HH2      ARG 916 -15.199   5.764  -0.761
  646   1HH2  ARG 916          2HH1      ARG 916 -14.880   9.002  -2.147
  647   2HH2  ARG 916          1HH1      ARG 916 -15.732   8.012  -0.983
  648    H    ARG 917           H        ARG 917  -7.733   8.551  -2.234
  649    HA   ARG 917           HA       ARG 917  -5.958   8.921  -4.555
  650   1HB   ARG 917          1HB       ARG 917  -6.043  11.469  -3.410
  651   2HB   ARG 917          2HB       ARG 917  -6.753  10.989  -4.970
  652   1HG   ARG 917          1HG       ARG 917  -8.327  10.387  -2.490
  653   2HG   ARG 917          2HG       ARG 917  -8.233  12.086  -3.011
  654   1HD   ARG 917          1HD       ARG 917  -8.682  10.642  -5.377
  655   2HD   ARG 917          2HD       ARG 917  -9.731   9.862  -4.174
  656    HE   ARG 917           HE       ARG 917 -10.209  12.355  -5.422
  657   1HH1  ARG 917          2HH2      ARG 917 -10.182  10.894  -2.202
  658   2HH1  ARG 917          1HH2      ARG 917 -11.405  11.966  -1.556
  659   1HH2  ARG 917          2HH1      ARG 917 -11.824  13.771  -4.568
  660   2HH2  ARG 917          1HH1      ARG 917 -12.341  13.606  -2.905
  661    H    LEU 918           H        LEU 918  -3.983   8.390  -3.852
  662    HA   LEU 918           HA       LEU 918  -3.111   7.656  -1.440
  663   1HB   LEU 918          1HB       LEU 918  -1.678   9.443  -3.435
  664   2HB   LEU 918          2HB       LEU 918  -0.866   8.701  -2.035
  665    HG   LEU 918           HG       LEU 918  -0.524   7.190  -3.860
  666   1HD1  LEU 918          1HD1      LEU 918  -1.192   5.317  -2.757
  667   2HD1  LEU 918          2HD1      LEU 918  -1.874   6.449  -1.564
  668   3HD1  LEU 918          3HD1      LEU 918  -2.911   5.772  -2.843
  669   1HD2  LEU 918          1HD2      LEU 918  -2.114   6.641  -5.483
  670   2HD2  LEU 918          2HD2      LEU 918  -3.485   6.989  -4.404
  671   3HD2  LEU 918          3HD2      LEU 918  -2.552   8.326  -5.116
  672    H    VAL 919           H        VAL 919  -3.041   8.427   0.584
  673    HA   VAL 919           HA       VAL 919  -3.419  11.350   0.952
  674    HB   VAL 919           HB       VAL 919  -4.738  10.819   2.707
  675   1HG1  VAL 919          1HG1      VAL 919  -5.927   8.822   2.432
  676   2HG1  VAL 919          2HG1      VAL 919  -5.165   9.007   0.834
  677   3HG1  VAL 919          3HG1      VAL 919  -4.466   7.889   2.030
  678   1HG2  VAL 919          1HG2      VAL 919  -2.342   9.209   3.405
  679   2HG2  VAL 919          2HG2      VAL 919  -3.337  10.277   4.425
  680   3HG2  VAL 919          3HG2      VAL 919  -3.872   8.612   4.092
  681    H    ALA 920           H        ALA 920  -2.471  11.656   3.520
  682    HA   ALA 920           HA       ALA 920   0.339  11.913   3.068
  683   1HB   ALA 920          1HB       ALA 920  -1.555  12.334   5.368
  684   2HB   ALA 920          2HB       ALA 920   0.198  12.334   5.678
  685   3HB   ALA 920          3HB       ALA 920  -0.503  13.504   4.534
  686    HA   PRO 921           HA       PRO 921   1.297   7.680   4.147
  687   1HB   PRO 921          1HB       PRO 921   3.929   7.773   3.450
  688   2HB   PRO 921          2HB       PRO 921   2.624   7.794   2.220
  689   1HG   PRO 921          1HG       PRO 921   4.078  10.179   3.399
  690   2HG   PRO 921          2HG       PRO 921   3.845   9.797   1.662
  691   1HD   PRO 921          1HD       PRO 921   2.177  11.504   2.977
  692   2HD   PRO 921          2HD       PRO 921   1.525  10.338   1.786
  693    H    CYS 922           H        CYS 922   1.751   6.955   6.156
  694    HA   CYS 922           HA       CYS 922   3.862   8.243   7.740
  695   1HB   CYS 922          1HB       CYS 922   1.220   9.102   8.042
  696   2HB   CYS 922          2HB       CYS 922   1.435   7.909   9.347
  697    HG   CYS 922           HG       CYS 922   3.759  10.095   8.584
  Start of MODEL   17
    1    H    GLY 835           H        GLY 835  -9.231  -4.075  12.555
    2   1HA   GLY 835          1HA       GLY 835  -7.743  -5.459  10.441
    3   2HA   GLY 835          2HA       GLY 835  -9.166  -6.320  11.069
    4    H    SER 836           H        SER 836  -8.292  -2.940  10.128
    5    HA   SER 836           HA       SER 836 -10.942  -2.227   9.378
    6   1HB   SER 836          1HB       SER 836  -8.204  -1.109   9.145
    7   2HB   SER 836          2HB       SER 836  -9.356  -0.560   7.904
    8    HG   SER 836           HG       SER 836  -9.307  -0.092  10.623
    9    H    ALA 837           H        ALA 837  -8.692  -4.339   7.930
   10    HA   ALA 837           HA       ALA 837  -8.971  -3.915   5.193
   11   1HB   ALA 837          1HB       ALA 837  -8.149  -6.071   4.951
   12   2HB   ALA 837          2HB       ALA 837  -7.673  -5.722   6.630
   13   3HB   ALA 837          3HB       ALA 837  -9.119  -6.707   6.301
   14    H    ASP 838           H        ASP 838 -11.143  -5.713   7.425
   15    HA   ASP 838           HA       ASP 838 -13.024  -6.355   5.322
   16   1HB   ASP 838          1HB       ASP 838 -14.304  -7.352   7.054
   17   2HB   ASP 838          2HB       ASP 838 -12.608  -7.624   7.507
   18    H    GLU 839           H        GLU 839 -12.176  -3.447   6.607
   19    HA   GLU 839           HA       GLU 839 -14.953  -2.413   6.737
   20   1HB   GLU 839          1HB       GLU 839 -12.310  -1.623   7.855
   21   2HB   GLU 839          2HB       GLU 839 -13.373  -0.290   7.345
   22   1HG   GLU 839          1HG       GLU 839 -14.992  -2.218   8.702
   23   2HG   GLU 839          2HG       GLU 839 -13.552  -1.932   9.703
   24    H    THR 840           H        THR 840 -12.272  -2.741   4.623
   25    HA   THR 840           HA       THR 840 -13.515  -0.753   2.797
   26    HB   THR 840           HB       THR 840 -11.587   0.412   2.500
   27    HG1  THR 840           1HG      THR 840  -9.512  -0.749   2.700
   28   1HG2  THR 840          1HG2      THR 840 -11.798   0.549   4.899
   29   2HG2  THR 840          2HG2      THR 840 -11.055  -1.054   5.114
   30   3HG2  THR 840          3HG2      THR 840 -10.070   0.314   4.542
   31    H    LEU 841           H        LEU 841 -10.785  -3.118   2.825
   32    HA   LEU 841           HA       LEU 841 -11.252  -3.947   0.134
   33   1HB   LEU 841          1HB       LEU 841  -9.085  -4.172   1.307
   34   2HB   LEU 841          2HB       LEU 841  -9.810  -5.367   2.408
   35    HG   LEU 841           HG       LEU 841  -8.536  -6.000   0.058
   36   1HD1  LEU 841          1HD1      LEU 841  -8.972  -7.717   1.603
   37   2HD1  LEU 841          2HD1      LEU 841 -10.711  -7.340   1.677
   38   3HD1  LEU 841          3HD1      LEU 841 -10.035  -8.148   0.242
   39   1HD2  LEU 841          1HD2      LEU 841 -11.429  -5.408  -0.498
   40   2HD2  LEU 841          2HD2      LEU 841 -10.008  -5.220  -1.553
   41   3HD2  LEU 841          3HD2      LEU 841 -10.702  -6.835  -1.273
   42    H    CYS 842           H        CYS 842 -13.103  -4.415   2.887
   43    HA   CYS 842           HA       CYS 842 -13.852  -7.151   2.675
   44   1HB   CYS 842          1HB       CYS 842 -14.530  -6.181   4.669
   45   2HB   CYS 842          2HB       CYS 842 -15.014  -4.656   3.886
   46    HG   CYS 842           HG       CYS 842 -16.447  -7.612   3.989
   47    H    GLN 843           H        GLN 843 -14.222  -4.611   0.481
   48    HA   GLN 843           HA       GLN 843 -16.749  -5.707  -0.620
   49   1HB   GLN 843          1HB       GLN 843 -15.309  -3.322  -1.751
   50   2HB   GLN 843          2HB       GLN 843 -17.055  -3.652  -1.651
   51   1HG   GLN 843          1HG       GLN 843 -16.071  -3.609   1.020
   52   2HG   GLN 843          2HG       GLN 843 -15.370  -2.199   0.195
   53   1HE2  GLN 843          1HE2      GLN 843 -18.519  -3.969   0.372
   54   2HE2  GLN 843          2HE2      GLN 843 -19.514  -2.531   0.457
   55    H    THR 844           H        THR 844 -14.961  -7.609  -0.940
   56    HA   THR 844           HA       THR 844 -14.114  -8.946  -2.609
   57    HB   THR 844           HB       THR 844 -15.632  -6.990  -4.031
   58    HG1  THR 844           1HG      THR 844 -15.947  -9.202  -4.149
   59   1HG2  THR 844          1HG2      THR 844 -14.081  -7.292  -6.185
   60   2HG2  THR 844          2HG2      THR 844 -13.849  -5.926  -5.068
   61   3HG2  THR 844          3HG2      THR 844 -12.794  -7.356  -4.958
   62    H    LYS 845           H        LYS 845 -13.135  -5.729  -3.878
   63    HA   LYS 845           HA       LYS 845 -10.405  -6.166  -2.851
   64   1HB   LYS 845          1HB       LYS 845 -11.114  -6.922  -5.461
   65   2HB   LYS 845          2HB       LYS 845 -10.333  -5.333  -5.644
   66   1HG   LYS 845          1HG       LYS 845  -8.817  -7.452  -5.638
   67   2HG   LYS 845          2HG       LYS 845  -8.327  -6.068  -4.631
   68   1HD   LYS 845          1HD       LYS 845 -10.161  -7.811  -3.182
   69   2HD   LYS 845          2HD       LYS 845  -8.751  -8.723  -3.774
   70   1HE   LYS 845          1HE       LYS 845  -8.403  -6.033  -2.434
   71   2HE   LYS 845          2HE       LYS 845  -8.589  -7.510  -1.463
   72   1HZ   LYS 845          1HZ       LYS 845  -6.472  -6.829  -3.354
   73   2HZ   LYS 845          2HZ       LYS 845  -6.343  -7.276  -1.771
   74   3HZ   LYS 845          3HZ       LYS 845  -6.753  -8.394  -2.913
   75    H    VAL 846           H        VAL 846 -13.059  -4.208  -3.790
   76    HA   VAL 846           HA       VAL 846 -13.412  -1.946  -3.774
   77    HB   VAL 846           HB       VAL 846 -11.098  -1.182  -2.170
   78   1HG1  VAL 846          1HG1      VAL 846 -13.762  -0.508  -2.442
   79   2HG1  VAL 846          2HG1      VAL 846 -13.771  -1.439  -0.925
   80   3HG1  VAL 846          3HG1      VAL 846 -12.721  -0.010  -1.086
   81   1HG2  VAL 846          1HG2      VAL 846 -11.265  -2.692  -0.373
   82   2HG2  VAL 846          2HG2      VAL 846 -12.845  -3.309  -0.913
   83   3HG2  VAL 846          3HG2      VAL 846 -11.365  -3.762  -1.792
   84    H    LEU 847           H        LEU 847  -9.934  -1.488  -3.256
   85    HA   LEU 847           HA       LEU 847  -8.326  -0.505  -4.552
   86   1HB   LEU 847          1HB       LEU 847  -9.814  -1.248  -7.060
   87   2HB   LEU 847          2HB       LEU 847  -8.068  -1.303  -6.718
   88    HG   LEU 847           HG       LEU 847  -8.827  -3.583  -6.738
   89   1HD1  LEU 847          1HD1      LEU 847  -8.530  -2.444  -3.936
   90   2HD1  LEU 847          2HD1      LEU 847  -8.618  -4.194  -4.252
   91   3HD1  LEU 847          3HD1      LEU 847  -7.288  -3.231  -4.940
   92   1HD2  LEU 847          1HD2      LEU 847 -11.281  -2.490  -6.014
   93   2HD2  LEU 847          2HD2      LEU 847 -10.909  -4.228  -6.113
   94   3HD2  LEU 847          3HD2      LEU 847 -10.790  -3.380  -4.553
   95    H    LEU 848           H        LEU 848  -8.242   1.658  -4.491
   96    HA   LEU 848           HA       LEU 848 -10.110   3.165  -6.229
   97   1HB   LEU 848          1HB       LEU 848  -9.865   3.298  -3.254
   98   2HB   LEU 848          2HB       LEU 848  -9.993   4.846  -4.124
   99    HG   LEU 848           HG       LEU 848 -11.874   2.536  -4.703
  100   1HD1  LEU 848          1HD1      LEU 848 -11.663   3.937  -2.237
  101   2HD1  LEU 848          2HD1      LEU 848 -13.069   4.622  -3.088
  102   3HD1  LEU 848          3HD1      LEU 848 -12.985   2.872  -2.771
  103   1HD2  LEU 848          1HD2      LEU 848 -11.416   5.108  -5.811
  104   2HD2  LEU 848          2HD2      LEU 848 -12.766   4.003  -6.164
  105   3HD2  LEU 848          3HD2      LEU 848 -12.931   5.231  -4.886
  106    H    ASP 849           H        ASP 849  -9.337   5.666  -5.949
  107    HA   ASP 849           HA       ASP 849  -6.627   5.652  -6.981
  108   1HB   ASP 849          1HB       ASP 849  -8.578   7.892  -6.329
  109   2HB   ASP 849          2HB       ASP 849  -7.021   8.113  -7.155
  110    H    ILE 850           H        ILE 850  -6.647   4.609  -4.365
  111    HA   ILE 850           HA       ILE 850  -5.973   6.663  -2.448
  112    HB   ILE 850           HB       ILE 850  -4.911   3.992  -1.902
  113   1HG1  ILE 850          1HG1      ILE 850  -6.802   3.571  -3.620
  114   2HG1  ILE 850          2HG1      ILE 850  -6.909   2.717  -2.062
  115   1HG2  ILE 850          1HG2      ILE 850  -7.317   5.057  -0.511
  116   2HG2  ILE 850          2HG2      ILE 850  -5.780   4.462   0.161
  117   3HG2  ILE 850          3HG2      ILE 850  -5.887   6.116  -0.487
  118   1HD1  ILE 850          1HD1      ILE 850  -9.037   3.580  -2.079
  119   2HD1  ILE 850          2HD1      ILE 850  -8.211   5.011  -1.417
  120   3HD1  ILE 850          3HD1      ILE 850  -8.594   4.928  -3.153
  121    H    PHE 851           H        PHE 851  -3.771   3.951  -2.899
  122    HA   PHE 851           HA       PHE 851  -1.463   5.586  -2.699
  123   1HB   PHE 851          1HB       PHE 851  -1.464   2.901  -4.060
  124   2HB   PHE 851          2HB       PHE 851  -0.259   3.605  -2.969
  125    HD1  PHE 851           1HD      PHE 851  -1.374   4.239  -0.541
  126    HD2  PHE 851           2HD      PHE 851  -2.654   1.121  -3.204
  127    HE1  PHE 851           1HE      PHE 851  -2.392   3.026   1.368
  128    HE2  PHE 851           2HE      PHE 851  -3.672  -0.091  -1.295
  129    HZ   PHE 851           HZ       PHE 851  -3.542   0.861   0.991
  130    H    THR 852           H        THR 852  -3.476   6.279  -4.883
  131    HA   THR 852           HA       THR 852  -2.764   5.775  -7.445
  132    HB   THR 852           HB       THR 852  -4.264   7.681  -6.226
  133    HG1  THR 852           1HG      THR 852  -4.343   8.564  -8.466
  134   1HG2  THR 852          1HG2      THR 852  -3.377   9.893  -6.885
  135   2HG2  THR 852          2HG2      THR 852  -2.277   9.083  -5.743
  136   3HG2  THR 852          3HG2      THR 852  -1.887   9.122  -7.480
  137    H    GLY 853           H        GLY 853  -0.739   5.346  -8.160
  138   1HA   GLY 853          1HA       GLY 853   1.405   5.791  -8.863
  139   2HA   GLY 853          2HA       GLY 853   1.125   7.504  -8.475
  140    H    VAL 854           H        VAL 854   0.458   5.301  -5.903
  141    HA   VAL 854           HA       VAL 854   2.865   6.266  -4.486
  142    HB   VAL 854           HB       VAL 854   0.245   4.996  -3.645
  143   1HG1  VAL 854          1HG1      VAL 854   1.038   4.653  -1.467
  144   2HG1  VAL 854          2HG1      VAL 854   2.427   4.128  -2.449
  145   3HG1  VAL 854          3HG1      VAL 854   2.429   5.740  -1.695
  146   1HG2  VAL 854          1HG2      VAL 854   1.618   7.661  -3.436
  147   2HG2  VAL 854          2HG2      VAL 854  -0.093   7.286  -3.754
  148   3HG2  VAL 854          3HG2      VAL 854   0.553   7.160  -2.101
  149    H    ARG 855           H        ARG 855   4.607   5.024  -4.995
  150    HA   ARG 855           HA       ARG 855   4.271   2.105  -5.221
  151   1HB   ARG 855          1HB       ARG 855   6.394   2.107  -6.228
  152   2HB   ARG 855          2HB       ARG 855   5.689   3.650  -6.769
  153   1HG   ARG 855          1HG       ARG 855   6.804   4.638  -4.619
  154   2HG   ARG 855          2HG       ARG 855   7.792   3.158  -4.649
  155   1HD   ARG 855          1HD       ARG 855   9.012   3.888  -6.407
  156   2HD   ARG 855          2HD       ARG 855   7.564   4.414  -7.292
  157    HE   ARG 855           HE       ARG 855   9.213   6.035  -5.451
  158   1HH1  ARG 855          2HH2      ARG 855   6.337   5.707  -7.481
  159   2HH1  ARG 855          1HH2      ARG 855   6.045   7.428  -7.582
  160   1HH2  ARG 855          2HH1      ARG 855   8.827   8.309  -5.584
  161   2HH2  ARG 855          1HH1      ARG 855   7.464   8.912  -6.501
  162    H    LEU 856           H        LEU 856   3.734   1.666  -3.000
  163    HA   LEU 856           HA       LEU 856   5.918   2.186  -1.059
  164   1HB   LEU 856          1HB       LEU 856   4.304   2.295   0.529
  165   2HB   LEU 856          2HB       LEU 856   3.192   2.502  -0.846
  166    HG   LEU 856           HG       LEU 856   2.712   0.130  -0.904
  167   1HD1  LEU 856          1HD1      LEU 856   4.498  -1.188  -0.399
  168   2HD1  LEU 856          2HD1      LEU 856   5.203   0.027   0.694
  169   3HD1  LEU 856          3HD1      LEU 856   3.916  -1.055   1.278
  170   1HD2  LEU 856          1HD2      LEU 856   1.366   0.103   0.952
  171   2HD2  LEU 856          2HD2      LEU 856   2.705   0.496   2.056
  172   3HD2  LEU 856          3HD2      LEU 856   1.925   1.785   1.108
  173    H    TYR 857           H        TYR 857   7.091   0.548  -0.152
  174    HA   TYR 857           HA       TYR 857   7.011  -2.023  -1.489
  175   1HB   TYR 857          1HB       TYR 857   9.167  -1.647  -0.942
  176   2HB   TYR 857          2HB       TYR 857   8.744  -0.549   0.383
  177    HD1  TYR 857           1HD      TYR 857   9.809  -1.237   2.321
  178    HD2  TYR 857           2HD      TYR 857   8.014  -4.186  -0.235
  179    HE1  TYR 857           1HE      TYR 857  10.371  -3.006   3.966
  180    HE2  TYR 857           2HE      TYR 857   8.575  -5.954   1.411
  181    HH   TYR 857           HH       TYR 857   9.542  -6.442   3.420
  182    H    LEU 858           H        LEU 858   5.187  -3.200  -1.044
  183    HA   LEU 858           HA       LEU 858   4.170  -3.365   1.690
  184   1HB   LEU 858          1HB       LEU 858   2.691  -3.318  -0.329
  185   2HB   LEU 858          2HB       LEU 858   3.359  -4.895  -0.812
  186    HG   LEU 858           HG       LEU 858   2.160  -6.019   0.764
  187   1HD1  LEU 858          1HD1      LEU 858   2.728  -3.634   2.566
  188   2HD1  LEU 858          2HD1      LEU 858   1.755  -5.033   3.077
  189   3HD1  LEU 858          3HD1      LEU 858   3.466  -5.252   2.638
  190   1HD2  LEU 858          1HD2      LEU 858   0.622  -4.160  -0.329
  191   2HD2  LEU 858          2HD2      LEU 858   0.008  -5.151   1.016
  192   3HD2  LEU 858          3HD2      LEU 858   0.599  -3.501   1.324
  193    HA   PRO 859           HA       PRO 859   6.988  -6.754   2.497
  194   1HB   PRO 859          1HB       PRO 859   6.521  -6.901   5.177
  195   2HB   PRO 859          2HB       PRO 859   7.440  -5.543   4.451
  196   1HG   PRO 859          1HG       PRO 859   4.488  -5.605   5.137
  197   2HG   PRO 859          2HG       PRO 859   5.692  -4.368   5.624
  198   1HD   PRO 859          1HD       PRO 859   4.095  -4.015   3.443
  199   2HD   PRO 859          2HD       PRO 859   5.812  -3.515   3.400
  200    HA   PRO 860           HA       PRO 860   4.019 -10.022   2.241
  201   1HB   PRO 860          1HB       PRO 860   5.669 -12.157   2.625
  202   2HB   PRO 860          2HB       PRO 860   5.790 -11.118   1.167
  203   1HG   PRO 860          1HG       PRO 860   7.423 -10.910   3.713
  204   2HG   PRO 860          2HG       PRO 860   8.038 -11.000   2.030
  205   1HD   PRO 860          1HD       PRO 860   7.714  -8.609   3.300
  206   2HD   PRO 860          2HD       PRO 860   7.291  -8.782   1.569
  207    H    SER 861           H        SER 861   6.032  -9.340   5.030
  208    HA   SER 861           HA       SER 861   4.766 -11.298   6.762
  209   1HB   SER 861          1HB       SER 861   7.000  -9.479   6.840
  210   2HB   SER 861          2HB       SER 861   5.971  -9.202   8.266
  211    HG   SER 861           HG       SER 861   6.602 -11.042   9.020
  212    H    THR 862           H        THR 862   3.898  -8.246   5.464
  213    HA   THR 862           HA       THR 862   2.408  -7.215   7.689
  214    HB   THR 862           HB       THR 862   3.113  -6.402   5.075
  215    HG1  THR 862           1HG      THR 862   2.959  -4.648   6.186
  216   1HG2  THR 862          1HG2      THR 862   0.133  -6.780   5.483
  217   2HG2  THR 862          2HG2      THR 862   0.764  -5.487   4.434
  218   3HG2  THR 862          3HG2      THR 862   1.124  -7.190   4.062
  219    HA   PRO 863           HA       PRO 863  -1.103  -9.869   7.545
  220   1HB   PRO 863          1HB       PRO 863  -2.861  -8.368   8.988
  221   2HB   PRO 863          2HB       PRO 863  -1.390  -9.077   9.731
  222   1HG   PRO 863          1HG       PRO 863  -1.726  -6.269   8.638
  223   2HG   PRO 863          2HG       PRO 863  -1.117  -6.740  10.258
  224   1HD   PRO 863          1HD       PRO 863   0.587  -6.198   8.201
  225   2HD   PRO 863          2HD       PRO 863   0.926  -7.546   9.328
  226    H    ASP 864           H        ASP 864  -2.829 -10.173   6.176
  227    HA   ASP 864           HA       ASP 864  -4.490  -9.669   4.660
  228   1HB   ASP 864          1HB       ASP 864  -4.448  -7.407   6.225
  229   2HB   ASP 864          2HB       ASP 864  -4.079  -6.744   4.619
  230    H    PHE 865           H        PHE 865  -1.230  -9.041   4.487
  231    HA   PHE 865           HA       PHE 865  -0.658  -7.614   2.234
  232   1HB   PHE 865          1HB       PHE 865   0.969  -8.845   3.640
  233   2HB   PHE 865          2HB       PHE 865   0.428 -10.368   2.914
  234    HD1  PHE 865           1HD      PHE 865   1.987  -7.069   2.107
  235    HD2  PHE 865           2HD      PHE 865   1.357 -11.141   0.895
  236    HE1  PHE 865           1HE      PHE 865   3.628  -6.776   0.271
  237    HE2  PHE 865           2HE      PHE 865   2.998 -10.848  -0.942
  238    HZ   PHE 865           HZ       PHE 865   4.134  -8.666  -1.253
  239    H    SER 866           H        SER 866  -1.754 -11.050   2.279
  240    HA   SER 866           HA       SER 866  -1.729 -11.816  -0.283
  241   1HB   SER 866          1HB       SER 866  -2.976 -12.814   1.783
  242   2HB   SER 866          2HB       SER 866  -4.383 -11.922   1.155
  243    HG   SER 866           HG       SER 866  -3.713 -12.986  -0.932
  244    H    ARG 867           H        ARG 867  -3.831  -9.250   1.022
  245    HA   ARG 867           HA       ARG 867  -4.910  -8.779  -1.700
  246   1HB   ARG 867          1HB       ARG 867  -5.708  -7.439   0.905
  247   2HB   ARG 867          2HB       ARG 867  -6.619  -7.497  -0.622
  248   1HG   ARG 867          1HG       ARG 867  -5.873  -9.971   0.988
  249   2HG   ARG 867          2HG       ARG 867  -7.427  -9.120   1.155
  250   1HD   ARG 867          1HD       ARG 867  -7.986  -9.535  -1.157
  251   2HD   ARG 867          2HD       ARG 867  -6.355 -10.153  -1.497
  252    HE   ARG 867           HE       ARG 867  -7.455 -11.736   0.568
  253   1HH1  ARG 867          2HH2      ARG 867  -8.012 -10.972  -2.839
  254   2HH1  ARG 867          1HH2      ARG 867  -8.717 -12.529  -3.214
  255   1HH2  ARG 867          2HH1      ARG 867  -8.386 -13.792   0.072
  256   2HH2  ARG 867          1HH1      ARG 867  -8.930 -14.137  -1.554
  257    H    LEU 868           H        LEU 868  -3.597  -6.885   1.085
  258    HA   LEU 868           HA       LEU 868  -3.231  -4.429   0.159
  259   1HB   LEU 868          1HB       LEU 868  -1.111  -6.213   1.401
  260   2HB   LEU 868          2HB       LEU 868  -0.893  -4.462   1.170
  261    HG   LEU 868           HG       LEU 868  -3.303  -5.634   2.605
  262   1HD1  LEU 868          1HD1      LEU 868  -0.761  -5.975   3.528
  263   2HD1  LEU 868          2HD1      LEU 868  -1.111  -4.350   4.164
  264   3HD1  LEU 868          3HD1      LEU 868  -2.165  -5.719   4.592
  265   1HD2  LEU 868          1HD2      LEU 868  -1.989  -2.885   2.676
  266   2HD2  LEU 868          2HD2      LEU 868  -3.418  -3.299   1.699
  267   3HD2  LEU 868          3HD2      LEU 868  -3.507  -3.358   3.476
  268    H    ARG 869           H        ARG 869  -1.192  -7.187  -0.930
  269    HA   ARG 869           HA       ARG 869   0.343  -5.642  -2.779
  270   1HB   ARG 869          1HB       ARG 869   0.231  -8.317  -1.827
  271   2HB   ARG 869          2HB       ARG 869   0.063  -8.397  -3.597
  272   1HG   ARG 869          1HG       ARG 869   2.032  -6.587  -3.498
  273   2HG   ARG 869          2HG       ARG 869   2.346  -7.375  -1.933
  274   1HD   ARG 869          1HD       ARG 869   2.381  -8.577  -4.710
  275   2HD   ARG 869          2HD       ARG 869   3.638  -8.632  -3.455
  276    HE   ARG 869           HE       ARG 869   1.240  -9.929  -2.548
  277   1HH1  ARG 869          2HH2      ARG 869   4.022 -10.304  -4.697
  278   2HH1  ARG 869          1HH2      ARG 869   4.022 -12.051  -4.617
  279   1HH2  ARG 869          2HH1      ARG 869   1.240 -12.238  -2.442
  280   2HH2  ARG 869          1HH1      ARG 869   2.435 -13.154  -3.331
  281    H    ARG 870           H        ARG 870  -1.692  -8.363  -3.860
  282    HA   ARG 870           HA       ARG 870  -2.184  -7.473  -6.410
  283   1HB   ARG 870          1HB       ARG 870  -2.854  -9.677  -5.265
  284   2HB   ARG 870          2HB       ARG 870  -4.323  -8.820  -4.736
  285   1HG   ARG 870          1HG       ARG 870  -5.017  -9.757  -6.768
  286   2HG   ARG 870          2HG       ARG 870  -4.499  -8.131  -7.273
  287   1HD   ARG 870          1HD       ARG 870  -2.169  -9.217  -7.643
  288   2HD   ARG 870          2HD       ARG 870  -3.036 -10.766  -7.575
  289    HE   ARG 870           HE       ARG 870  -4.036 -10.299  -9.635
  290   1HH1  ARG 870          2HH2      ARG 870  -2.270  -7.503  -8.384
  291   2HH1  ARG 870          1HH2      ARG 870  -2.350  -6.609  -9.885
  292   1HH2  ARG 870          2HH1      ARG 870  -4.141  -9.117 -11.618
  293   2HH2  ARG 870          1HH1      ARG 870  -3.416  -7.529 -11.729
  294    H    TYR 871           H        TYR 871  -3.518  -6.238  -3.413
  295    HA   TYR 871           HA       TYR 871  -5.721  -4.836  -4.701
  296   1HB   TYR 871          1HB       TYR 871  -5.680  -5.686  -2.319
  297   2HB   TYR 871          2HB       TYR 871  -4.510  -4.407  -1.954
  298    HD1  TYR 871           1HD      TYR 871  -7.568  -4.312  -4.119
  299    HD2  TYR 871           2HD      TYR 871  -5.630  -2.915  -0.550
  300    HE1  TYR 871           1HE      TYR 871  -9.430  -2.721  -3.731
  301    HE2  TYR 871           2HE      TYR 871  -7.492  -1.323  -0.162
  302    HH   TYR 871           HH       TYR 871 -10.112  -1.245  -0.918
  303    H    PHE 872           H        PHE 872  -2.908  -3.618  -2.792
  304    HA   PHE 872           HA       PHE 872  -3.009  -0.976  -3.570
  305   1HB   PHE 872          1HB       PHE 872  -1.458  -2.003  -1.906
  306   2HB   PHE 872          2HB       PHE 872  -0.497  -2.651  -3.246
  307    HD1  PHE 872           1HD      PHE 872   0.049  -0.709  -5.106
  308    HD2  PHE 872           2HD      PHE 872  -0.612  -0.105  -0.905
  309    HE1  PHE 872           1HE      PHE 872   1.338   1.407  -5.208
  310    HE2  PHE 872           2HE      PHE 872   0.677   2.011  -1.007
  311    HZ   PHE 872           HZ       PHE 872   1.652   2.767  -3.158
  312    H    VAL 873           H        VAL 873  -0.291  -2.791  -4.949
  313    HA   VAL 873           HA       VAL 873   0.221  -1.408  -7.171
  314    HB   VAL 873           HB       VAL 873   1.530  -3.306  -6.972
  315   1HG1  VAL 873          1HG1      VAL 873   0.498  -5.617  -6.739
  316   2HG1  VAL 873          2HG1      VAL 873   0.178  -4.516  -5.378
  317   3HG1  VAL 873          3HG1      VAL 873  -1.086  -4.817  -6.595
  318   1HG2  VAL 873          1HG2      VAL 873   0.788  -3.041  -9.337
  319   2HG2  VAL 873          2HG2      VAL 873   1.126  -4.741  -8.928
  320   3HG2  VAL 873          3HG2      VAL 873  -0.556  -4.166  -9.023
  321    H    ALA 874           H        ALA 874  -2.610  -3.539  -6.760
  322    HA   ALA 874           HA       ALA 874  -3.539  -3.494  -9.424
  323   1HB   ALA 874          1HB       ALA 874  -4.582  -4.131  -6.742
  324   2HB   ALA 874          2HB       ALA 874  -5.827  -3.539  -7.868
  325   3HB   ALA 874          3HB       ALA 874  -4.843  -4.959  -8.296
  326    H    PHE 875           H        PHE 875  -4.640  -1.459  -6.645
  327    HA   PHE 875           HA       PHE 875  -6.382   0.246  -7.696
  328   1HB   PHE 875          1HB       PHE 875  -3.866   1.205  -6.293
  329   2HB   PHE 875          2HB       PHE 875  -5.423   2.048  -6.362
  330    HD1  PHE 875           1HD      PHE 875  -6.078  -1.396  -6.117
  331    HD2  PHE 875           2HD      PHE 875  -4.791   1.960  -3.766
  332    HE1  PHE 875           1HE      PHE 875  -6.805  -2.563  -4.053
  333    HE2  PHE 875           2HE      PHE 875  -5.518   0.794  -1.702
  334    HZ   PHE 875           HZ       PHE 875  -6.525  -1.468  -1.845
  335    H    ASP 876           H        ASP 876  -2.847   0.524  -8.343
  336    HA   ASP 876           HA       ASP 876  -2.708   0.962 -10.954
  337   1HB   ASP 876          1HB       ASP 876  -4.341   3.116  -9.782
  338   2HB   ASP 876          2HB       ASP 876  -2.998   3.705 -10.785
  339    H    GLY 877           H        GLY 877  -1.474   1.035  -8.019
  340   1HA   GLY 877          1HA       GLY 877   0.692   2.984  -8.542
  341   2HA   GLY 877          2HA       GLY 877   0.370   2.137  -7.012
  342    H    ASP 878           H        ASP 878   2.457   1.296  -6.754
  343    HA   ASP 878           HA       ASP 878   3.008  -1.074  -8.386
  344   1HB   ASP 878          1HB       ASP 878   4.453   1.473  -8.685
  345   2HB   ASP 878          2HB       ASP 878   5.515   0.097  -8.316
  346    H    LEU 879           H        LEU 879   4.681  -2.433  -7.405
  347    HA   LEU 879           HA       LEU 879   5.264  -1.718  -4.577
  348   1HB   LEU 879          1HB       LEU 879   3.686  -3.988  -5.658
  349   2HB   LEU 879          2HB       LEU 879   4.916  -4.423  -4.446
  350    HG   LEU 879           HG       LEU 879   3.941  -3.076  -2.786
  351   1HD1  LEU 879          1HD1      LEU 879   2.679  -1.609  -5.124
  352   2HD1  LEU 879          2HD1      LEU 879   2.093  -1.392  -3.458
  353   3HD1  LEU 879          3HD1      LEU 879   3.771  -0.970  -3.873
  354   1HD2  LEU 879          1HD2      LEU 879   2.313  -4.679  -2.777
  355   2HD2  LEU 879          2HD2      LEU 879   1.287  -3.367  -3.405
  356   3HD2  LEU 879          3HD2      LEU 879   2.024  -4.536  -4.527
  357    H    VAL 880           H        VAL 880   7.346  -2.049  -4.018
  358    HA   VAL 880           HA       VAL 880   9.019  -3.605  -5.932
  359    HB   VAL 880           HB       VAL 880  10.451  -1.822  -4.110
  360   1HG1  VAL 880          1HG1      VAL 880  10.258  -1.535  -7.107
  361   2HG1  VAL 880          2HG1      VAL 880  11.677  -1.366  -6.046
  362   3HG1  VAL 880          3HG1      VAL 880  11.032  -2.982  -6.417
  363   1HG2  VAL 880          1HG2      VAL 880   8.737  -0.253  -4.110
  364   2HG2  VAL 880          2HG2      VAL 880   9.574   0.196  -5.615
  365   3HG2  VAL 880          3HG2      VAL 880   8.097  -0.796  -5.680
  366    H    GLN 881           H        GLN 881  10.356  -5.204  -5.148
  367    HA   GLN 881           HA       GLN 881   9.658  -6.382  -2.637
  368   1HB   GLN 881          1HB       GLN 881  12.125  -6.912  -4.332
  369   2HB   GLN 881          2HB       GLN 881  11.333  -8.023  -3.189
  370   1HG   GLN 881          1HG       GLN 881   9.856  -8.691  -4.753
  371   2HG   GLN 881          2HG       GLN 881   9.423  -7.011  -5.137
  372   1HE2  GLN 881          1HE2      GLN 881  11.087  -9.846  -6.175
  373   2HE2  GLN 881          2HE2      GLN 881  11.838  -9.175  -7.607
  374    H    GLU 882           H        GLU 882  10.524  -6.160  -0.636
  375    HA   GLU 882           HA       GLU 882  11.755  -4.065   0.400
  376   1HB   GLU 882          1HB       GLU 882  11.232  -6.152   1.644
  377   2HB   GLU 882          2HB       GLU 882  12.698  -6.902   0.970
  378   1HG   GLU 882          1HG       GLU 882  13.801  -4.642   1.928
  379   2HG   GLU 882          2HG       GLU 882  12.420  -4.756   3.040
  380    H    PHE 883           H        PHE 883  13.917  -6.784  -0.568
  381    HA   PHE 883           HA       PHE 883  16.224  -5.109  -0.687
  382   1HB   PHE 883          1HB       PHE 883  17.332  -7.039  -1.552
  383   2HB   PHE 883          2HB       PHE 883  16.161  -7.601  -0.347
  384    HD1  PHE 883           1HD      PHE 883  14.172  -8.853  -1.009
  385    HD2  PHE 883           2HD      PHE 883  17.032  -7.516  -3.921
  386    HE1  PHE 883           1HE      PHE 883  13.181 -10.388  -2.686
  387    HE2  PHE 883           2HE      PHE 883  16.041  -9.051  -5.599
  388    HZ   PHE 883           HZ       PHE 883  14.116 -10.486  -4.981
  389    H    ASP 884           H        ASP 884  13.646  -4.566  -2.418
  390    HA   ASP 884           HA       ASP 884  15.201  -3.724  -4.784
  391   1HB   ASP 884          1HB       ASP 884  12.664  -5.396  -4.873
  392   2HB   ASP 884          2HB       ASP 884  13.367  -4.558  -6.272
  393    H    MET 885           H        MET 885  14.993  -1.595  -3.969
  394    HA   MET 885           HA       MET 885  12.319  -0.443  -4.457
  395   1HB   MET 885          1HB       MET 885  13.009   0.980  -2.259
  396   2HB   MET 885          2HB       MET 885  11.986  -0.475  -2.194
  397   1HG   MET 885          1HG       MET 885  14.169  -1.802  -1.971
  398   2HG   MET 885          2HG       MET 885  14.963  -0.247  -1.673
  399   1HE   MET 885          1HE       MET 885  12.307  -2.649  -0.885
  400   2HE   MET 885          2HE       MET 885  12.269  -2.781   0.890
  401   3HE   MET 885          3HE       MET 885  11.272  -1.557   0.067
  402    H    THR 886           H        THR 886  15.814  -0.076  -3.884
  403    HA   THR 886           HA       THR 886  16.766   2.242  -4.082
  404    HB   THR 886           HB       THR 886  18.200   1.749  -5.886
  405    HG1  THR 886           1HG      THR 886  16.209   0.037  -6.954
  406   1HG2  THR 886          1HG2      THR 886  18.111  -0.015  -4.077
  407   2HG2  THR 886          2HG2      THR 886  17.021  -0.955  -5.125
  408   3HG2  THR 886          3HG2      THR 886  18.688  -0.616  -5.650
  409    H    SER 887           H        SER 887  14.677   1.239  -6.850
  410    HA   SER 887           HA       SER 887  14.317   4.095  -7.530
  411   1HB   SER 887          1HB       SER 887  14.244   1.521  -8.955
  412   2HB   SER 887          2HB       SER 887  12.880   2.591  -9.360
  413    HG   SER 887           HG       SER 887  15.262   3.910  -9.179
  414    H    ALA 888           H        ALA 888  12.829   1.565  -5.763
  415    HA   ALA 888           HA       ALA 888  10.131   1.757  -6.164
  416   1HB   ALA 888          1HB       ALA 888  10.778   0.304  -4.460
  417   2HB   ALA 888          2HB       ALA 888  11.819   1.518  -3.678
  418   3HB   ALA 888          3HB       ALA 888  10.049   1.639  -3.535
  419    H    THR 889           H        THR 889   8.526   2.940  -4.588
  420    HA   THR 889           HA       THR 889   9.329   5.811  -4.489
  421    HB   THR 889           HB       THR 889   7.591   4.927  -6.279
  422    HG1  THR 889           1HG      THR 889   6.712   6.947  -6.196
  423   1HG2  THR 889          1HG2      THR 889   6.093   4.920  -3.648
  424   2HG2  THR 889          2HG2      THR 889   5.250   5.292  -5.171
  425   3HG2  THR 889          3HG2      THR 889   6.055   3.719  -4.961
  426    H    HIS 890           H        HIS 890   7.142   3.277  -3.163
  427    HA   HIS 890           HA       HIS 890   7.289   4.719  -0.558
  428   1HB   HIS 890          1HB       HIS 890   4.943   3.523  -2.025
  429   2HB   HIS 890          2HB       HIS 890   4.943   3.602  -0.253
  430    HD1  HIS 890           1HD      HIS 890   5.283   6.052  -3.248
  431    HD2  HIS 890           2HD      HIS 890   4.195   5.862   0.813
  432    HE1  HIS 890           1HE      HIS 890   4.358   8.354  -2.626
  433    H    VAL 891           H        VAL 891   6.952   3.287   1.330
  434    HA   VAL 891           HA       VAL 891   7.425   0.422   0.825
  435    HB   VAL 891           HB       VAL 891   9.332   0.529   2.534
  436   1HG1  VAL 891          1HG1      VAL 891  10.557   0.232   0.667
  437   2HG1  VAL 891          2HG1      VAL 891   9.248   0.957  -0.297
  438   3HG1  VAL 891          3HG1      VAL 891  10.539   1.986   0.366
  439   1HG2  VAL 891          1HG2      VAL 891   9.125   3.467   1.749
  440   2HG2  VAL 891          2HG2      VAL 891   8.930   2.785   3.382
  441   3HG2  VAL 891          3HG2      VAL 891  10.520   2.741   2.583
  442    H    LEU 892           H        LEU 892   6.317  -0.797   2.258
  443    HA   LEU 892           HA       LEU 892   4.779   0.567   4.324
  444   1HB   LEU 892          1HB       LEU 892   4.326  -1.601   2.716
  445   2HB   LEU 892          2HB       LEU 892   4.812  -2.396   4.233
  446    HG   LEU 892           HG       LEU 892   3.114  -0.305   5.039
  447   1HD1  LEU 892          1HD1      LEU 892   1.547   0.045   3.453
  448   2HD1  LEU 892          2HD1      LEU 892   2.582  -0.853   2.318
  449   3HD1  LEU 892          3HD1      LEU 892   1.314  -1.705   3.231
  450   1HD2  LEU 892          1HD2      LEU 892   1.508  -2.537   5.038
  451   2HD2  LEU 892          2HD2      LEU 892   3.125  -3.267   4.901
  452   3HD2  LEU 892          3HD2      LEU 892   2.748  -2.190   6.267
  453    H    GLY 893           H        GLY 893   5.493   0.926   6.337
  454   1HA   GLY 893          1HA       GLY 893   6.776   0.773   8.238
  455   2HA   GLY 893          2HA       GLY 893   6.616  -0.986   8.033
  456    H    SER 894           H        SER 894   8.810   1.531   8.270
  457    HA   SER 894           HA       SER 894  11.116   1.453   8.169
  458   1HB   SER 894          1HB       SER 894  10.616  -1.263   6.894
  459   2HB   SER 894          2HB       SER 894  12.231  -0.599   7.238
  460    HG   SER 894           HG       SER 894  11.924  -0.888   9.312
  461    H    ARG 895           H        ARG 895  12.843   1.715   6.499
  462    HA   ARG 895           HA       ARG 895  11.784   2.040   3.753
  463   1HB   ARG 895          1HB       ARG 895  12.899   4.308   3.679
  464   2HB   ARG 895          2HB       ARG 895  11.455   4.226   4.717
  465   1HG   ARG 895          1HG       ARG 895  12.713   4.276   6.696
  466   2HG   ARG 895          2HG       ARG 895  14.189   3.691   5.890
  467   1HD   ARG 895          1HD       ARG 895  14.687   5.780   4.987
  468   2HD   ARG 895          2HD       ARG 895  12.996   6.322   5.038
  469    HE   ARG 895           HE       ARG 895  14.319   5.871   7.634
  470   1HH1  ARG 895          2HH2      ARG 895  13.297   8.118   5.102
  471   2HH1  ARG 895          1HH2      ARG 895  13.373   9.529   6.134
  472   1HH2  ARG 895          2HH1      ARG 895  14.420   7.735   8.996
  473   2HH2  ARG 895          1HH1      ARG 895  14.013   9.311   8.354
  474    H    ASP 896           H        ASP 896  14.468   1.792   6.056
  475    HA   ASP 896           HA       ASP 896  16.797   1.981   5.009
  476   1HB   ASP 896          1HB       ASP 896  16.719   0.454   6.776
  477   2HB   ASP 896          2HB       ASP 896  15.542  -0.593   5.953
  478    H    LYS 897           H        LYS 897  15.256  -1.050   3.852
  479    HA   LYS 897           HA       LYS 897  16.689  -1.605   1.663
  480   1HB   LYS 897          1HB       LYS 897  14.026  -1.769   0.707
  481   2HB   LYS 897          2HB       LYS 897  14.984  -3.054   1.483
  482   1HG   LYS 897          1HG       LYS 897  13.084  -2.902   2.869
  483   2HG   LYS 897          2HG       LYS 897  14.281  -1.897   3.721
  484   1HD   LYS 897          1HD       LYS 897  13.308   0.074   2.334
  485   2HD   LYS 897          2HD       LYS 897  11.937  -1.015   2.013
  486   1HE   LYS 897          1HE       LYS 897  12.182  -1.356   4.695
  487   2HE   LYS 897          2HE       LYS 897  12.779   0.312   4.550
  488   1HZ   LYS 897          1HZ       LYS 897  10.286  -0.528   3.284
  489   2HZ   LYS 897          2HZ       LYS 897  10.325  -0.047   4.861
  490   3HZ   LYS 897          3HZ       LYS 897  10.789   0.994   3.669
  491    H    ASN 898           H        ASN 898  14.478   1.154   1.970
  492    HA   ASN 898           HA       ASN 898  15.777   2.451  -0.287
  493   1HB   ASN 898          1HB       ASN 898  13.489   0.871  -0.797
  494   2HB   ASN 898          2HB       ASN 898  12.925   2.556  -0.795
  495   1HD2  ASN 898          1HD2      ASN 898  12.689   3.018  -2.941
  496   2HD2  ASN 898          2HD2      ASN 898  13.968   2.880  -4.129
  497    HA   PRO 899           HA       PRO 899  14.495   5.372   2.939
  498   1HB   PRO 899          1HB       PRO 899  16.569   7.103   2.587
  499   2HB   PRO 899          2HB       PRO 899  16.783   5.527   3.416
  500   1HG   PRO 899          1HG       PRO 899  17.318   6.157   0.499
  501   2HG   PRO 899          2HG       PRO 899  18.436   5.379   1.667
  502   1HD   PRO 899          1HD       PRO 899  16.899   3.901  -0.031
  503   2HD   PRO 899          2HD       PRO 899  17.150   3.371   1.660
  504    H    ALA 900           H        ALA 900  14.849   5.459  -0.487
  505    HA   ALA 900           HA       ALA 900  13.946   8.238  -0.754
  506   1HB   ALA 900          1HB       ALA 900  15.557   6.740  -2.292
  507   2HB   ALA 900          2HB       ALA 900  14.004   6.331  -3.060
  508   3HB   ALA 900          3HB       ALA 900  14.531   8.029  -2.968
  509    H    ALA 901           H        ALA 901  12.501   5.370   0.086
  510    HA   ALA 901           HA       ALA 901  10.044   5.836  -1.491
  511   1HB   ALA 901          1HB       ALA 901  10.751   3.637   0.491
  512   2HB   ALA 901          2HB       ALA 901   9.333   3.680  -0.584
  513   3HB   ALA 901          3HB       ALA 901  10.968   3.533  -1.273
  514    H    GLN 902           H        GLN 902   8.283   4.720   0.522
  515    HA   GLN 902           HA       GLN 902   8.334   6.900   2.554
  516   1HB   GLN 902          1HB       GLN 902   6.231   6.091   0.598
  517   2HB   GLN 902          2HB       GLN 902   5.684   6.466   2.250
  518   1HG   GLN 902          1HG       GLN 902   7.327   8.250   0.409
  519   2HG   GLN 902          2HG       GLN 902   5.649   8.511   0.932
  520   1HE2  GLN 902          1HE2      GLN 902   6.029   7.655   3.683
  521   2HE2  GLN 902          2HE2      GLN 902   6.967   8.897   4.484
  522    H    GLN 903           H        GLN 903   7.972   6.269   4.629
  523    HA   GLN 903           HA       GLN 903   7.713   3.375   5.095
  524   1HB   GLN 903          1HB       GLN 903   8.296   5.757   6.894
  525   2HB   GLN 903          2HB       GLN 903   8.159   4.081   7.479
  526   1HG   GLN 903          1HG       GLN 903  10.325   3.786   6.942
  527   2HG   GLN 903          2HG       GLN 903   9.869   3.962   5.234
  528   1HE2  GLN 903          1HE2      GLN 903  10.141   5.984   4.176
  529   2HE2  GLN 903          2HE2      GLN 903  11.152   7.244   4.852
  530    H    VAL 904           H        VAL 904   5.406   3.815   4.061
  531    HA   VAL 904           HA       VAL 904   3.456   4.965   5.876
  532    HB   VAL 904           HB       VAL 904   2.081   4.827   4.083
  533   1HG1  VAL 904          1HG1      VAL 904   4.491   5.321   3.190
  534   2HG1  VAL 904          2HG1      VAL 904   4.398   3.680   2.507
  535   3HG1  VAL 904          3HG1      VAL 904   3.214   4.916   2.018
  536   1HG2  VAL 904          1HG2      VAL 904   3.137   1.990   3.744
  537   2HG2  VAL 904          2HG2      VAL 904   1.575   2.481   4.443
  538   3HG2  VAL 904          3HG2      VAL 904   1.887   2.716   2.706
  539    H    SER 905           H        SER 905   1.453   3.530   6.411
  540    HA   SER 905           HA       SER 905   2.411   0.873   7.359
  541   1HB   SER 905          1HB       SER 905   1.824   3.100   8.956
  542   2HB   SER 905          2HB       SER 905   0.363   2.088   9.048
  543    HG   SER 905           HG       SER 905   2.913   1.622   9.982
  544    HA   PRO 906           HA       PRO 906  -1.454  -0.841   6.096
  545   1HB   PRO 906          1HB       PRO 906  -2.757  -1.852   8.265
  546   2HB   PRO 906          2HB       PRO 906  -1.162  -2.483   7.742
  547   1HG   PRO 906          1HG       PRO 906  -1.703  -0.399   9.876
  548   2HG   PRO 906          2HG       PRO 906  -0.714  -1.887  10.034
  549   1HD   PRO 906          1HD       PRO 906   0.426   0.523   9.469
  550   2HD   PRO 906          2HD       PRO 906   1.009  -0.967   8.667
  551    H    GLU 907           H        GLU 907  -1.757   1.485   8.774
  552    HA   GLU 907           HA       GLU 907  -4.564   1.978   8.417
  553   1HB   GLU 907          1HB       GLU 907  -2.298   3.510   9.734
  554   2HB   GLU 907          2HB       GLU 907  -3.983   4.085   9.734
  555   1HG   GLU 907          1HG       GLU 907  -4.446   2.721  11.459
  556   2HG   GLU 907          2HG       GLU 907  -4.007   1.317  10.461
  557    H    TRP 908           H        TRP 908  -1.646   3.032   6.791
  558    HA   TRP 908           HA       TRP 908  -2.716   5.449   5.670
  559   1HB   TRP 908          1HB       TRP 908  -0.311   4.948   5.864
  560   2HB   TRP 908          2HB       TRP 908  -0.496   3.613   4.717
  561    HD1  TRP 908           HD       TRP 908  -0.658   7.447   4.872
  562    HE1  TRP 908           1HE      TRP 908  -0.177   8.419   2.567
  563    HE3  TRP 908           3HE      TRP 908  -0.459   3.094   2.186
  564    HZ2  TRP 908           2HZ      TRP 908   0.243   7.436  -0.123
  565    HZ3  TRP 908           3HZ      TRP 908  -0.017   3.152  -0.241
  566    HH2  TRP 908           HH       TRP 908   0.334   5.309  -1.408
  567    H    ILE 909           H        ILE 909  -2.192   2.153   4.295
  568    HA   ILE 909           HA       ILE 909  -3.303   2.535   1.791
  569    HB   ILE 909           HB       ILE 909  -3.047   0.234   3.682
  570   1HG1  ILE 909          1HG1      ILE 909  -2.409  -0.239   0.898
  571   2HG1  ILE 909          2HG1      ILE 909  -1.714   1.316   1.413
  572   1HG2  ILE 909          1HG2      ILE 909  -5.160  -0.436   2.978
  573   2HG2  ILE 909          2HG2      ILE 909  -5.033   0.429   1.427
  574   3HG2  ILE 909          3HG2      ILE 909  -4.159  -1.103   1.666
  575   1HD1  ILE 909          1HD1      ILE 909  -0.028  -0.111   2.112
  576   2HD1  ILE 909          2HD1      ILE 909  -1.045  -0.116   3.572
  577   3HD1  ILE 909          3HD1      ILE 909  -1.149  -1.461   2.411
  578    H    TRP 910           H        TRP 910  -5.016   1.722   4.853
  579    HA   TRP 910           HA       TRP 910  -7.612   1.632   3.679
  580   1HB   TRP 910          1HB       TRP 910  -7.006   2.452   6.520
  581   2HB   TRP 910          2HB       TRP 910  -8.409   1.571   5.900
  582    HD1  TRP 910           HD       TRP 910  -5.767   0.892   8.054
  583    HE1  TRP 910           1HE      TRP 910  -4.933  -1.515   8.012
  584    HE3  TRP 910           3HE      TRP 910  -7.779  -0.582   3.584
  585    HZ2  TRP 910           2HZ      TRP 910  -5.111  -3.809   6.257
  586    HZ3  TRP 910           3HZ      TRP 910  -7.426  -2.881   2.762
  587    HH2  TRP 910           HH       TRP 910  -6.098  -4.503   4.082
  588    H    ALA 911           H        ALA 911  -6.333   4.145   5.929
  589    HA   ALA 911           HA       ALA 911  -8.255   6.078   5.460
  590   1HB   ALA 911          1HB       ALA 911  -5.321   6.761   5.774
  591   2HB   ALA 911          2HB       ALA 911  -6.740   7.617   6.424
  592   3HB   ALA 911          3HB       ALA 911  -6.260   6.043   7.105
  593    H    CYS 912           H        CYS 912  -5.534   5.111   3.424
  594    HA   CYS 912           HA       CYS 912  -5.670   7.412   1.680
  595   1HB   CYS 912          1HB       CYS 912  -4.427   4.648   1.389
  596   2HB   CYS 912          2HB       CYS 912  -4.219   5.972   0.216
  597    HG   CYS 912           HG       CYS 912  -3.898   6.863   3.273
  598    H    ILE 913           H        ILE 913  -6.113   3.999   0.674
  599    HA   ILE 913           HA       ILE 913  -7.634   4.421  -1.560
  600    HB   ILE 913           HB       ILE 913  -6.823   2.218  -0.837
  601   1HG1  ILE 913          1HG1      ILE 913  -9.847   2.407  -1.166
  602   2HG1  ILE 913          2HG1      ILE 913  -8.643   2.272  -2.469
  603   1HG2  ILE 913          1HG2      ILE 913  -7.237   1.446   1.240
  604   2HG2  ILE 913          2HG2      ILE 913  -8.148   2.937   1.579
  605   3HG2  ILE 913          3HG2      ILE 913  -8.991   1.504   0.941
  606   1HD1  ILE 913          1HD1      ILE 913  -8.242   0.163  -0.514
  607   2HD1  ILE 913          2HD1      ILE 913  -9.926   0.154  -1.088
  608   3HD1  ILE 913          3HD1      ILE 913  -8.588   0.028  -2.255
  609    H    ARG 914           H        ARG 914  -8.677   4.621   1.823
  610    HA   ARG 914           HA       ARG 914 -11.498   4.724   1.215
  611   1HB   ARG 914          1HB       ARG 914 -10.423   4.056   3.423
  612   2HB   ARG 914          2HB       ARG 914 -10.072   5.782   3.680
  613   1HG   ARG 914          1HG       ARG 914 -12.270   4.868   4.687
  614   2HG   ARG 914          2HG       ARG 914 -12.382   6.356   3.717
  615   1HD   ARG 914          1HD       ARG 914 -12.647   3.751   2.268
  616   2HD   ARG 914          2HD       ARG 914 -14.000   4.238   3.311
  617    HE   ARG 914           HE       ARG 914 -13.214   6.448   1.686
  618   1HH1  ARG 914          2HH2      ARG 914 -14.776   3.281   1.504
  619   2HH1  ARG 914          1HH2      ARG 914 -15.761   3.695   0.118
  620   1HH2  ARG 914          2HH1      ARG 914 -14.516   6.994  -0.144
  621   2HH2  ARG 914          1HH1      ARG 914 -15.613   5.811  -0.821
  622    H    LYS 915           H        LYS 915  -8.853   7.076   1.546
  623    HA   LYS 915           HA       LYS 915 -10.692   9.347   1.419
  624   1HB   LYS 915          1HB       LYS 915  -7.675   9.030   1.484
  625   2HB   LYS 915          2HB       LYS 915  -8.468  10.610   1.269
  626   1HG   LYS 915          1HG       LYS 915  -9.242   8.759   3.542
  627   2HG   LYS 915          2HG       LYS 915  -7.861   9.872   3.689
  628   1HD   LYS 915          1HD       LYS 915  -9.246  11.793   3.369
  629   2HD   LYS 915          2HD       LYS 915 -10.611  10.805   2.796
  630   1HE   LYS 915          1HE       LYS 915 -11.097  11.423   5.071
  631   2HE   LYS 915          2HE       LYS 915 -10.645   9.705   5.081
  632   1HZ   LYS 915          1HZ       LYS 915  -8.613  11.735   5.524
  633   2HZ   LYS 915          2HZ       LYS 915  -9.617  11.308   6.760
  634   3HZ   LYS 915          3HZ       LYS 915  -8.663  10.170   6.043
  635    H    ARG 916           H        ARG 916  -9.315   7.151  -0.780
  636    HA   ARG 916           HA       ARG 916  -9.331   7.090  -3.070
  637   1HB   ARG 916          1HB       ARG 916 -11.272   9.169  -2.382
  638   2HB   ARG 916          2HB       ARG 916 -10.480   9.484  -3.944
  639   1HG   ARG 916          1HG       ARG 916 -11.330   6.667  -3.415
  640   2HG   ARG 916          2HG       ARG 916 -12.627   7.853  -3.695
  641   1HD   ARG 916          1HD       ARG 916 -10.575   8.380  -5.606
  642   2HD   ARG 916          2HD       ARG 916 -10.852   6.625  -5.611
  643    HE   ARG 916           HE       ARG 916 -13.382   7.862  -5.624
  644   1HH1  ARG 916          2HH2      ARG 916 -10.500   7.638  -7.659
  645   2HH1  ARG 916          1HH2      ARG 916 -11.377   7.839  -9.160
  646   1HH2  ARG 916          2HH1      ARG 916 -14.540   8.127  -7.606
  647   2HH2  ARG 916          1HH1      ARG 916 -13.680   8.118  -9.129
  648    H    ARG 917           H        ARG 917  -7.654   9.189  -1.176
  649    HA   ARG 917           HA       ARG 917  -5.860   9.888  -3.402
  650   1HB   ARG 917          1HB       ARG 917  -5.876  12.240  -1.945
  651   2HB   ARG 917          2HB       ARG 917  -6.694  11.987  -3.506
  652   1HG   ARG 917          1HG       ARG 917  -8.133  11.077  -1.040
  653   2HG   ARG 917          2HG       ARG 917  -8.015  12.832  -1.314
  654   1HD   ARG 917          1HD       ARG 917  -8.709  12.102  -3.798
  655   2HD   ARG 917          2HD       ARG 917  -9.421  10.728  -2.926
  656    HE   ARG 917           HE       ARG 917 -10.329  12.862  -1.490
  657   1HH1  ARG 917          2HH2      ARG 917 -10.277  12.089  -4.940
  658   2HH1  ARG 917          1HH2      ARG 917 -11.742  12.975  -5.300
  659   1HH2  ARG 917          2HH1      ARG 917 -12.263  14.033  -1.966
  660   2HH2  ARG 917          1HH1      ARG 917 -12.874  14.084  -3.605
  661    H    LEU 918           H        LEU 918  -3.886   9.258  -2.782
  662    HA   LEU 918           HA       LEU 918  -3.072   8.157  -0.467
  663   1HB   LEU 918          1HB       LEU 918  -1.640   9.989  -2.389
  664   2HB   LEU 918          2HB       LEU 918  -0.793   9.368  -0.952
  665    HG   LEU 918           HG       LEU 918  -0.394   7.483  -2.133
  666   1HD1  LEU 918          1HD1      LEU 918  -3.430   7.259  -1.988
  667   2HD1  LEU 918          2HD1      LEU 918  -2.343   5.924  -2.439
  668   3HD1  LEU 918          3HD1      LEU 918  -2.255   6.630  -0.807
  669   1HD2  LEU 918          1HD2      LEU 918  -0.673   8.565  -4.251
  670   2HD2  LEU 918          2HD2      LEU 918  -1.632   7.068  -4.343
  671   3HD2  LEU 918          3HD2      LEU 918  -2.442   8.629  -4.066
  672    H    VAL 919           H        VAL 919  -2.919   8.681   1.634
  673    HA   VAL 919           HA       VAL 919  -3.215  11.549   2.348
  674    HB   VAL 919           HB       VAL 919  -4.349  10.859   4.224
  675   1HG1  VAL 919          1HG1      VAL 919  -4.759   9.127   1.915
  676   2HG1  VAL 919          2HG1      VAL 919  -5.134   8.268   3.428
  677   3HG1  VAL 919          3HG1      VAL 919  -5.958   9.799   3.046
  678   1HG2  VAL 919          1HG2      VAL 919  -2.193   8.884   4.289
  679   2HG2  VAL 919          2HG2      VAL 919  -3.132   9.578   5.633
  680   3HG2  VAL 919          3HG2      VAL 919  -3.754   8.163   4.750
  681    H    ALA 920           H        ALA 920  -2.245  11.311   5.006
  682    HA   ALA 920           HA       ALA 920   0.573  11.650   4.514
  683   1HB   ALA 920          1HB       ALA 920   0.687  12.184   6.867
  684   2HB   ALA 920          2HB       ALA 920  -0.807  12.900   6.217
  685   3HB   ALA 920          3HB       ALA 920  -0.883  11.400   7.172
  686    HA   PRO 921           HA       PRO 921   1.429   7.276   4.946
  687   1HB   PRO 921          1HB       PRO 921   4.035   7.398   4.160
  688   2HB   PRO 921          2HB       PRO 921   2.686   7.620   2.999
  689   1HG   PRO 921          1HG       PRO 921   4.254   9.784   4.430
  690   2HG   PRO 921          2HG       PRO 921   3.944   9.649   2.668
  691   1HD   PRO 921          1HD       PRO 921   2.380  11.202   4.272
  692   2HD   PRO 921          2HD       PRO 921   1.649  10.227   2.961
  693    H    CYS 922           H        CYS 922   1.983   6.243   6.793
  694    HA   CYS 922           HA       CYS 922   2.597   7.371   9.177
  695   1HB   CYS 922          1HB       CYS 922   2.150   5.045   9.137
  696   2HB   CYS 922          2HB       CYS 922   3.473   4.724   7.988
  697    HG   CYS 922           HG       CYS 922   3.580   4.120  10.824
  Start of MODEL   18
    1    H    GLY 835           H        GLY 835 -12.805  -2.974  11.686
    2   1HA   GLY 835          1HA       GLY 835 -15.401  -1.892  11.199
    3   2HA   GLY 835          2HA       GLY 835 -14.619  -1.005  12.527
    4    H    SER 836           H        SER 836 -13.780  -2.340   9.275
    5    HA   SER 836           HA       SER 836 -13.110   0.177   8.162
    6   1HB   SER 836          1HB       SER 836 -10.550  -0.379   8.066
    7   2HB   SER 836          2HB       SER 836 -11.218   0.408   9.516
    8    HG   SER 836           HG       SER 836  -9.830  -1.555   9.766
    9    H    ALA 837           H        ALA 837 -10.718  -2.271   7.605
   10    HA   ALA 837           HA       ALA 837 -11.044  -2.623   4.946
   11   1HB   ALA 837          1HB       ALA 837  -9.798  -4.571   5.154
   12   2HB   ALA 837          2HB       ALA 837  -9.485  -3.805   6.730
   13   3HB   ALA 837          3HB       ALA 837 -10.686  -5.111   6.600
   14    H    ASP 838           H        ASP 838 -12.623  -4.867   7.299
   15    HA   ASP 838           HA       ASP 838 -14.240  -6.254   5.562
   16   1HB   ASP 838          1HB       ASP 838 -14.965  -5.215   8.328
   17   2HB   ASP 838          2HB       ASP 838 -15.778  -6.548   7.478
   18    H    GLU 839           H        GLU 839 -14.588  -2.911   6.667
   19    HA   GLU 839           HA       GLU 839 -17.251  -2.701   5.421
   20   1HB   GLU 839          1HB       GLU 839 -15.643  -1.196   7.384
   21   2HB   GLU 839          2HB       GLU 839 -16.506  -0.165   6.217
   22   1HG   GLU 839          1HG       GLU 839 -18.106  -2.427   7.249
   23   2HG   GLU 839          2HG       GLU 839 -17.619  -1.258   8.496
   24    H    THR 840           H        THR 840 -13.860  -1.856   4.869
   25    HA   THR 840           HA       THR 840 -14.590  -0.227   2.519
   26    HB   THR 840           HB       THR 840 -11.970  -0.856   3.924
   27    HG1  THR 840           1HG      THR 840 -12.834   0.752   4.998
   28   1HG2  THR 840          1HG2      THR 840 -11.841  -0.648   1.362
   29   2HG2  THR 840          2HG2      THR 840 -12.370   1.038   1.582
   30   3HG2  THR 840          3HG2      THR 840 -10.839   0.484   2.302
   31    H    LEU 841           H        LEU 841 -12.071  -2.745   3.069
   32    HA   LEU 841           HA       LEU 841 -11.884  -3.533   0.383
   33   1HB   LEU 841          1HB       LEU 841 -10.272  -4.101   2.198
   34   2HB   LEU 841          2HB       LEU 841 -11.463  -5.242   2.866
   35    HG   LEU 841           HG       LEU 841  -9.555  -5.953   1.055
   36   1HD1  LEU 841          1HD1      LEU 841 -10.585  -7.954   1.301
   37   2HD1  LEU 841          2HD1      LEU 841 -11.808  -7.087   2.261
   38   3HD1  LEU 841          3HD1      LEU 841 -12.074  -7.364   0.523
   39   1HD2  LEU 841          1HD2      LEU 841 -11.105  -4.315  -0.483
   40   2HD2  LEU 841          2HD2      LEU 841 -10.187  -5.696  -1.129
   41   3HD2  LEU 841          3HD2      LEU 841 -11.918  -5.875  -0.755
   42    H    CYS 842           H        CYS 842 -14.613  -3.639   2.222
   43    HA   CYS 842           HA       CYS 842 -15.649  -6.246   1.780
   44   1HB   CYS 842          1HB       CYS 842 -17.629  -5.377   2.615
   45   2HB   CYS 842          2HB       CYS 842 -16.475  -4.164   3.224
   46    HG   CYS 842           HG       CYS 842 -18.997  -3.779   1.576
   47    H    GLN 843           H        GLN 843 -14.746  -3.865  -0.438
   48    HA   GLN 843           HA       GLN 843 -16.746  -4.805  -2.433
   49   1HB   GLN 843          1HB       GLN 843 -14.885  -2.470  -2.846
   50   2HB   GLN 843          2HB       GLN 843 -16.508  -2.757  -3.520
   51   1HG   GLN 843          1HG       GLN 843 -16.686  -2.714  -0.645
   52   2HG   GLN 843          2HG       GLN 843 -15.803  -1.270  -1.183
   53   1HE2  GLN 843          1HE2      GLN 843 -18.309  -1.026   0.017
   54   2HE2  GLN 843          2HE2      GLN 843 -19.479  -0.507  -1.178
   55    H    THR 844           H        THR 844 -14.775  -6.636  -1.777
   56    HA   THR 844           HA       THR 844 -12.960  -7.795  -2.600
   57    HB   THR 844           HB       THR 844 -14.911  -7.276  -4.679
   58    HG1  THR 844           1HG      THR 844 -14.792  -9.295  -4.011
   59   1HG2  THR 844          1HG2      THR 844 -11.982  -7.331  -5.446
   60   2HG2  THR 844          2HG2      THR 844 -13.219  -8.012  -6.530
   61   3HG2  THR 844          3HG2      THR 844 -13.285  -6.293  -6.075
   62    H    LYS 845           H        LYS 845 -11.072  -6.796  -2.031
   63    HA   LYS 845           HA       LYS 845  -9.342  -5.255  -2.124
   64   1HB   LYS 845          1HB       LYS 845  -9.603  -6.501  -4.865
   65   2HB   LYS 845          2HB       LYS 845  -8.301  -5.339  -4.513
   66   1HG   LYS 845          1HG       LYS 845  -7.652  -7.748  -4.125
   67   2HG   LYS 845          2HG       LYS 845  -7.485  -6.716  -2.685
   68   1HD   LYS 845          1HD       LYS 845 -10.149  -7.994  -3.042
   69   2HD   LYS 845          2HD       LYS 845  -8.806  -9.108  -2.694
   70   1HE   LYS 845          1HE       LYS 845  -8.518  -6.812  -1.001
   71   2HE   LYS 845          2HE       LYS 845 -10.201  -7.370  -0.884
   72   1HZ   LYS 845          1HZ       LYS 845  -8.180  -9.407  -0.803
   73   2HZ   LYS 845          2HZ       LYS 845  -8.229  -8.398   0.500
   74   3HZ   LYS 845          3HZ       LYS 845  -9.571  -9.256   0.070
   75    H    VAL 846           H        VAL 846 -12.259  -4.518  -3.547
   76    HA   VAL 846           HA       VAL 846 -12.978  -2.688  -4.850
   77    HB   VAL 846           HB       VAL 846 -13.419  -1.064  -3.294
   78   1HG1  VAL 846          1HG1      VAL 846 -13.260  -3.531  -2.232
   79   2HG1  VAL 846          2HG1      VAL 846 -12.024  -2.733  -1.230
   80   3HG1  VAL 846          3HG1      VAL 846 -13.691  -2.109  -1.253
   81   1HG2  VAL 846          1HG2      VAL 846 -11.696  -0.172  -1.721
   82   2HG2  VAL 846          2HG2      VAL 846 -10.519  -1.327  -2.391
   83   3HG2  VAL 846          3HG2      VAL 846 -11.191  -0.042  -3.423
   84    H    LEU 847           H        LEU 847  -9.754  -1.851  -3.449
   85    HA   LEU 847           HA       LEU 847  -7.881  -1.006  -4.479
   86   1HB   LEU 847          1HB       LEU 847  -9.374  -1.189  -7.117
   87   2HB   LEU 847          2HB       LEU 847  -7.614  -1.160  -6.852
   88    HG   LEU 847           HG       LEU 847  -8.314  -3.458  -7.293
   89   1HD1  LEU 847          1HD1      LEU 847  -7.178  -4.450  -5.518
   90   2HD1  LEU 847          2HD1      LEU 847  -6.681  -2.752  -5.321
   91   3HD1  LEU 847          3HD1      LEU 847  -7.974  -3.425  -4.299
   92   1HD2  LEU 847          1HD2      LEU 847  -9.839  -4.386  -5.266
   93   2HD2  LEU 847          2HD2      LEU 847 -10.440  -2.712  -5.322
   94   3HD2  LEU 847          3HD2      LEU 847 -10.539  -3.743  -6.770
   95    H    LEU 848           H        LEU 848  -8.981   0.510  -7.220
   96    HA   LEU 848           HA       LEU 848  -9.944   2.608  -7.625
   97   1HB   LEU 848          1HB       LEU 848 -10.415   2.305  -4.772
   98   2HB   LEU 848          2HB       LEU 848  -9.893   3.963  -5.153
   99    HG   LEU 848           HG       LEU 848 -11.985   2.579  -6.847
  100   1HD1  LEU 848          1HD1      LEU 848 -12.228   3.202  -4.052
  101   2HD1  LEU 848          2HD1      LEU 848 -13.205   4.372  -4.971
  102   3HD1  LEU 848          3HD1      LEU 848 -13.487   2.626  -5.169
  103   1HD2  LEU 848          1HD2      LEU 848 -10.962   5.361  -6.344
  104   2HD2  LEU 848          2HD2      LEU 848 -11.390   4.569  -7.880
  105   3HD2  LEU 848          3HD2      LEU 848 -12.672   5.160  -6.795
  106    H    ASP 849           H        ASP 849  -9.134   5.018  -7.141
  107    HA   ASP 849           HA       ASP 849  -6.270   4.928  -7.624
  108   1HB   ASP 849          1HB       ASP 849  -8.266   7.209  -7.375
  109   2HB   ASP 849          2HB       ASP 849  -6.562   7.406  -7.840
  110    H    ILE 850           H        ILE 850  -6.634   3.836  -5.145
  111    HA   ILE 850           HA       ILE 850  -6.527   5.762  -3.018
  112    HB   ILE 850           HB       ILE 850  -5.760   2.835  -3.261
  113   1HG1  ILE 850          1HG1      ILE 850  -7.795   2.486  -1.983
  114   2HG1  ILE 850          2HG1      ILE 850  -7.997   4.238  -1.743
  115   1HG2  ILE 850          1HG2      ILE 850  -5.598   4.751  -0.909
  116   2HG2  ILE 850          2HG2      ILE 850  -5.755   2.992  -0.690
  117   3HG2  ILE 850          3HG2      ILE 850  -4.337   3.661  -1.532
  118   1HD1  ILE 850          1HD1      ILE 850  -8.397   4.593  -4.096
  119   2HD1  ILE 850          2HD1      ILE 850  -7.930   2.921  -4.486
  120   3HD1  ILE 850          3HD1      ILE 850  -9.434   3.239  -3.587
  121    H    PHE 851           H        PHE 851  -3.914   3.453  -3.896
  122    HA   PHE 851           HA       PHE 851  -1.936   5.460  -3.074
  123   1HB   PHE 851          1HB       PHE 851  -1.357   2.725  -4.206
  124   2HB   PHE 851          2HB       PHE 851  -0.400   3.683  -3.063
  125    HD1  PHE 851           1HD      PHE 851  -0.827   3.611  -0.704
  126    HD2  PHE 851           2HD      PHE 851  -3.420   1.567  -3.451
  127    HE1  PHE 851           1HE      PHE 851  -1.882   2.405   1.190
  128    HE2  PHE 851           2HE      PHE 851  -4.474   0.360  -1.558
  129    HZ   PHE 851           HZ       PHE 851  -3.705   0.780   0.762
  130    H    THR 852           H        THR 852  -3.543   6.031  -5.451
  131    HA   THR 852           HA       THR 852  -2.683   5.508  -7.920
  132    HB   THR 852           HB       THR 852  -3.991   7.618  -6.764
  133    HG1  THR 852           1HG      THR 852  -4.602   7.247  -8.748
  134   1HG2  THR 852          1HG2      THR 852  -2.796   9.663  -7.598
  135   2HG2  THR 852          2HG2      THR 852  -1.933   8.839  -6.277
  136   3HG2  THR 852          3HG2      THR 852  -1.382   8.644  -7.959
  137    H    GLY 853           H        GLY 853  -0.691   4.874  -8.551
  138   1HA   GLY 853          1HA       GLY 853   1.519   5.115  -9.159
  139   2HA   GLY 853          2HA       GLY 853   1.442   6.814  -8.640
  140    H    VAL 854           H        VAL 854   0.659   6.461  -5.945
  141    HA   VAL 854           HA       VAL 854   2.915   6.394  -4.500
  142    HB   VAL 854           HB       VAL 854   0.114   5.603  -3.968
  143   1HG1  VAL 854          1HG1      VAL 854   0.502   4.494  -1.894
  144   2HG1  VAL 854          2HG1      VAL 854   1.573   3.679  -3.059
  145   3HG1  VAL 854          3HG1      VAL 854   2.240   4.877  -1.925
  146   1HG2  VAL 854          1HG2      VAL 854   1.237   6.938  -1.780
  147   2HG2  VAL 854          2HG2      VAL 854   2.134   7.578  -3.178
  148   3HG2  VAL 854          3HG2      VAL 854   0.359   7.692  -3.133
  149    H    ARG 855           H        ARG 855   4.650   5.100  -4.535
  150    HA   ARG 855           HA       ARG 855   4.206   2.187  -4.952
  151   1HB   ARG 855          1HB       ARG 855   6.332   2.100  -5.941
  152   2HB   ARG 855          2HB       ARG 855   5.698   3.666  -6.503
  153   1HG   ARG 855          1HG       ARG 855   6.831   4.639  -4.365
  154   2HG   ARG 855          2HG       ARG 855   7.743   3.110  -4.338
  155   1HD   ARG 855          1HD       ARG 855   9.020   3.716  -6.107
  156   2HD   ARG 855          2HD       ARG 855   7.622   4.340  -7.010
  157    HE   ARG 855           HE       ARG 855   9.408   5.850  -5.225
  158   1HH1  ARG 855          2HH2      ARG 855   6.384   5.712  -7.051
  159   2HH1  ARG 855          1HH2      ARG 855   6.180   7.449  -7.109
  160   1HH2  ARG 855          2HH1      ARG 855   9.138   8.144  -5.301
  161   2HH2  ARG 855          1HH1      ARG 855   7.751   8.835  -6.110
  162    H    LEU 856           H        LEU 856   3.747   1.556  -2.831
  163    HA   LEU 856           HA       LEU 856   5.839   2.170  -0.809
  164   1HB   LEU 856          1HB       LEU 856   4.178   2.244   0.725
  165   2HB   LEU 856          2HB       LEU 856   3.082   2.367  -0.672
  166    HG   LEU 856           HG       LEU 856   2.681   0.001  -0.680
  167   1HD1  LEU 856          1HD1      LEU 856   3.972  -1.223   1.378
  168   2HD1  LEU 856          2HD1      LEU 856   4.606  -1.180  -0.285
  169   3HD1  LEU 856          3HD1      LEU 856   5.197  -0.014   0.923
  170   1HD2  LEU 856          1HD2      LEU 856   2.760   0.316   2.279
  171   2HD2  LEU 856          2HD2      LEU 856   1.921   1.610   1.391
  172   3HD2  LEU 856          3HD2      LEU 856   1.393  -0.080   1.210
  173    H    TYR 857           H        TYR 857   7.007   0.546   0.150
  174    HA   TYR 857           HA       TYR 857   7.019  -2.018  -1.229
  175   1HB   TYR 857          1HB       TYR 857   9.167  -1.657  -0.680
  176   2HB   TYR 857          2HB       TYR 857   8.740  -0.474   0.568
  177    HD1  TYR 857           1HD      TYR 857   9.497  -0.984   2.685
  178    HD2  TYR 857           2HD      TYR 857   8.347  -4.186   0.063
  179    HE1  TYR 857           1HE      TYR 857  10.073  -2.632   4.446
  180    HE2  TYR 857           2HE      TYR 857   8.923  -5.835   1.824
  181    HH   TYR 857           HH       TYR 857   9.839  -4.871   5.101
  182    H    LEU 858           H        LEU 858   5.145  -3.148  -0.771
  183    HA   LEU 858           HA       LEU 858   4.231  -3.398   1.995
  184   1HB   LEU 858          1HB       LEU 858   2.651  -3.249   0.083
  185   2HB   LEU 858          2HB       LEU 858   3.303  -4.778  -0.555
  186    HG   LEU 858           HG       LEU 858   2.179  -6.031   0.977
  187   1HD1  LEU 858          1HD1      LEU 858   2.916  -3.815   2.920
  188   2HD1  LEU 858          2HD1      LEU 858   1.874  -5.181   3.388
  189   3HD1  LEU 858          3HD1      LEU 858   3.546  -5.479   2.855
  190   1HD2  LEU 858          1HD2      LEU 858   0.045  -5.198   1.400
  191   2HD2  LEU 858          2HD2      LEU 858   0.650  -3.585   1.846
  192   3HD2  LEU 858          3HD2      LEU 858   0.594  -4.073   0.135
  193    HA   PRO 859           HA       PRO 859   7.019  -6.858   2.565
  194   1HB   PRO 859          1HB       PRO 859   6.648  -7.102   5.253
  195   2HB   PRO 859          2HB       PRO 859   7.563  -5.731   4.545
  196   1HG   PRO 859          1HG       PRO 859   4.637  -5.775   5.338
  197   2HG   PRO 859          2HG       PRO 859   5.879  -4.576   5.827
  198   1HD   PRO 859          1HD       PRO 859   4.207  -4.115   3.723
  199   2HD   PRO 859          2HD       PRO 859   5.930  -3.639   3.634
  200    HA   PRO 860           HA       PRO 860   4.150 -10.200   2.451
  201   1HB   PRO 860          1HB       PRO 860   5.685 -12.283   3.306
  202   2HB   PRO 860          2HB       PRO 860   6.036 -11.415   1.776
  203   1HG   PRO 860          1HG       PRO 860   7.286 -10.927   4.494
  204   2HG   PRO 860          2HG       PRO 860   8.137 -11.207   2.940
  205   1HD   PRO 860          1HD       PRO 860   7.679  -8.688   3.876
  206   2HD   PRO 860          2HD       PRO 860   7.508  -9.053   2.132
  207    H    SER 861           H        SER 861   5.949  -9.525   5.450
  208    HA   SER 861           HA       SER 861   4.302 -11.159   7.147
  209   1HB   SER 861          1HB       SER 861   6.608  -9.447   7.367
  210   2HB   SER 861          2HB       SER 861   5.421  -8.984   8.610
  211    HG   SER 861           HG       SER 861   6.424 -11.591   8.091
  212    H    THR 862           H        THR 862   3.629  -8.368   5.382
  213    HA   THR 862           HA       THR 862   2.066  -6.887   7.258
  214    HB   THR 862           HB       THR 862   1.544  -7.019   4.280
  215    HG1  THR 862           1HG      THR 862   3.442  -6.217   3.928
  216   1HG2  THR 862          1HG2      THR 862   1.382  -4.472   4.804
  217   2HG2  THR 862          2HG2      THR 862   0.063  -5.528   5.363
  218   3HG2  THR 862          3HG2      THR 862   1.310  -4.980   6.509
  219    HA   PRO 863           HA       PRO 863  -1.531  -9.396   7.582
  220   1HB   PRO 863          1HB       PRO 863  -3.350  -7.537   8.393
  221   2HB   PRO 863          2HB       PRO 863  -1.954  -8.003   9.418
  222   1HG   PRO 863          1HG       PRO 863  -2.143  -5.633   7.538
  223   2HG   PRO 863          2HG       PRO 863  -1.663  -5.615   9.267
  224   1HD   PRO 863          1HD       PRO 863   0.197  -5.696   7.276
  225   2HD   PRO 863          2HD       PRO 863   0.421  -6.661   8.766
  226    H    ASP 864           H        ASP 864  -3.076 -10.115   6.176
  227    HA   ASP 864           HA       ASP 864  -4.436 -10.197   4.337
  228   1HB   ASP 864          1HB       ASP 864  -4.588  -7.364   5.219
  229   2HB   ASP 864          2HB       ASP 864  -5.077  -7.674   3.539
  230    H    PHE 865           H        PHE 865  -1.349  -9.253   4.365
  231    HA   PHE 865           HA       PHE 865  -0.594  -7.863   2.180
  232   1HB   PHE 865          1HB       PHE 865   0.880  -9.164   3.725
  233   2HB   PHE 865          2HB       PHE 865   0.448 -10.637   2.840
  234    HD1  PHE 865           1HD      PHE 865   1.913 -11.361   1.207
  235    HD2  PHE 865           2HD      PHE 865   1.720  -7.168   2.121
  236    HE1  PHE 865           1HE      PHE 865   3.743 -10.924  -0.410
  237    HE2  PHE 865           2HE      PHE 865   3.550  -6.732   0.505
  238    HZ   PHE 865           HZ       PHE 865   4.561  -8.610  -0.761
  239    H    SER 866           H        SER 866  -1.657 -11.309   2.062
  240    HA   SER 866           HA       SER 866  -1.418 -11.984  -0.525
  241   1HB   SER 866          1HB       SER 866  -3.356 -12.531   1.584
  242   2HB   SER 866          2HB       SER 866  -4.110 -12.604  -0.027
  243    HG   SER 866           HG       SER 866  -3.236 -14.582   0.308
  244    H    ARG 867           H        ARG 867  -3.552  -9.446   0.722
  245    HA   ARG 867           HA       ARG 867  -4.528  -8.944  -2.040
  246   1HB   ARG 867          1HB       ARG 867  -5.578  -7.496   0.369
  247   2HB   ARG 867          2HB       ARG 867  -6.427  -8.023  -1.103
  248   1HG   ARG 867          1HG       ARG 867  -6.806 -10.139  -0.291
  249   2HG   ARG 867          2HG       ARG 867  -5.274 -10.179   0.615
  250   1HD   ARG 867          1HD       ARG 867  -6.582  -8.194   1.950
  251   2HD   ARG 867          2HD       ARG 867  -7.960  -9.194   1.442
  252    HE   ARG 867           HE       ARG 867  -5.783  -9.969   3.287
  253   1HH1  ARG 867          2HH2      ARG 867  -8.689 -10.822   1.462
  254   2HH1  ARG 867          1HH2      ARG 867  -9.028 -12.254   2.408
  255   1HH2  ARG 867          2HH1      ARG 867  -6.232 -11.861   4.536
  256   2HH2  ARG 867          1HH1      ARG 867  -7.627 -12.846   4.161
  257    H    LEU 868           H        LEU 868  -3.631  -7.008   0.877
  258    HA   LEU 868           HA       LEU 868  -3.216  -4.557  -0.061
  259   1HB   LEU 868          1HB       LEU 868  -1.225  -6.194   1.551
  260   2HB   LEU 868          2HB       LEU 868  -1.126  -4.428   1.349
  261    HG   LEU 868           HG       LEU 868  -3.525  -5.930   2.484
  262   1HD1  LEU 868          1HD1      LEU 868  -1.340  -5.852   3.865
  263   2HD1  LEU 868          2HD1      LEU 868  -1.615  -4.097   3.969
  264   3HD1  LEU 868          3HD1      LEU 868  -2.814  -5.228   4.642
  265   1HD2  LEU 868          1HD2      LEU 868  -2.862  -3.001   2.029
  266   2HD2  LEU 868          2HD2      LEU 868  -4.293  -3.907   1.482
  267   3HD2  LEU 868          3HD2      LEU 868  -4.091  -3.520   3.207
  268    H    ARG 869           H        ARG 869  -0.904  -7.247  -0.677
  269    HA   ARG 869           HA       ARG 869   0.852  -5.691  -2.307
  270   1HB   ARG 869          1HB       ARG 869   0.887  -8.199  -1.176
  271   2HB   ARG 869          2HB       ARG 869   0.646  -8.581  -2.897
  272   1HG   ARG 869          1HG       ARG 869   2.554  -6.623  -3.067
  273   2HG   ARG 869          2HG       ARG 869   2.995  -7.388  -1.522
  274   1HD   ARG 869          1HD       ARG 869   2.784  -8.656  -4.268
  275   2HD   ARG 869          2HD       ARG 869   4.182  -8.620  -3.171
  276    HE   ARG 869           HE       ARG 869   2.099  -9.957  -1.824
  277   1HH1  ARG 869          2HH2      ARG 869   4.118 -10.342  -4.700
  278   2HH1  ARG 869          1HH2      ARG 869   4.074 -12.091  -4.665
  279   1HH2  ARG 869          2HH1      ARG 869   2.039 -12.267  -1.778
  280   2HH2  ARG 869          1HH1      ARG 869   2.888 -13.188  -2.999
  281    H    ARG 870           H        ARG 870  -0.938  -8.524  -3.559
  282    HA   ARG 870           HA       ARG 870  -0.997  -7.790  -6.207
  283   1HB   ARG 870          1HB       ARG 870  -2.069  -9.817  -4.692
  284   2HB   ARG 870          2HB       ARG 870  -3.534  -8.972  -5.247
  285   1HG   ARG 870          1HG       ARG 870  -3.078 -10.533  -6.974
  286   2HG   ARG 870          2HG       ARG 870  -2.420  -8.998  -7.591
  287   1HD   ARG 870          1HD       ARG 870  -0.796 -10.794  -7.949
  288   2HD   ARG 870          2HD       ARG 870  -0.172  -9.649  -6.741
  289    HE   ARG 870           HE       ARG 870  -0.267 -11.315  -5.130
  290   1HH1  ARG 870          2HH2      ARG 870  -2.097 -12.259  -8.004
  291   2HH1  ARG 870          1HH2      ARG 870  -2.351 -13.905  -7.469
  292   1HH2  ARG 870          2HH1      ARG 870  -0.602 -13.489  -4.424
  293   2HH2  ARG 870          1HH1      ARG 870  -1.499 -14.606  -5.428
  294    H    TYR 871           H        TYR 871  -3.032  -6.584  -3.563
  295    HA   TYR 871           HA       TYR 871  -4.925  -5.244  -5.273
  296   1HB   TYR 871          1HB       TYR 871  -5.170  -5.968  -2.818
  297   2HB   TYR 871          2HB       TYR 871  -4.224  -4.524  -2.419
  298    HD1  TYR 871           1HD      TYR 871  -7.043  -5.061  -1.467
  299    HD2  TYR 871           2HD      TYR 871  -5.548  -3.015  -4.935
  300    HE1  TYR 871           1HE      TYR 871  -9.106  -3.686  -1.546
  301    HE2  TYR 871           2HE      TYR 871  -7.610  -1.641  -5.014
  302    HH   TYR 871           HH       TYR 871 -10.252  -2.041  -2.635
  303    H    PHE 872           H        PHE 872  -2.666  -3.716  -2.923
  304    HA   PHE 872           HA       PHE 872  -2.614  -1.176  -3.808
  305   1HB   PHE 872          1HB       PHE 872  -1.206  -2.164  -1.995
  306   2HB   PHE 872          2HB       PHE 872  -0.106  -2.788  -3.235
  307    HD1  PHE 872           1HD      PHE 872   0.342  -0.709  -5.103
  308    HD2  PHE 872           2HD      PHE 872  -0.289  -0.369  -0.867
  309    HE1  PHE 872           1HE      PHE 872   1.578   1.441  -5.091
  310    HE2  PHE 872           2HE      PHE 872   0.947   1.781  -0.856
  311    HZ   PHE 872           HZ       PHE 872   1.880   2.686  -2.967
  312    H    VAL 873           H        VAL 873   0.032  -3.291  -5.007
  313    HA   VAL 873           HA       VAL 873   0.787  -1.791  -7.179
  314    HB   VAL 873           HB       VAL 873   2.093  -3.684  -6.664
  315   1HG1  VAL 873          1HG1      VAL 873   0.918  -5.283  -5.538
  316   2HG1  VAL 873          2HG1      VAL 873  -0.570  -4.979  -6.466
  317   3HG1  VAL 873          3HG1      VAL 873   0.711  -6.008  -7.151
  318   1HG2  VAL 873          1HG2      VAL 873   1.648  -3.240  -9.157
  319   2HG2  VAL 873          2HG2      VAL 873   2.276  -4.854  -8.741
  320   3HG2  VAL 873          3HG2      VAL 873   0.546  -4.637  -9.100
  321    H    ALA 874           H        ALA 874  -2.083  -3.832  -6.840
  322    HA   ALA 874           HA       ALA 874  -2.769  -4.003  -9.594
  323   1HB   ALA 874          1HB       ALA 874  -5.177  -4.050  -8.315
  324   2HB   ALA 874          2HB       ALA 874  -4.078  -5.447  -8.416
  325   3HB   ALA 874          3HB       ALA 874  -4.081  -4.421  -6.962
  326    H    PHE 875           H        PHE 875  -4.321  -1.931  -7.075
  327    HA   PHE 875           HA       PHE 875  -5.912  -0.286  -8.336
  328   1HB   PHE 875          1HB       PHE 875  -3.531   0.760  -6.767
  329   2HB   PHE 875          2HB       PHE 875  -5.045   1.632  -7.062
  330    HD1  PHE 875           1HD      PHE 875  -3.633  -1.427  -5.445
  331    HD2  PHE 875           2HD      PHE 875  -6.892   1.365  -5.628
  332    HE1  PHE 875           1HE      PHE 875  -4.610  -2.433  -3.399
  333    HE2  PHE 875           2HE      PHE 875  -7.870   0.359  -3.583
  334    HZ   PHE 875           HZ       PHE 875  -6.728  -1.540  -2.468
  335    H    ASP 876           H        ASP 876  -2.342   0.083  -8.696
  336    HA   ASP 876           HA       ASP 876  -1.970   0.351 -11.302
  337   1HB   ASP 876          1HB       ASP 876  -3.789   2.515 -10.442
  338   2HB   ASP 876          2HB       ASP 876  -2.401   3.065 -11.405
  339    H    GLY 877           H        GLY 877  -0.965   0.591  -8.338
  340   1HA   GLY 877          1HA       GLY 877   1.087   2.690  -8.729
  341   2HA   GLY 877          2HA       GLY 877   0.717   1.832  -7.215
  342    H    ASP 878           H        ASP 878   2.701   0.971  -6.706
  343    HA   ASP 878           HA       ASP 878   3.586  -1.290  -8.314
  344   1HB   ASP 878          1HB       ASP 878   5.019   1.333  -8.306
  345   2HB   ASP 878          2HB       ASP 878   6.007  -0.137  -8.163
  346    H    LEU 879           H        LEU 879   5.190  -2.581  -7.179
  347    HA   LEU 879           HA       LEU 879   5.603  -1.808  -4.344
  348   1HB   LEU 879          1HB       LEU 879   4.498  -4.471  -5.323
  349   2HB   LEU 879          2HB       LEU 879   4.961  -4.095  -3.646
  350    HG   LEU 879           HG       LEU 879   2.829  -2.643  -5.273
  351   1HD1  LEU 879          1HD1      LEU 879   1.229  -3.873  -4.124
  352   2HD1  LEU 879          2HD1      LEU 879   2.517  -5.093  -4.264
  353   3HD1  LEU 879          3HD1      LEU 879   2.309  -4.189  -2.745
  354   1HD2  LEU 879          1HD2      LEU 879   3.616  -2.376  -2.340
  355   2HD2  LEU 879          2HD2      LEU 879   4.082  -1.230  -3.619
  356   3HD2  LEU 879          3HD2      LEU 879   2.366  -1.442  -3.197
  357    H    VAL 880           H        VAL 880   7.670  -2.096  -3.746
  358    HA   VAL 880           HA       VAL 880   9.356  -3.837  -5.480
  359    HB   VAL 880           HB       VAL 880  10.972  -2.150  -3.876
  360   1HG1  VAL 880          1HG1      VAL 880  11.667  -2.759  -6.059
  361   2HG1  VAL 880          2HG1      VAL 880  10.127  -2.243  -6.787
  362   3HG1  VAL 880          3HG1      VAL 880  11.284  -1.026  -6.198
  363   1HG2  VAL 880          1HG2      VAL 880   8.462  -0.829  -4.935
  364   2HG2  VAL 880          2HG2      VAL 880   9.259  -0.615  -3.358
  365   3HG2  VAL 880          3HG2      VAL 880   9.989   0.079  -4.825
  366    H    GLN 881           H        GLN 881  10.628  -5.411  -4.548
  367    HA   GLN 881           HA       GLN 881   9.817  -6.352  -1.948
  368   1HB   GLN 881          1HB       GLN 881  12.151  -7.206  -3.706
  369   2HB   GLN 881          2HB       GLN 881  11.435  -8.135  -2.366
  370   1HG   GLN 881          1HG       GLN 881   9.411  -8.489  -3.539
  371   2HG   GLN 881          2HG       GLN 881   9.750  -7.184  -4.696
  372   1HE2  GLN 881          1HE2      GLN 881   9.898 -10.544  -4.114
  373   2HE2  GLN 881          2HE2      GLN 881  10.916 -10.995  -5.465
  374    H    GLU 882           H        GLU 882  10.736  -6.041   0.017
  375    HA   GLU 882           HA       GLU 882  12.159  -3.972   0.851
  376   1HB   GLU 882          1HB       GLU 882  11.476  -5.859   2.298
  377   2HB   GLU 882          2HB       GLU 882  12.825  -6.830   1.662
  378   1HG   GLU 882          1HG       GLU 882  14.044  -4.439   2.409
  379   2HG   GLU 882          2HG       GLU 882  12.832  -4.694   3.684
  380    H    PHE 883           H        PHE 883  13.949  -6.957  -0.124
  381    HA   PHE 883           HA       PHE 883  16.446  -5.540  -0.312
  382   1HB   PHE 883          1HB       PHE 883  17.336  -7.618  -1.044
  383   2HB   PHE 883          2HB       PHE 883  16.104  -8.000   0.170
  384    HD1  PHE 883           1HD      PHE 883  17.095  -8.299  -3.334
  385    HD2  PHE 883           2HD      PHE 883  13.913  -8.940  -0.520
  386    HE1  PHE 883           1HE      PHE 883  15.962  -9.794  -4.956
  387    HE2  PHE 883           2HE      PHE 883  12.780 -10.435  -2.142
  388    HZ   PHE 883           HZ       PHE 883  13.805 -10.862  -4.360
  389    H    ASP 884           H        ASP 884  14.002  -4.649  -1.960
  390    HA   ASP 884           HA       ASP 884  15.532  -4.061  -4.371
  391   1HB   ASP 884          1HB       ASP 884  13.030  -5.784  -4.443
  392   2HB   ASP 884          2HB       ASP 884  13.693  -4.943  -5.861
  393    H    MET 885           H        MET 885  15.307  -1.883  -3.999
  394    HA   MET 885           HA       MET 885  12.675  -0.754  -4.533
  395   1HB   MET 885          1HB       MET 885  13.477   0.639  -2.209
  396   2HB   MET 885          2HB       MET 885  12.069  -0.434  -2.395
  397   1HG   MET 885          1HG       MET 885  14.588  -1.902  -2.087
  398   2HG   MET 885          2HG       MET 885  14.252  -0.842  -0.708
  399   1HE   MET 885          1HE       MET 885  11.164  -1.533   0.675
  400   2HE   MET 885          2HE       MET 885  12.427  -2.468   1.511
  401   3HE   MET 885          3HE       MET 885  12.819  -0.888   0.791
  402    H    THR 886           H        THR 886  15.772   0.231  -2.950
  403    HA   THR 886           HA       THR 886  16.872   2.283  -3.336
  404    HB   THR 886           HB       THR 886  18.411   1.894  -5.098
  405    HG1  THR 886           1HG      THR 886  16.522   0.135  -6.270
  406   1HG2  THR 886          1HG2      THR 886  18.415   0.137  -3.345
  407   2HG2  THR 886          2HG2      THR 886  17.249  -0.810  -4.300
  408   3HG2  THR 886          3HG2      THR 886  18.890  -0.524  -4.928
  409    H    SER 887           H        SER 887  14.899   1.374  -6.213
  410    HA   SER 887           HA       SER 887  14.601   4.255  -6.834
  411   1HB   SER 887          1HB       SER 887  14.615   1.734  -8.347
  412   2HB   SER 887          2HB       SER 887  13.259   2.803  -8.782
  413    HG   SER 887           HG       SER 887  15.641   4.112  -8.441
  414    H    ALA 888           H        ALA 888  13.036   1.707  -5.188
  415    HA   ALA 888           HA       ALA 888  10.362   1.881  -5.727
  416   1HB   ALA 888          1HB       ALA 888  11.536   1.989  -2.924
  417   2HB   ALA 888          2HB       ALA 888   9.972   1.295  -3.415
  418   3HB   ALA 888          3HB       ALA 888  11.489   0.519  -3.927
  419    H    THR 889           H        THR 889   8.635   3.056  -4.353
  420    HA   THR 889           HA       THR 889   9.425   5.923  -4.125
  421    HB   THR 889           HB       THR 889   7.740   4.909  -6.001
  422    HG1  THR 889           1HG      THR 889   7.493   6.968  -6.342
  423   1HG2  THR 889          1HG2      THR 889   5.842   5.934  -3.884
  424   2HG2  THR 889          2HG2      THR 889   5.491   4.962  -5.333
  425   3HG2  THR 889          3HG2      THR 889   6.281   4.209  -3.927
  426    H    HIS 890           H        HIS 890   7.312   3.281  -2.942
  427    HA   HIS 890           HA       HIS 890   7.108   4.778  -0.372
  428   1HB   HIS 890          1HB       HIS 890   5.020   3.261  -1.943
  429   2HB   HIS 890          2HB       HIS 890   4.869   3.493  -0.192
  430    HD1  HIS 890           1HD      HIS 890   6.147   6.219  -2.611
  431    HD2  HIS 890           2HD      HIS 890   2.862   5.209  -0.182
  432    HE1  HIS 890           1HE      HIS 890   4.618   8.268  -2.553
  433    H    VAL 891           H        VAL 891   6.778   3.363   1.525
  434    HA   VAL 891           HA       VAL 891   7.512   0.540   1.162
  435    HB   VAL 891           HB       VAL 891   9.337   0.919   2.975
  436   1HG1  VAL 891          1HG1      VAL 891  10.459   2.168   0.595
  437   2HG1  VAL 891          2HG1      VAL 891  10.718   0.527   1.233
  438   3HG1  VAL 891          3HG1      VAL 891   9.344   0.854   0.150
  439   1HG2  VAL 891          1HG2      VAL 891   8.839   3.227   3.530
  440   2HG2  VAL 891          2HG2      VAL 891  10.423   3.189   2.718
  441   3HG2  VAL 891          3HG2      VAL 891   8.976   3.716   1.824
  442    H    LEU 892           H        LEU 892   6.240  -0.613   2.481
  443    HA   LEU 892           HA       LEU 892   4.682   0.726   4.532
  444   1HB   LEU 892          1HB       LEU 892   4.441  -1.581   2.947
  445   2HB   LEU 892          2HB       LEU 892   4.631  -2.187   4.609
  446    HG   LEU 892           HG       LEU 892   2.864   0.148   4.490
  447   1HD1  LEU 892          1HD1      LEU 892   2.484  -2.088   2.554
  448   2HD1  LEU 892          2HD1      LEU 892   1.049  -1.621   3.497
  449   3HD1  LEU 892          3HD1      LEU 892   1.886  -0.412   2.494
  450   1HD2  LEU 892          1HD2      LEU 892   1.554  -2.260   5.312
  451   2HD2  LEU 892          2HD2      LEU 892   3.228  -2.330   5.911
  452   3HD2  LEU 892          3HD2      LEU 892   2.188  -0.950   6.337
  453    H    GLY 893           H        GLY 893   5.369   1.119   6.548
  454   1HA   GLY 893          1HA       GLY 893   6.576   0.963   8.495
  455   2HA   GLY 893          2HA       GLY 893   6.485  -0.798   8.265
  456    H    SER 894           H        SER 894   8.540   1.919   8.379
  457    HA   SER 894           HA       SER 894  10.861   1.908   8.389
  458   1HB   SER 894          1HB       SER 894  10.646  -0.807   7.031
  459   2HB   SER 894          2HB       SER 894  12.120  -0.072   7.706
  460    HG   SER 894           HG       SER 894  11.528  -0.947   9.504
  461    H    ARG 895           H        ARG 895  12.667   1.947   6.647
  462    HA   ARG 895           HA       ARG 895  11.575   2.326   3.929
  463   1HB   ARG 895          1HB       ARG 895  12.781   4.554   3.825
  464   2HB   ARG 895          2HB       ARG 895  11.329   4.533   4.853
  465   1HG   ARG 895          1HG       ARG 895  12.631   4.405   6.857
  466   2HG   ARG 895          2HG       ARG 895  14.117   4.026   5.953
  467   1HD   ARG 895          1HD       ARG 895  13.222   6.430   4.828
  468   2HD   ARG 895          2HD       ARG 895  12.913   6.626   6.567
  469    HE   ARG 895           HE       ARG 895  15.528   5.543   6.172
  470   1HH1  ARG 895          2HH2      ARG 895  13.648   8.511   5.774
  471   2HH1  ARG 895          1HH2      ARG 895  15.026   9.572   5.963
  472   1HH2  ARG 895          2HH1      ARG 895  17.348   6.945   6.422
  473   2HH2  ARG 895          1HH1      ARG 895  17.136   8.679   6.333
  474    H    ASP 896           H        ASP 896  14.279   2.012   6.200
  475    HA   ASP 896           HA       ASP 896  16.599   2.111   5.126
  476   1HB   ASP 896          1HB       ASP 896  16.456   0.599   6.915
  477   2HB   ASP 896          2HB       ASP 896  15.278  -0.433   6.075
  478    H    LYS 897           H        LYS 897  14.992  -0.898   4.018
  479    HA   LYS 897           HA       LYS 897  16.364  -1.503   1.814
  480   1HB   LYS 897          1HB       LYS 897  13.676  -1.582   0.901
  481   2HB   LYS 897          2HB       LYS 897  14.616  -2.898   1.643
  482   1HG   LYS 897          1HG       LYS 897  12.716  -2.680   3.047
  483   2HG   LYS 897          2HG       LYS 897  13.998  -1.796   3.909
  484   1HD   LYS 897          1HD       LYS 897  13.133   0.287   2.600
  485   2HD   LYS 897          2HD       LYS 897  11.675  -0.692   2.310
  486   1HE   LYS 897          1HE       LYS 897  12.044  -1.114   4.983
  487   2HE   LYS 897          2HE       LYS 897  12.683   0.536   4.824
  488   1HZ   LYS 897          1HZ       LYS 897  10.238   0.245   5.254
  489   2HZ   LYS 897          2HZ       LYS 897  10.674   1.288   4.052
  490   3HZ   LYS 897          3HZ       LYS 897  10.107  -0.214   3.675
  491    H    ASN 898           H        ASN 898  14.158   1.281   2.081
  492    HA   ASN 898           HA       ASN 898  15.494   2.531  -0.195
  493   1HB   ASN 898          1HB       ASN 898  13.776   1.145  -1.300
  494   2HB   ASN 898          2HB       ASN 898  12.522   1.887  -0.283
  495   1HD2  ASN 898          1HD2      ASN 898  13.194   1.887  -3.314
  496   2HD2  ASN 898          2HD2      ASN 898  13.122   3.582  -3.747
  497    HA   PRO 899           HA       PRO 899  14.368   5.522   3.029
  498   1HB   PRO 899          1HB       PRO 899  16.504   7.168   2.640
  499   2HB   PRO 899          2HB       PRO 899  16.666   5.591   3.480
  500   1HG   PRO 899          1HG       PRO 899  17.192   6.177   0.552
  501   2HG   PRO 899          2HG       PRO 899  18.292   5.365   1.714
  502   1HD   PRO 899          1HD       PRO 899  16.680   3.934   0.045
  503   2HD   PRO 899          2HD       PRO 899  16.929   3.408   1.738
  504    H    ALA 900           H        ALA 900  14.676   5.561  -0.400
  505    HA   ALA 900           HA       ALA 900  13.825   8.370  -0.650
  506   1HB   ALA 900          1HB       ALA 900  13.738   7.133  -3.163
  507   2HB   ALA 900          2HB       ALA 900  15.067   8.122  -2.512
  508   3HB   ALA 900          3HB       ALA 900  15.104   6.352  -2.330
  509    H    ALA 901           H        ALA 901  12.342   5.557   0.185
  510    HA   ALA 901           HA       ALA 901   9.953   5.955  -1.510
  511   1HB   ALA 901          1HB       ALA 901   9.193   3.850  -0.515
  512   2HB   ALA 901          2HB       ALA 901  10.849   3.664  -1.142
  513   3HB   ALA 901          3HB       ALA 901  10.576   3.857   0.606
  514    H    GLN 902           H        GLN 902   8.160   4.889   0.560
  515    HA   GLN 902           HA       GLN 902   8.088   7.226   2.408
  516   1HB   GLN 902          1HB       GLN 902   6.017   6.120   0.544
  517   2HB   GLN 902          2HB       GLN 902   5.477   6.728   2.128
  518   1HG   GLN 902          1HG       GLN 902   7.093   8.244   0.039
  519   2HG   GLN 902          2HG       GLN 902   5.407   8.550   0.509
  520   1HE2  GLN 902          1HE2      GLN 902   6.000   7.969   3.391
  521   2HE2  GLN 902          2HE2      GLN 902   6.826   9.391   3.990
  522    H    GLN 903           H        GLN 903   7.840   6.721   4.519
  523    HA   GLN 903           HA       GLN 903   7.649   3.879   5.218
  524   1HB   GLN 903          1HB       GLN 903   8.267   6.447   6.690
  525   2HB   GLN 903          2HB       GLN 903   7.912   4.946   7.579
  526   1HG   GLN 903          1HG       GLN 903   9.981   4.165   7.167
  527   2HG   GLN 903          2HG       GLN 903   9.744   4.376   5.418
  528   1HE2  GLN 903          1HE2      GLN 903  10.288   6.435   4.436
  529   2HE2  GLN 903          2HE2      GLN 903  11.456   7.493   5.200
  530    H    VAL 904           H        VAL 904   5.337   4.127   4.139
  531    HA   VAL 904           HA       VAL 904   3.332   5.314   5.890
  532    HB   VAL 904           HB       VAL 904   2.003   5.112   4.075
  533   1HG1  VAL 904          1HG1      VAL 904   3.158   5.173   2.050
  534   2HG1  VAL 904          2HG1      VAL 904   4.479   5.483   3.203
  535   3HG1  VAL 904          3HG1      VAL 904   4.258   3.855   2.519
  536   1HG2  VAL 904          1HG2      VAL 904   3.022   2.250   3.995
  537   2HG2  VAL 904          2HG2      VAL 904   1.411   2.830   4.482
  538   3HG2  VAL 904          3HG2      VAL 904   1.903   2.900   2.773
  539    H    SER 905           H        SER 905   1.365   3.820   6.433
  540    HA   SER 905           HA       SER 905   2.425   1.254   7.520
  541   1HB   SER 905          1HB       SER 905   0.210   2.561   8.987
  542   2HB   SER 905          2HB       SER 905   1.676   1.761   9.602
  543    HG   SER 905           HG       SER 905   2.029   3.851  10.021
  544    HA   PRO 906           HA       PRO 906  -1.237  -0.764   6.119
  545   1HB   PRO 906          1HB       PRO 906  -2.554  -1.820   8.258
  546   2HB   PRO 906          2HB       PRO 906  -0.896  -2.342   7.817
  547   1HG   PRO 906          1HG       PRO 906  -1.681  -0.256   9.872
  548   2HG   PRO 906          2HG       PRO 906  -0.593  -1.662  10.110
  549   1HD   PRO 906          1HD       PRO 906   0.390   0.813   9.530
  550   2HD   PRO 906          2HD       PRO 906   1.116  -0.647   8.792
  551    H    GLU 907           H        GLU 907  -1.780   1.657   8.651
  552    HA   GLU 907           HA       GLU 907  -4.617   1.912   8.173
  553   1HB   GLU 907          1HB       GLU 907  -2.522   3.557   9.617
  554   2HB   GLU 907          2HB       GLU 907  -4.206   4.111   9.457
  555   1HG   GLU 907          1HG       GLU 907  -4.345   2.943  11.456
  556   2HG   GLU 907          2HG       GLU 907  -4.749   1.653  10.303
  557    H    TRP 908           H        TRP 908  -1.687   3.169   6.710
  558    HA   TRP 908           HA       TRP 908  -2.782   5.508   5.514
  559   1HB   TRP 908          1HB       TRP 908  -0.382   5.052   5.709
  560   2HB   TRP 908          2HB       TRP 908  -0.542   3.669   4.618
  561    HD1  TRP 908           HD       TRP 908  -0.855   7.506   4.592
  562    HE1  TRP 908           1HE      TRP 908  -0.336   8.387   2.260
  563    HE3  TRP 908           3HE      TRP 908  -0.338   3.043   2.139
  564    HZ2  TRP 908           2HZ      TRP 908   0.235   7.297  -0.360
  565    HZ3  TRP 908           3HZ      TRP 908   0.193   3.005  -0.270
  566    HH2  TRP 908           HH       TRP 908   0.482   5.118  -1.532
  567    H    ILE 909           H        ILE 909  -2.288   2.181   4.208
  568    HA   ILE 909           HA       ILE 909  -3.342   2.515   1.677
  569    HB   ILE 909           HB       ILE 909  -3.263   0.256   3.651
  570   1HG1  ILE 909          1HG1      ILE 909  -2.394  -0.350   0.980
  571   2HG1  ILE 909          2HG1      ILE 909  -1.747   1.247   1.427
  572   1HG2  ILE 909          1HG2      ILE 909  -5.349  -0.324   2.771
  573   2HG2  ILE 909          2HG2      ILE 909  -5.016   0.449   1.203
  574   3HG2  ILE 909          3HG2      ILE 909  -4.250  -1.106   1.609
  575   1HD1  ILE 909          1HD1      ILE 909  -0.327  -0.800   2.084
  576   2HD1  ILE 909          2HD1      ILE 909  -0.670   0.380   3.372
  577   3HD1  ILE 909          3HD1      ILE 909  -1.586  -1.144   3.294
  578    H    TRP 910           H        TRP 910  -5.203   1.563   4.627
  579    HA   TRP 910           HA       TRP 910  -7.743   1.523   3.514
  580   1HB   TRP 910          1HB       TRP 910  -6.979   2.632   6.231
  581   2HB   TRP 910          2HB       TRP 910  -8.559   1.992   5.759
  582    HD1  TRP 910           HD       TRP 910  -6.042   1.005   7.911
  583    HE1  TRP 910           1HE      TRP 910  -5.672  -1.509   8.077
  584    HE3  TRP 910           3HE      TRP 910  -8.403  -0.445   3.608
  585    HZ2  TRP 910           2HZ      TRP 910  -6.318  -3.872   6.536
  586    HZ3  TRP 910           3HZ      TRP 910  -8.505  -2.832   2.991
  587    HH2  TRP 910           HH       TRP 910  -7.470  -4.554   4.440
  588    H    ALA 911           H        ALA 911  -6.537   4.332   5.425
  589    HA   ALA 911           HA       ALA 911  -8.444   6.169   4.650
  590   1HB   ALA 911          1HB       ALA 911  -5.568   7.036   4.834
  591   2HB   ALA 911          2HB       ALA 911  -7.026   7.783   5.532
  592   3HB   ALA 911          3HB       ALA 911  -6.348   6.306   6.259
  593    H    CYS 912           H        CYS 912  -5.430   5.270   2.931
  594    HA   CYS 912           HA       CYS 912  -5.811   7.180   0.810
  595   1HB   CYS 912          1HB       CYS 912  -4.181   4.611   0.793
  596   2HB   CYS 912          2HB       CYS 912  -3.947   6.049  -0.232
  597    HG   CYS 912           HG       CYS 912  -4.212   6.827   2.825
  598    H    ILE 913           H        ILE 913  -6.835   3.850   1.450
  599    HA   ILE 913           HA       ILE 913  -7.539   3.072  -1.164
  600    HB   ILE 913           HB       ILE 913  -8.882   2.395   1.482
  601   1HG1  ILE 913          1HG1      ILE 913  -6.468   1.320  -0.004
  602   2HG1  ILE 913          2HG1      ILE 913  -6.597   1.806   1.703
  603   1HG2  ILE 913          1HG2      ILE 913  -9.627   1.779  -1.173
  604   2HG2  ILE 913          2HG2      ILE 913  -8.814   0.320  -0.559
  605   3HG2  ILE 913          3HG2      ILE 913 -10.211   0.994   0.314
  606   1HD1  ILE 913          1HD1      ILE 913  -8.566  -0.203   1.293
  607   2HD1  ILE 913          2HD1      ILE 913  -7.080  -0.789   0.506
  608   3HD1  ILE 913          3HD1      ILE 913  -7.057  -0.338   2.228
  609    H    ARG 914           H        ARG 914  -9.678   4.455   1.401
  610    HA   ARG 914           HA       ARG 914 -11.868   4.865  -0.393
  611   1HB   ARG 914          1HB       ARG 914 -11.502   4.897   2.331
  612   2HB   ARG 914          2HB       ARG 914 -11.677   6.632   1.972
  613   1HG   ARG 914          1HG       ARG 914 -13.580   4.636   0.736
  614   2HG   ARG 914          2HG       ARG 914 -13.829   5.182   2.412
  615   1HD   ARG 914          1HD       ARG 914 -13.229   7.346   0.478
  616   2HD   ARG 914          2HD       ARG 914 -14.763   6.498   0.185
  617    HE   ARG 914           HE       ARG 914 -14.760   7.016   2.908
  618   1HH1  ARG 914          2HH2      ARG 914 -14.442   8.915  -0.057
  619   2HH1  ARG 914          1HH2      ARG 914 -15.169  10.354   0.624
  620   1HH2  ARG 914          2HH1      ARG 914 -15.720   8.916   3.807
  621   2HH2  ARG 914          1HH1      ARG 914 -15.897  10.354   2.827
  622    H    LYS 915           H        LYS 915  -9.204   6.944   0.797
  623    HA   LYS 915           HA       LYS 915 -10.110   9.384  -0.286
  624   1HB   LYS 915          1HB       LYS 915  -7.357   8.252   0.291
  625   2HB   LYS 915          2HB       LYS 915  -7.595   9.907  -0.320
  626   1HG   LYS 915          1HG       LYS 915  -9.084   8.861   2.111
  627   2HG   LYS 915          2HG       LYS 915  -7.477   9.614   2.243
  628   1HD   LYS 915          1HD       LYS 915  -8.269  11.690   1.362
  629   2HD   LYS 915          2HD       LYS 915  -9.790  10.956   0.799
  630   1HE   LYS 915          1HE       LYS 915 -10.622  11.796   2.749
  631   2HE   LYS 915          2HE       LYS 915  -9.891  10.337   3.455
  632   1HZ   LYS 915          1HZ       LYS 915  -8.744  11.719   4.681
  633   2HZ   LYS 915          2HZ       LYS 915  -7.883  12.138   3.338
  634   3HZ   LYS 915          3HZ       LYS 915  -9.182  13.043   3.801
  635    H    ARG 916           H        ARG 916  -9.632   6.563  -1.934
  636    HA   ARG 916           HA       ARG 916  -9.154   6.016  -4.114
  637   1HB   ARG 916          1HB       ARG 916 -10.728   8.538  -4.114
  638   2HB   ARG 916          2HB       ARG 916  -9.921   8.132  -5.648
  639   1HG   ARG 916          1HG       ARG 916 -12.108   7.093  -5.675
  640   2HG   ARG 916          2HG       ARG 916 -10.902   5.804  -5.444
  641   1HD   ARG 916          1HD       ARG 916 -12.724   5.447  -3.876
  642   2HD   ARG 916          2HD       ARG 916 -11.286   5.963  -2.969
  643    HE   ARG 916           HE       ARG 916 -12.342   7.979  -2.437
  644   1HH1  ARG 916          2HH2      ARG 916 -14.204   6.120  -4.798
  645   2HH1  ARG 916          1HH2      ARG 916 -15.639   7.110  -4.650
  646   1HH2  ARG 916          2HH1      ARG 916 -14.237   9.287  -2.242
  647   2HH2  ARG 916          1HH1      ARG 916 -15.657   8.916  -3.192
  648    H    ARG 917           H        ARG 917  -7.203   7.875  -2.455
  649    HA   ARG 917           HA       ARG 917  -5.262   8.085  -4.634
  650   1HB   ARG 917          1HB       ARG 917  -4.811  10.456  -4.287
  651   2HB   ARG 917          2HB       ARG 917  -6.521  10.240  -4.734
  652   1HG   ARG 917          1HG       ARG 917  -6.631  11.714  -2.897
  653   2HG   ARG 917          2HG       ARG 917  -6.938  10.125  -2.158
  654   1HD   ARG 917          1HD       ARG 917  -4.834  10.022  -1.175
  655   2HD   ARG 917          2HD       ARG 917  -4.100  11.096  -2.385
  656    HE   ARG 917           HE       ARG 917  -5.335  11.869   0.111
  657   1HH1  ARG 917          2HH2      ARG 917  -4.751  12.854  -3.234
  658   2HH1  ARG 917          1HH2      ARG 917  -4.840  14.566  -2.890
  659   1HH2  ARG 917          2HH1      ARG 917  -5.453  14.132   0.565
  660   2HH2  ARG 917          1HH1      ARG 917  -5.241  15.295  -0.724
  661    H    LEU 918           H        LEU 918  -3.290   9.514  -3.386
  662    HA   LEU 918           HA       LEU 918  -2.673   7.739  -1.104
  663   1HB   LEU 918          1HB       LEU 918  -1.021   9.559  -2.886
  664   2HB   LEU 918          2HB       LEU 918  -0.361   8.771  -1.433
  665    HG   LEU 918           HG       LEU 918   0.143   7.149  -3.007
  666   1HD1  LEU 918          1HD1      LEU 918  -2.742   6.312  -2.741
  667   2HD1  LEU 918          2HD1      LEU 918  -1.263   5.331  -2.603
  668   3HD1  LEU 918          3HD1      LEU 918  -1.731   6.426  -1.280
  669   1HD2  LEU 918          1HD2      LEU 918  -1.001   6.815  -5.071
  670   2HD2  LEU 918          2HD2      LEU 918  -2.476   7.612  -4.473
  671   3HD2  LEU 918          3HD2      LEU 918  -1.019   8.576  -4.814
  672    H    VAL 919           H        VAL 919  -2.761   8.430   0.951
  673    HA   VAL 919           HA       VAL 919  -3.161  11.336   1.401
  674    HB   VAL 919           HB       VAL 919  -4.486  10.764   3.177
  675   1HG1  VAL 919          1HG1      VAL 919  -4.423   8.486   1.228
  676   2HG1  VAL 919          2HG1      VAL 919  -5.332   8.248   2.740
  677   3HG1  VAL 919          3HG1      VAL 919  -5.756   9.588   1.648
  678   1HG2  VAL 919          1HG2      VAL 919  -2.285   8.867   3.660
  679   2HG2  VAL 919          2HG2      VAL 919  -3.301   9.750   4.824
  680   3HG2  VAL 919          3HG2      VAL 919  -3.878   8.220   4.121
  681    H    ALA 920           H        ALA 920  -2.444  11.339   4.147
  682    HA   ALA 920           HA       ALA 920   0.396  11.723   3.898
  683   1HB   ALA 920          1HB       ALA 920  -1.671  12.538   5.626
  684   2HB   ALA 920          2HB       ALA 920  -0.573  11.569   6.638
  685   3HB   ALA 920          3HB       ALA 920   0.053  12.970   5.736
  686    HA   PRO 921           HA       PRO 921   1.309   7.415   4.721
  687   1HB   PRO 921          1HB       PRO 921   3.969   7.556   4.147
  688   2HB   PRO 921          2HB       PRO 921   2.719   7.652   2.864
  689   1HG   PRO 921          1HG       PRO 921   4.110   9.961   4.253
  690   2HG   PRO 921          2HG       PRO 921   3.954   9.688   2.487
  691   1HD   PRO 921          1HD       PRO 921   2.224  11.307   3.833
  692   2HD   PRO 921          2HD       PRO 921   1.630  10.217   2.544
  693    H    CYS 922           H        CYS 922   1.772   6.513   6.663
  694    HA   CYS 922           HA       CYS 922   3.731   7.797   8.443
  695   1HB   CYS 922          1HB       CYS 922   1.287   8.716   8.795
  696   2HB   CYS 922          2HB       CYS 922   1.015   7.140   9.580
  697    HG   CYS 922           HG       CYS 922   1.521   8.552  11.554
  Start of MODEL   19
    1    H    GLY 835           H        GLY 835  -9.052  -4.163   9.857
    2   1HA   GLY 835          1HA       GLY 835 -11.471  -4.721  11.462
    3   2HA   GLY 835          2HA       GLY 835 -10.433  -3.367  11.963
    4    H    SER 836           H        SER 836  -9.592  -2.523   9.353
    5    HA   SER 836           HA       SER 836 -12.065  -1.146   8.533
    6   1HB   SER 836          1HB       SER 836  -9.547  -0.233   8.935
    7   2HB   SER 836          2HB       SER 836  -9.459  -0.599   7.195
    8    HG   SER 836           HG       SER 836 -11.047   1.245   8.568
    9    H    ALA 837           H        ALA 837  -9.510  -3.285   7.216
   10    HA   ALA 837           HA       ALA 837 -10.192  -3.331   4.538
   11   1HB   ALA 837          1HB       ALA 837  -8.424  -4.670   6.025
   12   2HB   ALA 837          2HB       ALA 837  -9.659  -5.946   5.907
   13   3HB   ALA 837          3HB       ALA 837  -8.938  -5.266   4.428
   14    H    ASP 838           H        ASP 838 -11.501  -5.579   7.049
   15    HA   ASP 838           HA       ASP 838 -13.405  -6.841   5.455
   16   1HB   ASP 838          1HB       ASP 838 -12.867  -6.456   8.302
   17   2HB   ASP 838          2HB       ASP 838 -14.608  -6.568   7.964
   18    H    GLU 839           H        GLU 839 -13.296  -3.552   6.554
   19    HA   GLU 839           HA       GLU 839 -16.178  -3.201   5.910
   20   1HB   GLU 839          1HB       GLU 839 -14.198  -1.784   7.658
   21   2HB   GLU 839          2HB       GLU 839 -15.489  -0.819   6.905
   22   1HG   GLU 839          1HG       GLU 839 -16.683  -3.226   7.870
   23   2HG   GLU 839          2HG       GLU 839 -15.650  -2.596   9.171
   24    H    THR 840           H        THR 840 -13.056  -2.922   4.598
   25    HA   THR 840           HA       THR 840 -14.036  -0.894   2.642
   26    HB   THR 840           HB       THR 840 -11.190  -1.463   3.559
   27    HG1  THR 840           1HG      THR 840 -12.263  -0.297   5.095
   28   1HG2  THR 840          1HG2      THR 840 -12.220   0.770   1.771
   29   2HG2  THR 840          2HG2      THR 840 -10.530   0.313   2.090
   30   3HG2  THR 840          3HG2      THR 840 -11.574  -0.758   1.126
   31    H    LEU 841           H        LEU 841 -11.494  -3.447   2.918
   32    HA   LEU 841           HA       LEU 841 -11.625  -4.055   0.111
   33   1HB   LEU 841          1HB       LEU 841  -9.646  -4.385   1.670
   34   2HB   LEU 841          2HB       LEU 841 -10.513  -5.786   2.347
   35    HG   LEU 841           HG       LEU 841  -8.810  -5.987   0.249
   36   1HD1  LEU 841          1HD1      LEU 841 -10.703  -7.589   1.535
   37   2HD1  LEU 841          2HD1      LEU 841 -11.158  -7.699  -0.182
   38   3HD1  LEU 841          3HD1      LEU 841  -9.512  -8.139   0.332
   39   1HD2  LEU 841          1HD2      LEU 841  -9.744  -5.580  -1.800
   40   2HD2  LEU 841          2HD2      LEU 841 -11.369  -6.073  -1.269
   41   3HD2  LEU 841          3HD2      LEU 841 -10.762  -4.446  -0.880
   42    H    CYS 842           H        CYS 842 -13.828  -4.591   2.541
   43    HA   CYS 842           HA       CYS 842 -14.583  -7.298   2.200
   44   1HB   CYS 842          1HB       CYS 842 -15.588  -6.293   4.033
   45   2HB   CYS 842          2HB       CYS 842 -15.910  -4.775   3.159
   46    HG   CYS 842           HG       CYS 842 -18.087  -6.270   3.904
   47    H    GLN 843           H        GLN 843 -14.652  -4.675   0.009
   48    HA   GLN 843           HA       GLN 843 -16.910  -5.810  -1.530
   49   1HB   GLN 843          1HB       GLN 843 -15.270  -3.393  -2.303
   50   2HB   GLN 843          2HB       GLN 843 -16.971  -3.763  -2.674
   51   1HG   GLN 843          1HG       GLN 843 -16.651  -3.741   0.181
   52   2HG   GLN 843          2HG       GLN 843 -15.914  -2.262  -0.472
   53   1HE2  GLN 843          1HE2      GLN 843 -18.053  -1.824   1.073
   54   2HE2  GLN 843          2HE2      GLN 843 -19.474  -1.440   0.126
   55    H    THR 844           H        THR 844 -15.292  -7.768  -1.680
   56    HA   THR 844           HA       THR 844 -14.041  -9.072  -3.085
   57    HB   THR 844           HB       THR 844 -15.506  -7.321  -4.750
   58    HG1  THR 844           1HG      THR 844 -15.494  -9.083  -5.974
   59   1HG2  THR 844          1HG2      THR 844 -13.685  -6.032  -5.474
   60   2HG2  THR 844          2HG2      THR 844 -12.545  -7.394  -5.351
   61   3HG2  THR 844          3HG2      THR 844 -13.721  -7.336  -6.686
   62    H    LYS 845           H        LYS 845 -13.099  -5.769  -4.184
   63    HA   LYS 845           HA       LYS 845 -10.502  -6.041  -2.857
   64   1HB   LYS 845          1HB       LYS 845 -10.925  -6.445  -5.783
   65   2HB   LYS 845          2HB       LYS 845  -9.555  -5.413  -5.308
   66   1HG   LYS 845          1HG       LYS 845 -10.100  -8.208  -4.219
   67   2HG   LYS 845          2HG       LYS 845  -8.913  -7.820  -5.487
   68   1HD   LYS 845          1HD       LYS 845  -7.439  -7.519  -3.790
   69   2HD   LYS 845          2HD       LYS 845  -8.305  -5.996  -3.474
   70   1HE   LYS 845          1HE       LYS 845  -8.410  -7.034  -1.387
   71   2HE   LYS 845          2HE       LYS 845  -9.949  -7.540  -2.117
   72   1HZ   LYS 845          1HZ       LYS 845  -7.490  -9.090  -1.816
   73   2HZ   LYS 845          2HZ       LYS 845  -9.003  -9.441  -1.262
   74   3HZ   LYS 845          3HZ       LYS 845  -8.673  -9.536  -2.875
   75    H    VAL 846           H        VAL 846 -13.146  -4.300  -3.953
   76    HA   VAL 846           HA       VAL 846 -13.614  -2.063  -4.162
   77    HB   VAL 846           HB       VAL 846 -11.746  -0.787  -2.540
   78   1HG1  VAL 846          1HG1      VAL 846 -14.027  -2.233  -1.245
   79   2HG1  VAL 846          2HG1      VAL 846 -13.573  -0.514  -1.162
   80   3HG1  VAL 846          3HG1      VAL 846 -14.420  -1.142  -2.596
   81   1HG2  VAL 846          1HG2      VAL 846 -11.527  -2.375  -0.604
   82   2HG2  VAL 846          2HG2      VAL 846 -12.156  -3.672  -1.647
   83   3HG2  VAL 846          3HG2      VAL 846 -10.608  -2.887  -2.039
   84    H    LEU 847           H        LEU 847 -10.183  -1.424  -3.487
   85    HA   LEU 847           HA       LEU 847  -8.522  -0.524  -4.781
   86   1HB   LEU 847          1HB       LEU 847 -10.090  -1.258  -7.262
   87   2HB   LEU 847          2HB       LEU 847  -8.326  -1.180  -7.035
   88    HG   LEU 847           HG       LEU 847  -8.848  -3.505  -7.011
   89   1HD1  LEU 847          1HD1      LEU 847  -7.338  -3.038  -5.221
   90   2HD1  LEU 847          2HD1      LEU 847  -8.632  -2.356  -4.207
   91   3HD1  LEU 847          3HD1      LEU 847  -8.579  -4.107  -4.523
   92   1HD2  LEU 847          1HD2      LEU 847 -10.873  -3.310  -4.820
   93   2HD2  LEU 847          2HD2      LEU 847 -11.387  -2.761  -6.433
   94   3HD2  LEU 847          3HD2      LEU 847 -10.796  -4.424  -6.206
   95    H    LEU 848           H        LEU 848  -8.357   1.632  -4.713
   96    HA   LEU 848           HA       LEU 848 -10.207   3.224  -6.390
   97   1HB   LEU 848          1HB       LEU 848 -10.007   3.228  -3.429
   98   2HB   LEU 848          2HB       LEU 848  -9.958   4.833  -4.197
   99    HG   LEU 848           HG       LEU 848 -12.028   2.779  -5.017
  100   1HD1  LEU 848          1HD1      LEU 848 -11.780   4.139  -2.441
  101   2HD1  LEU 848          2HD1      LEU 848 -13.270   4.616  -3.290
  102   3HD1  LEU 848          3HD1      LEU 848 -12.947   2.898  -2.956
  103   1HD2  LEU 848          1HD2      LEU 848 -11.578   5.751  -5.265
  104   2HD2  LEU 848          2HD2      LEU 848 -12.068   4.574  -6.508
  105   3HD2  LEU 848          3HD2      LEU 848 -13.241   5.118  -5.285
  106    H    ASP 849           H        ASP 849  -9.379   5.672  -6.177
  107    HA   ASP 849           HA       ASP 849  -6.653   5.598  -7.155
  108   1HB   ASP 849          1HB       ASP 849  -7.000   8.045  -7.415
  109   2HB   ASP 849          2HB       ASP 849  -8.305   7.089  -8.149
  110    H    ILE 850           H        ILE 850  -6.707   4.600  -4.533
  111    HA   ILE 850           HA       ILE 850  -6.056   6.674  -2.630
  112    HB   ILE 850           HB       ILE 850  -4.996   4.014  -2.036
  113   1HG1  ILE 850          1HG1      ILE 850  -6.875   3.598  -3.794
  114   2HG1  ILE 850          2HG1      ILE 850  -6.955   2.711  -2.253
  115   1HG2  ILE 850          1HG2      ILE 850  -5.930   4.487   0.003
  116   2HG2  ILE 850          2HG2      ILE 850  -5.989   6.139  -0.655
  117   3HG2  ILE 850          3HG2      ILE 850  -7.437   5.105  -0.716
  118   1HD1  ILE 850          1HD1      ILE 850  -8.336   4.860  -1.486
  119   2HD1  ILE 850          2HD1      ILE 850  -8.639   5.002  -3.235
  120   3HD1  ILE 850          3HD1      ILE 850  -9.125   3.528  -2.363
  121    H    PHE 851           H        PHE 851  -3.855   3.949  -3.085
  122    HA   PHE 851           HA       PHE 851  -1.542   5.568  -2.831
  123   1HB   PHE 851          1HB       PHE 851  -1.555   2.908  -4.244
  124   2HB   PHE 851          2HB       PHE 851  -0.342   3.586  -3.145
  125    HD1  PHE 851           1HD      PHE 851  -1.542   4.241  -0.721
  126    HD2  PHE 851           2HD      PHE 851  -2.658   1.070  -3.395
  127    HE1  PHE 851           1HE      PHE 851  -2.564   3.005   1.171
  128    HE2  PHE 851           2HE      PHE 851  -3.680  -0.166  -1.503
  129    HZ   PHE 851           HZ       PHE 851  -3.632   0.802   0.780
  130    H    THR 852           H        THR 852  -3.459   6.445  -4.960
  131    HA   THR 852           HA       THR 852  -2.867   5.997  -7.546
  132    HB   THR 852           HB       THR 852  -4.071   8.030  -6.187
  133    HG1  THR 852           1HG      THR 852  -4.676   8.627  -8.176
  134   1HG2  THR 852          1HG2      THR 852  -1.951   9.201  -5.772
  135   2HG2  THR 852          2HG2      THR 852  -1.570   9.166  -7.510
  136   3HG2  THR 852          3HG2      THR 852  -2.943  10.133  -6.919
  137    H    GLY 853           H        GLY 853  -0.915   5.323  -8.296
  138   1HA   GLY 853          1HA       GLY 853   1.283   5.441  -8.944
  139   2HA   GLY 853          2HA       GLY 853   1.149   7.206  -8.769
  140    H    VAL 854           H        VAL 854   0.495   5.011  -6.081
  141    HA   VAL 854           HA       VAL 854   2.842   6.155  -4.678
  142    HB   VAL 854           HB       VAL 854   0.234   4.889  -3.813
  143   1HG1  VAL 854          1HG1      VAL 854   2.293   3.927  -2.581
  144   2HG1  VAL 854          2HG1      VAL 854   2.517   5.568  -1.929
  145   3HG1  VAL 854          3HG1      VAL 854   1.023   4.667  -1.578
  146   1HG2  VAL 854          1HG2      VAL 854  -0.151   7.146  -3.824
  147   2HG2  VAL 854          2HG2      VAL 854   0.700   7.087  -2.262
  148   3HG2  VAL 854          3HG2      VAL 854   1.581   7.545  -3.738
  149    H    ARG 855           H        ARG 855   4.616   4.941  -5.153
  150    HA   ARG 855           HA       ARG 855   4.364   2.010  -5.271
  151   1HB   ARG 855          1HB       ARG 855   6.440   2.038  -6.324
  152   2HB   ARG 855          2HB       ARG 855   5.776   3.614  -6.820
  153   1HG   ARG 855          1HG       ARG 855   6.929   4.599  -4.758
  154   2HG   ARG 855          2HG       ARG 855   7.779   3.042  -4.604
  155   1HD   ARG 855          1HD       ARG 855   9.027   4.840  -5.905
  156   2HD   ARG 855          2HD       ARG 855   8.813   3.294  -6.754
  157    HE   ARG 855           HE       ARG 855   6.618   4.845  -7.484
  158   1HH1  ARG 855          2HH2      ARG 855  10.141   5.088  -7.659
  159   2HH1  ARG 855          1HH2      ARG 855  10.139   6.049  -9.120
  160   1HH2  ARG 855          2HH1      ARG 855   6.616   6.115  -9.415
  161   2HH2  ARG 855          1HH1      ARG 855   8.129   6.635 -10.122
  162    H    LEU 856           H        LEU 856   3.959   1.375  -3.144
  163    HA   LEU 856           HA       LEU 856   6.062   2.104  -1.165
  164   1HB   LEU 856          1HB       LEU 856   4.455   2.100   0.459
  165   2HB   LEU 856          2HB       LEU 856   3.381   2.429  -0.922
  166    HG   LEU 856           HG       LEU 856   2.852   0.062  -1.142
  167   1HD1  LEU 856          1HD1      LEU 856   3.887  -1.248   1.049
  168   2HD1  LEU 856          2HD1      LEU 856   4.576  -1.321  -0.591
  169   3HD1  LEU 856          3HD1      LEU 856   5.236  -0.176   0.602
  170   1HD2  LEU 856          1HD2      LEU 856   1.856   1.611   0.760
  171   2HD2  LEU 856          2HD2      LEU 856   1.484  -0.130   0.741
  172   3HD2  LEU 856          3HD2      LEU 856   2.734   0.501   1.840
  173    H    TYR 857           H        TYR 857   7.216   0.502  -0.133
  174    HA   TYR 857           HA       TYR 857   7.274  -2.080  -1.456
  175   1HB   TYR 857          1HB       TYR 857   9.394  -1.656  -0.819
  176   2HB   TYR 857          2HB       TYR 857   8.888  -0.533   0.455
  177    HD1  TYR 857           1HD      TYR 857   8.280  -4.203  -0.095
  178    HD2  TYR 857           2HD      TYR 857   9.871  -1.139   2.462
  179    HE1  TYR 857           1HE      TYR 857   8.811  -5.911   1.622
  180    HE2  TYR 857           2HE      TYR 857  10.402  -2.848   4.179
  181    HH   TYR 857           HH       TYR 857  10.471  -5.087   4.672
  182    H    LEU 858           H        LEU 858   5.437  -3.272  -1.078
  183    HA   LEU 858           HA       LEU 858   4.292  -3.442   1.593
  184   1HB   LEU 858          1HB       LEU 858   2.956  -3.529  -0.531
  185   2HB   LEU 858          2HB       LEU 858   3.711  -5.100  -0.891
  186    HG   LEU 858           HG       LEU 858   2.431  -6.193   0.637
  187   1HD1  LEU 858          1HD1      LEU 858   3.597  -5.354   2.563
  188   2HD1  LEU 858          2HD1      LEU 858   2.866  -3.741   2.383
  189   3HD1  LEU 858          3HD1      LEU 858   1.862  -5.122   2.888
  190   1HD2  LEU 858          1HD2      LEU 858   0.252  -5.381   0.712
  191   2HD2  LEU 858          2HD2      LEU 858   0.774  -3.712   1.046
  192   3HD2  LEU 858          3HD2      LEU 858   0.926  -4.380  -0.597
  193    HA   PRO 859           HA       PRO 859   7.205  -6.665   2.687
  194   1HB   PRO 859          1HB       PRO 859   6.567  -6.761   5.334
  195   2HB   PRO 859          2HB       PRO 859   7.467  -5.379   4.628
  196   1HG   PRO 859          1HG       PRO 859   4.482  -5.569   5.121
  197   2HG   PRO 859          2HG       PRO 859   5.591  -4.260   5.647
  198   1HD   PRO 859          1HD       PRO 859   4.127  -4.048   3.357
  199   2HD   PRO 859          2HD       PRO 859   5.818  -3.464   3.410
  200    HA   PRO 860           HA       PRO 860   4.439 -10.097   2.358
  201   1HB   PRO 860          1HB       PRO 860   6.146 -12.125   2.988
  202   2HB   PRO 860          2HB       PRO 860   6.348 -11.148   1.498
  203   1HG   PRO 860          1HG       PRO 860   7.735 -10.743   4.164
  204   2HG   PRO 860          2HG       PRO 860   8.502 -10.876   2.548
  205   1HD   PRO 860          1HD       PRO 860   7.953  -8.452   3.666
  206   2HD   PRO 860          2HD       PRO 860   7.696  -8.723   1.915
  207    H    SER 861           H        SER 861   6.122  -9.148   5.272
  208    HA   SER 861           HA       SER 861   4.765 -11.095   6.972
  209   1HB   SER 861          1HB       SER 861   6.976  -9.248   7.165
  210   2HB   SER 861          2HB       SER 861   5.836  -8.953   8.500
  211    HG   SER 861           HG       SER 861   7.205 -10.576   9.132
  212    H    THR 862           H        THR 862   4.010  -8.089   5.500
  213    HA   THR 862           HA       THR 862   2.359  -6.956   7.540
  214    HB   THR 862           HB       THR 862   3.097  -6.430   4.791
  215    HG1  THR 862           1HG      THR 862   3.307  -5.105   6.709
  216   1HG2  THR 862          1HG2      THR 862   0.864  -5.283   4.246
  217   2HG2  THR 862          2HG2      THR 862   0.896  -7.057   4.094
  218   3HG2  THR 862          3HG2      THR 862   0.150  -6.299   5.522
  219    HA   PRO 863           HA       PRO 863  -1.135  -9.627   7.357
  220   1HB   PRO 863          1HB       PRO 863  -3.002  -8.025   8.528
  221   2HB   PRO 863          2HB       PRO 863  -1.589  -8.652   9.438
  222   1HG   PRO 863          1HG       PRO 863  -1.852  -5.953   8.083
  223   2HG   PRO 863          2HG       PRO 863  -1.365  -6.276   9.779
  224   1HD   PRO 863          1HD       PRO 863   0.487  -5.895   7.816
  225   2HD   PRO 863          2HD       PRO 863   0.745  -7.138   9.078
  226    H    ASP 864           H        ASP 864  -2.793 -10.053   5.926
  227    HA   ASP 864           HA       ASP 864  -4.244  -9.754   4.176
  228   1HB   ASP 864          1HB       ASP 864  -4.274  -7.237   5.580
  229   2HB   ASP 864          2HB       ASP 864  -4.351  -6.931   3.831
  230    H    PHE 865           H        PHE 865  -1.133  -9.466   4.113
  231    HA   PHE 865           HA       PHE 865  -0.275  -7.807   2.072
  232   1HB   PHE 865          1HB       PHE 865   1.068  -9.400   3.514
  233   2HB   PHE 865          2HB       PHE 865   0.567 -10.700   2.419
  234    HD1  PHE 865           1HD      PHE 865   2.041  -7.243   2.206
  235    HD2  PHE 865           2HD      PHE 865   2.037 -11.278   0.733
  236    HE1  PHE 865           1HE      PHE 865   3.922  -6.690   0.688
  237    HE2  PHE 865           2HE      PHE 865   3.919 -10.725  -0.785
  238    HZ   PHE 865           HZ       PHE 865   4.862  -8.432  -0.807
  239    H    SER 866           H        SER 866  -1.439 -11.206   1.671
  240    HA   SER 866           HA       SER 866  -1.358 -11.650  -0.952
  241   1HB   SER 866          1HB       SER 866  -2.557 -13.236   0.274
  242   2HB   SER 866          2HB       SER 866  -3.636 -12.017   0.992
  243    HG   SER 866           HG       SER 866  -4.562 -11.736  -1.067
  244    H    ARG 867           H        ARG 867  -3.944  -9.591   0.502
  245    HA   ARG 867           HA       ARG 867  -4.801  -8.687  -2.127
  246   1HB   ARG 867          1HB       ARG 867  -5.541  -7.450   0.535
  247   2HB   ARG 867          2HB       ARG 867  -6.505  -7.544  -0.959
  248   1HG   ARG 867          1HG       ARG 867  -7.486  -9.308   0.129
  249   2HG   ARG 867          2HG       ARG 867  -6.079 -10.192  -0.510
  250   1HD   ARG 867          1HD       ARG 867  -5.075  -9.046   1.804
  251   2HD   ARG 867          2HD       ARG 867  -6.744  -9.445   2.266
  252    HE   ARG 867           HE       ARG 867  -5.308 -11.594   0.893
  253   1HH1  ARG 867          2HH2      ARG 867  -6.125 -10.056   3.970
  254   2HH1  ARG 867          1HH2      ARG 867  -5.835 -11.495   4.922
  255   1HH2  ARG 867          2HH1      ARG 867  -4.925 -13.494   2.151
  256   2HH2  ARG 867          1HH1      ARG 867  -5.150 -13.455   3.885
  257    H    LEU 868           H        LEU 868  -3.311  -7.113   0.763
  258    HA   LEU 868           HA       LEU 868  -2.928  -4.574   0.022
  259   1HB   LEU 868          1HB       LEU 868  -0.883  -6.518   1.136
  260   2HB   LEU 868          2HB       LEU 868  -0.559  -4.774   0.984
  261    HG   LEU 868           HG       LEU 868  -2.625  -6.185   2.691
  262   1HD1  LEU 868          1HD1      LEU 868  -1.097  -5.622   4.254
  263   2HD1  LEU 868          2HD1      LEU 868  -0.147  -4.707   3.059
  264   3HD1  LEU 868          3HD1      LEU 868  -1.480  -3.914   3.932
  265   1HD2  LEU 868          1HD2      LEU 868  -3.557  -3.856   3.114
  266   2HD2  LEU 868          2HD2      LEU 868  -2.646  -3.312   1.686
  267   3HD2  LEU 868          3HD2      LEU 868  -3.929  -4.533   1.511
  268    H    ARG 869           H        ARG 869  -0.843  -7.253  -1.202
  269    HA   ARG 869           HA       ARG 869   0.696  -5.655  -2.956
  270   1HB   ARG 869          1HB       ARG 869   1.048  -8.089  -2.168
  271   2HB   ARG 869          2HB       ARG 869  -0.072  -8.539  -3.476
  272   1HG   ARG 869          1HG       ARG 869   1.689  -8.470  -4.888
  273   2HG   ARG 869          2HG       ARG 869   1.725  -6.707  -4.646
  274   1HD   ARG 869          1HD       ARG 869   3.911  -7.433  -4.078
  275   2HD   ARG 869          2HD       ARG 869   3.094  -7.202  -2.517
  276    HE   ARG 869           HE       ARG 869   3.124  -9.512  -2.157
  277   1HH1  ARG 869          2HH2      ARG 869   4.185  -8.690  -5.428
  278   2HH1  ARG 869          1HH2      ARG 869   4.802 -10.289  -5.777
  279   1HH2  ARG 869          2HH1      ARG 869   3.939 -11.625  -2.618
  280   2HH2  ARG 869          1HH1      ARG 869   4.662 -11.962  -4.175
  281    H    ARG 870           H        ARG 870  -1.327  -8.180  -4.396
  282    HA   ARG 870           HA       ARG 870  -1.810  -7.061  -6.810
  283   1HB   ARG 870          1HB       ARG 870  -2.636  -9.280  -6.050
  284   2HB   ARG 870          2HB       ARG 870  -3.916  -8.466  -5.120
  285   1HG   ARG 870          1HG       ARG 870  -4.894  -9.112  -7.223
  286   2HG   ARG 870          2HG       ARG 870  -4.631  -7.353  -7.301
  287   1HD   ARG 870          1HD       ARG 870  -2.219  -8.360  -8.212
  288   2HD   ARG 870          2HD       ARG 870  -3.389  -9.524  -8.869
  289    HE   ARG 870           HE       ARG 870  -4.480  -7.034  -9.426
  290   1HH1  ARG 870          2HH2      ARG 870  -1.436  -8.708 -10.087
  291   2HH1  ARG 870          1HH2      ARG 870  -1.153  -7.882 -11.603
  292   1HH2  ARG 870          2HH1      ARG 870  -4.106  -5.944 -11.429
  293   2HH2  ARG 870          1HH1      ARG 870  -2.675  -6.307 -12.368
  294    H    TYR 871           H        TYR 871  -3.881  -6.481  -3.910
  295    HA   TYR 871           HA       TYR 871  -5.693  -4.701  -5.018
  296   1HB   TYR 871          1HB       TYR 871  -5.608  -5.650  -2.669
  297   2HB   TYR 871          2HB       TYR 871  -4.414  -4.398  -2.286
  298    HD1  TYR 871           1HD      TYR 871  -7.543  -4.229  -4.350
  299    HD2  TYR 871           2HD      TYR 871  -5.459  -2.906  -0.835
  300    HE1  TYR 871           1HE      TYR 871  -9.375  -2.630  -3.866
  301    HE2  TYR 871           2HE      TYR 871  -7.291  -1.307  -0.350
  302    HH   TYR 871           HH       TYR 871 -10.001  -1.251  -1.063
  303    H    PHE 872           H        PHE 872  -2.815  -3.628  -3.119
  304    HA   PHE 872           HA       PHE 872  -2.852  -0.960  -3.783
  305   1HB   PHE 872          1HB       PHE 872  -1.271  -2.205  -2.242
  306   2HB   PHE 872          2HB       PHE 872  -0.337  -2.649  -3.681
  307    HD1  PHE 872           1HD      PHE 872   0.229  -0.547  -5.269
  308    HD2  PHE 872           2HD      PHE 872  -0.574  -0.350  -1.054
  309    HE1  PHE 872           1HE      PHE 872   1.459   1.602  -5.135
  310    HE2  PHE 872           2HE      PHE 872   0.656   1.799  -0.920
  311    HZ   PHE 872           HZ       PHE 872   1.672   2.776  -2.961
  312    H    VAL 873           H        VAL 873  -0.153  -2.641  -5.299
  313    HA   VAL 873           HA       VAL 873   0.263  -1.196  -7.486
  314    HB   VAL 873           HB       VAL 873   1.618  -3.034  -7.531
  315   1HG1  VAL 873          1HG1      VAL 873  -0.806  -4.775  -6.903
  316   2HG1  VAL 873          2HG1      VAL 873   0.894  -5.300  -6.919
  317   3HG1  VAL 873          3HG1      VAL 873   0.334  -4.136  -5.695
  318   1HG2  VAL 873          1HG2      VAL 873  -0.505  -4.427  -9.156
  319   2HG2  VAL 873          2HG2      VAL 873   0.134  -2.866  -9.725
  320   3HG2  VAL 873          3HG2      VAL 873   1.234  -4.245  -9.486
  321    H    ALA 874           H        ALA 874  -2.521  -3.393  -7.089
  322    HA   ALA 874           HA       ALA 874  -3.529  -3.275  -9.714
  323   1HB   ALA 874          1HB       ALA 874  -5.795  -3.457  -8.268
  324   2HB   ALA 874          2HB       ALA 874  -4.666  -4.821  -8.454
  325   3HB   ALA 874          3HB       ALA 874  -4.616  -3.819  -6.984
  326    H    PHE 875           H        PHE 875  -4.381  -1.227  -6.862
  327    HA   PHE 875           HA       PHE 875  -6.213   0.479  -7.884
  328   1HB   PHE 875          1HB       PHE 875  -3.723   1.363  -6.388
  329   2HB   PHE 875          2HB       PHE 875  -5.270   2.223  -6.461
  330    HD1  PHE 875           1HD      PHE 875  -5.970  -1.218  -6.368
  331    HD2  PHE 875           2HD      PHE 875  -4.693   2.023  -3.855
  332    HE1  PHE 875           1HE      PHE 875  -6.757  -2.458  -4.369
  333    HE2  PHE 875           2HE      PHE 875  -5.479   0.783  -1.856
  334    HZ   PHE 875           HZ       PHE 875  -6.510  -1.457  -2.113
  335    H    ASP 876           H        ASP 876  -2.669   0.723  -8.475
  336    HA   ASP 876           HA       ASP 876  -2.475   1.279 -11.052
  337   1HB   ASP 876          1HB       ASP 876  -4.075   3.433  -9.803
  338   2HB   ASP 876          2HB       ASP 876  -2.744   4.000 -10.835
  339    H    GLY 877           H        GLY 877  -1.233   1.109  -8.179
  340   1HA   GLY 877          1HA       GLY 877   0.953   3.084  -8.581
  341   2HA   GLY 877          2HA       GLY 877   0.574   2.232  -7.066
  342    H    ASP 878           H        ASP 878   2.619   1.323  -6.756
  343    HA   ASP 878           HA       ASP 878   3.154  -1.042  -8.399
  344   1HB   ASP 878          1HB       ASP 878   4.809   1.449  -8.468
  345   2HB   ASP 878          2HB       ASP 878   5.670  -0.104  -8.404
  346    H    LEU 879           H        LEU 879   4.789  -2.441  -7.394
  347    HA   LEU 879           HA       LEU 879   5.303  -1.770  -4.542
  348   1HB   LEU 879          1HB       LEU 879   4.370  -4.482  -5.553
  349   2HB   LEU 879          2HB       LEU 879   4.622  -3.983  -3.863
  350    HG   LEU 879           HG       LEU 879   2.488  -3.033  -5.806
  351   1HD1  LEU 879          1HD1      LEU 879   2.639  -4.627  -3.274
  352   2HD1  LEU 879          2HD1      LEU 879   1.238  -3.548  -3.475
  353   3HD1  LEU 879          3HD1      LEU 879   1.563  -4.819  -4.678
  354   1HD2  LEU 879          1HD2      LEU 879   2.629  -0.990  -4.850
  355   2HD2  LEU 879          2HD2      LEU 879   2.114  -1.754  -3.327
  356   3HD2  LEU 879          3HD2      LEU 879   3.847  -1.557  -3.683
  357    H    VAL 880           H        VAL 880   7.395  -2.008  -4.025
  358    HA   VAL 880           HA       VAL 880   9.107  -3.533  -5.915
  359    HB   VAL 880           HB       VAL 880  10.476  -1.962  -3.865
  360   1HG1  VAL 880          1HG1      VAL 880  11.593  -1.053  -5.859
  361   2HG1  VAL 880          2HG1      VAL 880  11.450  -2.822  -5.992
  362   3HG1  VAL 880          3HG1      VAL 880  10.343  -1.768  -6.905
  363   1HG2  VAL 880          1HG2      VAL 880   8.830  -0.339  -3.788
  364   2HG2  VAL 880          2HG2      VAL 880   9.691   0.198  -5.250
  365   3HG2  VAL 880          3HG2      VAL 880   8.195  -0.755  -5.398
  366    H    GLN 881           H        GLN 881  11.193  -4.358  -4.608
  367    HA   GLN 881           HA       GLN 881  10.086  -6.068  -2.442
  368   1HB   GLN 881          1HB       GLN 881  12.657  -6.500  -3.990
  369   2HB   GLN 881          2HB       GLN 881  11.716  -7.685  -3.054
  370   1HG   GLN 881          1HG       GLN 881   9.827  -7.400  -4.666
  371   2HG   GLN 881          2HG       GLN 881  10.846  -6.305  -5.626
  372   1HE2  GLN 881          1HE2      GLN 881  10.184  -9.631  -4.720
  373   2HE2  GLN 881          2HE2      GLN 881  11.309 -10.383  -5.832
  374    H    GLU 882           H        GLU 882  10.887  -5.943  -0.405
  375    HA   GLU 882           HA       GLU 882  12.042  -3.883   0.781
  376   1HB   GLU 882          1HB       GLU 882  11.522  -6.092   1.853
  377   2HB   GLU 882          2HB       GLU 882  13.079  -6.705   1.246
  378   1HG   GLU 882          1HG       GLU 882  14.008  -4.492   2.399
  379   2HG   GLU 882          2HG       GLU 882  12.524  -4.644   3.365
  380    H    PHE 883           H        PHE 883  14.241  -6.501  -0.384
  381    HA   PHE 883           HA       PHE 883  16.529  -4.761  -0.313
  382   1HB   PHE 883          1HB       PHE 883  17.693  -6.638  -1.314
  383   2HB   PHE 883          2HB       PHE 883  16.625  -7.216  -0.023
  384    HD1  PHE 883           1HD      PHE 883  14.620  -8.522  -0.535
  385    HD2  PHE 883           2HD      PHE 883  17.263  -7.178  -3.643
  386    HE1  PHE 883           1HE      PHE 883  13.566 -10.112  -2.120
  387    HE2  PHE 883           2HE      PHE 883  16.208  -8.768  -5.228
  388    HZ   PHE 883           HZ       PHE 883  14.360 -10.235  -4.466
  389    H    ASP 884           H        ASP 884  13.926  -4.446  -2.192
  390    HA   ASP 884           HA       ASP 884  15.541  -3.418  -4.460
  391   1HB   ASP 884          1HB       ASP 884  13.021  -5.109  -4.670
  392   2HB   ASP 884          2HB       ASP 884  13.818  -4.281  -6.026
  393    H    MET 885           H        MET 885  15.247  -1.333  -3.499
  394    HA   MET 885           HA       MET 885  12.548  -0.239  -4.043
  395   1HB   MET 885          1HB       MET 885  13.205   1.173  -1.823
  396   2HB   MET 885          2HB       MET 885  12.208  -0.301  -1.785
  397   1HG   MET 885          1HG       MET 885  14.427  -1.586  -1.585
  398   2HG   MET 885          2HG       MET 885  15.174  -0.018  -1.234
  399   1HE   MET 885          1HE       MET 885  11.476  -1.382   0.367
  400   2HE   MET 885          2HE       MET 885  12.535  -2.494  -0.533
  401   3HE   MET 885          3HE       MET 885  12.414  -2.619   1.238
  402    H    THR 886           H        THR 886  16.030   0.225  -3.448
  403    HA   THR 886           HA       THR 886  16.836   2.634  -3.617
  404    HB   THR 886           HB       THR 886  18.423   2.164  -5.302
  405    HG1  THR 886           1HG      THR 886  16.600   0.282  -6.391
  406   1HG2  THR 886          1HG2      THR 886  18.286   0.484  -3.391
  407   2HG2  THR 886          2HG2      THR 886  17.410  -0.593  -4.504
  408   3HG2  THR 886          3HG2      THR 886  19.085  -0.112  -4.865
  409    H    SER 887           H        SER 887  14.943   1.368  -6.412
  410    HA   SER 887           HA       SER 887  14.510   4.156  -7.305
  411   1HB   SER 887          1HB       SER 887  14.548   1.472  -8.549
  412   2HB   SER 887          2HB       SER 887  13.234   2.531  -9.117
  413    HG   SER 887           HG       SER 887  16.021   3.044  -9.105
  414    H    ALA 888           H        ALA 888  13.026   1.646  -5.481
  415    HA   ALA 888           HA       ALA 888  10.338   1.769  -6.030
  416   1HB   ALA 888          1HB       ALA 888  10.979   0.333  -4.292
  417   2HB   ALA 888          2HB       ALA 888  11.891   1.606  -3.444
  418   3HB   ALA 888          3HB       ALA 888  10.111   1.627  -3.430
  419    H    THR 889           H        THR 889   8.670   2.924  -4.448
  420    HA   THR 889           HA       THR 889   9.401   5.814  -4.390
  421    HB   THR 889           HB       THR 889   7.636   4.738  -6.137
  422    HG1  THR 889           1HG      THR 889   7.362   7.182  -4.714
  423   1HG2  THR 889          1HG2      THR 889   5.515   4.469  -5.317
  424   2HG2  THR 889          2HG2      THR 889   6.372   4.167  -3.787
  425   3HG2  THR 889          3HG2      THR 889   5.700   5.779  -4.127
  426    H    HIS 890           H        HIS 890   7.394   3.181  -3.010
  427    HA   HIS 890           HA       HIS 890   7.403   4.701  -0.449
  428   1HB   HIS 890          1HB       HIS 890   5.127   3.270  -1.839
  429   2HB   HIS 890          2HB       HIS 890   5.115   3.589  -0.095
  430    HD1  HIS 890           1HD      HIS 890   6.224   6.037  -2.898
  431    HD2  HIS 890           2HD      HIS 890   3.364   5.510   0.144
  432    HE1  HIS 890           1HE      HIS 890   4.875   8.206  -2.773
  433    H    VAL 891           H        VAL 891   6.882   3.195   1.439
  434    HA   VAL 891           HA       VAL 891   7.638   0.392   0.980
  435    HB   VAL 891           HB       VAL 891   9.376   0.694   2.893
  436   1HG1  VAL 891          1HG1      VAL 891  10.843   0.381   1.205
  437   2HG1  VAL 891          2HG1      VAL 891   9.514   0.733   0.075
  438   3HG1  VAL 891          3HG1      VAL 891  10.595   2.041   0.612
  439   1HG2  VAL 891          1HG2      VAL 891  10.475   3.019   2.644
  440   2HG2  VAL 891          2HG2      VAL 891   8.939   3.532   1.906
  441   3HG2  VAL 891          3HG2      VAL 891   8.965   2.936   3.583
  442    H    LEU 892           H        LEU 892   6.513  -0.906   2.325
  443    HA   LEU 892           HA       LEU 892   4.855   0.388   4.383
  444   1HB   LEU 892          1HB       LEU 892   4.453  -1.681   2.561
  445   2HB   LEU 892          2HB       LEU 892   4.660  -2.526   4.114
  446    HG   LEU 892           HG       LEU 892   3.021  -0.147   4.458
  447   1HD1  LEU 892          1HD1      LEU 892   2.597  -1.681   2.010
  448   2HD1  LEU 892          2HD1      LEU 892   1.183  -1.780   3.086
  449   3HD1  LEU 892          3HD1      LEU 892   1.794  -0.192   2.562
  450   1HD2  LEU 892          1HD2      LEU 892   3.081  -3.027   5.123
  451   2HD2  LEU 892          2HD2      LEU 892   2.548  -1.642   6.105
  452   3HD2  LEU 892          3HD2      LEU 892   1.441  -2.369   4.916
  453    H    GLY 893           H        GLY 893   4.985  -0.026   6.579
  454   1HA   GLY 893          1HA       GLY 893   5.791  -1.044   8.527
  455   2HA   GLY 893          2HA       GLY 893   6.926  -2.006   7.553
  456    H    SER 894           H        SER 894   8.734  -0.731   6.474
  457    HA   SER 894           HA       SER 894   9.523   1.611   8.131
  458   1HB   SER 894          1HB       SER 894  11.205  -0.820   7.412
  459   2HB   SER 894          2HB       SER 894  11.855   0.684   8.109
  460    HG   SER 894           HG       SER 894  11.142  -1.187   9.540
  461    H    ARG 895           H        ARG 895  12.056   1.928   6.858
  462    HA   ARG 895           HA       ARG 895  11.397   2.221   3.989
  463   1HB   ARG 895          1HB       ARG 895  12.199   4.589   4.067
  464   2HB   ARG 895          2HB       ARG 895  10.691   4.333   4.978
  465   1HG   ARG 895          1HG       ARG 895  11.720   5.229   6.776
  466   2HG   ARG 895          2HG       ARG 895  12.769   3.792   6.811
  467   1HD   ARG 895          1HD       ARG 895  14.319   4.906   5.220
  468   2HD   ARG 895          2HD       ARG 895  13.283   6.349   5.238
  469    HE   ARG 895           HE       ARG 895  14.342   5.386   7.828
  470   1HH1  ARG 895          2HH2      ARG 895  14.459   7.682   5.141
  471   2HH1  ARG 895          1HH2      ARG 895  15.392   8.872   6.020
  472   1HH2  ARG 895          2HH1      ARG 895  15.574   6.959   8.988
  473   2HH2  ARG 895          1HH1      ARG 895  16.028   8.460   8.213
  474    H    ASP 896           H        ASP 896  13.701   2.184   6.680
  475    HA   ASP 896           HA       ASP 896  16.133   2.655   5.971
  476   1HB   ASP 896          1HB       ASP 896  15.887   1.143   7.764
  477   2HB   ASP 896          2HB       ASP 896  15.075  -0.069   6.750
  478    H    LYS 897           H        LYS 897  15.169  -0.565   4.720
  479    HA   LYS 897           HA       LYS 897  16.927  -1.000   2.777
  480   1HB   LYS 897          1HB       LYS 897  14.454  -1.409   1.438
  481   2HB   LYS 897          2HB       LYS 897  15.410  -2.599   2.354
  482   1HG   LYS 897          1HG       LYS 897  13.305  -2.615   3.437
  483   2HG   LYS 897          2HG       LYS 897  14.299  -1.553   4.462
  484   1HD   LYS 897          1HD       LYS 897  13.394   0.376   2.961
  485   2HD   LYS 897          2HD       LYS 897  12.151  -0.796   2.464
  486   1HE   LYS 897          1HE       LYS 897  12.116  -1.136   5.176
  487   2HE   LYS 897          2HE       LYS 897  12.542   0.586   5.067
  488   1HZ   LYS 897          1HZ       LYS 897  10.103  -0.156   5.057
  489   2HZ   LYS 897          2HZ       LYS 897  10.591   1.068   4.065
  490   3HZ   LYS 897          3HZ       LYS 897  10.360  -0.447   3.455
  491    H    ASN 898           H        ASN 898  14.417   1.516   2.630
  492    HA   ASN 898           HA       ASN 898  15.944   2.890   0.555
  493   1HB   ASN 898          1HB       ASN 898  14.048   1.099  -0.321
  494   2HB   ASN 898          2HB       ASN 898  13.108   2.604  -0.219
  495   1HD2  ASN 898          1HD2      ASN 898  12.913   3.174  -2.353
  496   2HD2  ASN 898          2HD2      ASN 898  14.270   3.479  -3.415
  497    HA   PRO 899           HA       PRO 899  14.029   5.770   3.489
  498   1HB   PRO 899          1HB       PRO 899  15.993   7.654   3.352
  499   2HB   PRO 899          2HB       PRO 899  16.217   6.118   4.251
  500   1HG   PRO 899          1HG       PRO 899  17.079   6.726   1.409
  501   2HG   PRO 899          2HG       PRO 899  18.090   6.066   2.735
  502   1HD   PRO 899          1HD       PRO 899  16.907   4.433   0.901
  503   2HD   PRO 899          2HD       PRO 899  16.974   3.961   2.627
  504    H    ALA 900           H        ALA 900  14.836   5.821   0.136
  505    HA   ALA 900           HA       ALA 900  13.796   8.513  -0.348
  506   1HB   ALA 900          1HB       ALA 900  14.537   8.210  -2.533
  507   2HB   ALA 900          2HB       ALA 900  15.661   7.160  -1.637
  508   3HB   ALA 900          3HB       ALA 900  14.270   6.450  -2.491
  509    H    ALA 901           H        ALA 901  12.454   5.521   0.360
  510    HA   ALA 901           HA       ALA 901  10.100   5.949  -1.393
  511   1HB   ALA 901          1HB       ALA 901  10.778   3.710  -1.544
  512   2HB   ALA 901          2HB       ALA 901  11.205   3.620   0.181
  513   3HB   ALA 901          3HB       ALA 901   9.495   3.647  -0.312
  514    H    GLN 902           H        GLN 902   8.015   6.197  -0.538
  515    HA   GLN 902           HA       GLN 902   7.855   7.651   1.912
  516   1HB   GLN 902          1HB       GLN 902   6.185   7.021  -0.318
  517   2HB   GLN 902          2HB       GLN 902   5.305   6.561   1.159
  518   1HG   GLN 902          1HG       GLN 902   6.210   9.252   0.225
  519   2HG   GLN 902          2HG       GLN 902   4.744   8.790   1.118
  520   1HE2  GLN 902          1HE2      GLN 902   5.661   7.505   3.338
  521   2HE2  GLN 902          2HE2      GLN 902   6.655   8.570   4.308
  522    H    GLN 903           H        GLN 903   7.661   6.973   3.967
  523    HA   GLN 903           HA       GLN 903   7.483   4.086   4.463
  524   1HB   GLN 903          1HB       GLN 903   8.903   6.116   5.630
  525   2HB   GLN 903          2HB       GLN 903   7.518   5.983   6.741
  526   1HG   GLN 903          1HG       GLN 903   7.914   3.541   6.922
  527   2HG   GLN 903          2HG       GLN 903   9.311   3.693   5.835
  528   1HE2  GLN 903          1HE2      GLN 903  11.110   3.394   7.041
  529   2HE2  GLN 903          2HE2      GLN 903  11.450   4.196   8.560
  530    H    VAL 904           H        VAL 904   5.326   3.597   3.891
  531    HA   VAL 904           HA       VAL 904   3.235   4.947   5.516
  532    HB   VAL 904           HB       VAL 904   1.921   4.780   3.696
  533   1HG1  VAL 904          1HG1      VAL 904   3.051   4.375   1.537
  534   2HG1  VAL 904          2HG1      VAL 904   4.072   5.369   2.604
  535   3HG1  VAL 904          3HG1      VAL 904   4.429   3.638   2.390
  536   1HG2  VAL 904          1HG2      VAL 904   1.300   2.516   4.134
  537   2HG2  VAL 904          2HG2      VAL 904   1.778   2.549   2.420
  538   3HG2  VAL 904          3HG2      VAL 904   2.898   1.903   3.643
  539    H    SER 905           H        SER 905   1.331   3.299   5.981
  540    HA   SER 905           HA       SER 905   2.536   0.768   6.988
  541   1HB   SER 905          1HB       SER 905   1.768   1.131   9.109
  542   2HB   SER 905          2HB       SER 905   1.916   2.838   8.626
  543    HG   SER 905           HG       SER 905  -0.281   2.745   7.983
  544    HA   PRO 906           HA       PRO 906  -1.107  -1.335   5.659
  545   1HB   PRO 906          1HB       PRO 906  -2.328  -2.480   7.809
  546   2HB   PRO 906          2HB       PRO 906  -0.668  -2.940   7.308
  547   1HG   PRO 906          1HG       PRO 906  -1.455  -0.927   9.434
  548   2HG   PRO 906          2HG       PRO 906  -0.318  -2.303   9.607
  549   1HD   PRO 906          1HD       PRO 906   0.571   0.214   9.058
  550   2HD   PRO 906          2HD       PRO 906   1.319  -1.206   8.265
  551    H    GLU 907           H        GLU 907  -1.707   0.916   8.357
  552    HA   GLU 907           HA       GLU 907  -4.543   1.129   7.882
  553   1HB   GLU 907          1HB       GLU 907  -2.485   2.683   9.459
  554   2HB   GLU 907          2HB       GLU 907  -4.151   3.285   9.287
  555   1HG   GLU 907          1HG       GLU 907  -4.110   1.979  11.297
  556   2HG   GLU 907          2HG       GLU 907  -4.936   0.992  10.072
  557    H    TRP 908           H        TRP 908  -1.681   2.466   6.416
  558    HA   TRP 908           HA       TRP 908  -2.851   4.877   5.397
  559   1HB   TRP 908          1HB       TRP 908  -0.430   4.487   5.592
  560   2HB   TRP 908          2HB       TRP 908  -0.537   3.192   4.392
  561    HD1  TRP 908           HD       TRP 908  -0.962   7.005   4.678
  562    HE1  TRP 908           1HE      TRP 908  -0.475   8.089   2.425
  563    HE3  TRP 908           3HE      TRP 908  -0.336   2.774   1.865
  564    HZ2  TRP 908           2HZ      TRP 908   0.115   7.233  -0.276
  565    HZ3  TRP 908           3HZ      TRP 908   0.187   2.949  -0.540
  566    HH2  TRP 908           HH       TRP 908   0.415   5.165  -1.624
  567    H    ILE 909           H        ILE 909  -2.071   1.745   3.774
  568    HA   ILE 909           HA       ILE 909  -3.142   2.138   1.305
  569    HB   ILE 909           HB       ILE 909  -2.981  -0.198   3.157
  570   1HG1  ILE 909          1HG1      ILE 909  -2.267  -0.675   0.407
  571   2HG1  ILE 909          2HG1      ILE 909  -1.605   0.901   0.903
  572   1HG2  ILE 909          1HG2      ILE 909  -4.129  -1.624   1.423
  573   2HG2  ILE 909          2HG2      ILE 909  -5.228  -0.520   2.284
  574   3HG2  ILE 909          3HG2      ILE 909  -4.687  -0.130   0.633
  575   1HD1  ILE 909          1HD1      ILE 909   0.062  -0.678   1.528
  576   2HD1  ILE 909          2HD1      ILE 909  -0.801  -0.309   3.040
  577   3HD1  ILE 909          3HD1      ILE 909  -1.145  -1.821   2.166
  578    H    TRP 910           H        TRP 910  -5.027   1.190   4.232
  579    HA   TRP 910           HA       TRP 910  -7.555   1.196   2.938
  580   1HB   TRP 910          1HB       TRP 910  -7.051   1.906   5.832
  581   2HB   TRP 910          2HB       TRP 910  -8.467   1.114   5.127
  582    HD1  TRP 910           HD       TRP 910  -5.862   0.259   7.306
  583    HE1  TRP 910           1HE      TRP 910  -5.161  -2.187   7.213
  584    HE3  TRP 910           3HE      TRP 910  -7.955  -1.011   2.811
  585    HZ2  TRP 910           2HZ      TRP 910  -5.466  -4.432   5.412
  586    HZ3  TRP 910           3HZ      TRP 910  -7.729  -3.309   1.942
  587    HH2  TRP 910           HH       TRP 910  -6.491  -5.027   3.226
  588    H    ALA 911           H        ALA 911  -6.484   3.604   5.391
  589    HA   ALA 911           HA       ALA 911  -8.312   5.574   4.908
  590   1HB   ALA 911          1HB       ALA 911  -5.383   5.662   5.636
  591   2HB   ALA 911          2HB       ALA 911  -6.306   7.171   5.436
  592   3HB   ALA 911          3HB       ALA 911  -6.807   5.976   6.657
  593    H    CYS 912           H        CYS 912  -5.563   4.664   2.875
  594    HA   CYS 912           HA       CYS 912  -5.712   7.001   1.178
  595   1HB   CYS 912          1HB       CYS 912  -4.479   4.263   0.667
  596   2HB   CYS 912          2HB       CYS 912  -4.134   5.766  -0.225
  597    HG   CYS 912           HG       CYS 912  -2.650   4.581   2.112
  598    H    ILE 913           H        ILE 913  -6.052   3.621   0.049
  599    HA   ILE 913           HA       ILE 913  -7.573   4.074  -2.174
  600    HB   ILE 913           HB       ILE 913  -6.721   1.870  -1.558
  601   1HG1  ILE 913          1HG1      ILE 913  -9.762   1.959  -1.763
  602   2HG1  ILE 913          2HG1      ILE 913  -8.614   1.953  -3.124
  603   1HG2  ILE 913          1HG2      ILE 913  -7.043   1.027   0.507
  604   2HG2  ILE 913          2HG2      ILE 913  -7.992   2.475   0.920
  605   3HG2  ILE 913          3HG2      ILE 913  -8.806   1.035   0.262
  606   1HD1  ILE 913          1HD1      ILE 913  -8.103  -0.238  -1.244
  607   2HD1  ILE 913          2HD1      ILE 913  -9.753  -0.299  -1.908
  608   3HD1  ILE 913          3HD1      ILE 913  -8.352  -0.291  -3.006
  609    H    ARG 914           H        ARG 914  -8.632   4.179   1.200
  610    HA   ARG 914           HA       ARG 914 -11.456   4.203   0.582
  611   1HB   ARG 914          1HB       ARG 914 -10.623   3.456   2.761
  612   2HB   ARG 914          2HB       ARG 914  -9.896   5.055   3.053
  613   1HG   ARG 914          1HG       ARG 914 -12.647   5.437   2.311
  614   2HG   ARG 914          2HG       ARG 914 -12.580   4.203   3.592
  615   1HD   ARG 914          1HD       ARG 914 -11.300   5.676   5.029
  616   2HD   ARG 914          2HD       ARG 914 -11.125   6.872   3.727
  617    HE   ARG 914           HE       ARG 914 -13.845   6.632   3.989
  618   1HH1  ARG 914          2HH2      ARG 914 -11.182   7.240   6.234
  619   2HH1  ARG 914          1HH2      ARG 914 -12.143   8.211   7.326
  620   1HH2  ARG 914          2HH1      ARG 914 -15.115   7.915   5.432
  621   2HH2  ARG 914          1HH1      ARG 914 -14.386   8.596   6.869
  622    H    LYS 915           H        LYS 915  -8.869   6.600   0.873
  623    HA   LYS 915           HA       LYS 915 -10.802   8.819   0.775
  624   1HB   LYS 915          1HB       LYS 915  -7.778   8.640   0.992
  625   2HB   LYS 915          2HB       LYS 915  -8.649  10.182   0.812
  626   1HG   LYS 915          1HG       LYS 915  -9.424   8.186   2.958
  627   2HG   LYS 915          2HG       LYS 915  -8.109   9.356   3.222
  628   1HD   LYS 915          1HD       LYS 915  -9.588  11.223   2.872
  629   2HD   LYS 915          2HD       LYS 915 -10.888  10.161   2.280
  630   1HE   LYS 915          1HE       LYS 915 -11.522  10.575   4.505
  631   2HE   LYS 915          2HE       LYS 915 -10.693   9.007   4.610
  632   1HZ   LYS 915          1HZ       LYS 915  -8.700  10.227   5.231
  633   2HZ   LYS 915          2HZ       LYS 915  -9.557  11.636   5.247
  634   3HZ   LYS 915          3HZ       LYS 915  -9.929  10.432   6.312
  635    H    ARG 916           H        ARG 916  -9.327   6.701  -1.391
  636    HA   ARG 916           HA       ARG 916  -9.164   6.699  -3.674
  637   1HB   ARG 916          1HB       ARG 916 -11.014   9.020  -3.172
  638   2HB   ARG 916          2HB       ARG 916 -10.379   8.752  -4.813
  639   1HG   ARG 916          1HG       ARG 916 -12.497   7.558  -4.575
  640   2HG   ARG 916          2HG       ARG 916 -11.172   6.373  -4.675
  641   1HD   ARG 916          1HD       ARG 916 -12.698   5.739  -2.873
  642   2HD   ARG 916          2HD       ARG 916 -11.141   6.246  -2.184
  643    HE   ARG 916           HE       ARG 916 -12.448   8.558  -2.025
  644   1HH1  ARG 916          2HH2      ARG 916 -13.593   5.275  -1.385
  645   2HH1  ARG 916          1HH2      ARG 916 -14.763   5.770  -0.182
  646   1HH2  ARG 916          2HH1      ARG 916 -13.993   9.212  -0.436
  647   2HH2  ARG 916          1HH1      ARG 916 -14.990   8.015   0.359
  648    H    ARG 917           H        ARG 917  -7.658   8.793  -1.650
  649    HA   ARG 917           HA       ARG 917  -5.788   9.625  -3.767
  650   1HB   ARG 917          1HB       ARG 917  -5.941  11.921  -2.232
  651   2HB   ARG 917          2HB       ARG 917  -6.690  11.699  -3.832
  652   1HG   ARG 917          1HG       ARG 917  -8.194  10.654  -1.461
  653   2HG   ARG 917          2HG       ARG 917  -8.120  12.421  -1.664
  654   1HD   ARG 917          1HD       ARG 917  -8.745  11.896  -4.159
  655   2HD   ARG 917          2HD       ARG 917  -9.294  10.336  -3.508
  656    HE   ARG 917           HE       ARG 917 -11.070  11.406  -2.441
  657   1HH1  ARG 917          2HH2      ARG 917  -8.766  13.743  -3.755
  658   2HH1  ARG 917          1HH2      ARG 917  -9.815  15.122  -3.509
  659   1HH2  ARG 917          2HH1      ARG 917 -12.455  13.227  -2.116
  660   2HH2  ARG 917          1HH1      ARG 917 -11.918  14.827  -2.574
  661    H    LEU 918           H        LEU 918  -3.836   8.997  -3.078
  662    HA   LEU 918           HA       LEU 918  -3.088   7.850  -0.771
  663   1HB   LEU 918          1HB       LEU 918  -1.638   9.768  -2.585
  664   2HB   LEU 918          2HB       LEU 918  -0.831   9.172  -1.114
  665    HG   LEU 918           HG       LEU 918  -0.314   7.293  -2.251
  666   1HD1  LEU 918          1HD1      LEU 918  -2.245   6.359  -1.108
  667   2HD1  LEU 918          2HD1      LEU 918  -3.346   7.010  -2.345
  668   3HD1  LEU 918          3HD1      LEU 918  -2.210   5.705  -2.764
  669   1HD2  LEU 918          1HD2      LEU 918  -2.131   8.543  -4.321
  670   2HD2  LEU 918          2HD2      LEU 918  -0.373   8.270  -4.389
  671   3HD2  LEU 918          3HD2      LEU 918  -1.495   6.898  -4.560
  672    H    VAL 919           H        VAL 919  -3.112   8.301   1.349
  673    HA   VAL 919           HA       VAL 919  -3.497  11.132   2.148
  674    HB   VAL 919           HB       VAL 919  -4.784  10.344   3.851
  675   1HG1  VAL 919          1HG1      VAL 919  -4.840   7.585   2.742
  676   2HG1  VAL 919          2HG1      VAL 919  -6.172   8.736   3.007
  677   3HG1  VAL 919          3HG1      VAL 919  -5.141   8.884   1.563
  678   1HG2  VAL 919          1HG2      VAL 919  -4.055   7.822   4.679
  679   2HG2  VAL 919          2HG2      VAL 919  -2.494   8.482   4.136
  680   3HG2  VAL 919          3HG2      VAL 919  -3.434   9.334   5.384
  681    H    ALA 920           H        ALA 920  -2.636  10.930   4.804
  682    HA   ALA 920           HA       ALA 920   0.182  11.333   4.473
  683   1HB   ALA 920          1HB       ALA 920   0.057  11.397   7.053
  684   2HB   ALA 920          2HB       ALA 920  -0.887  12.610   6.154
  685   3HB   ALA 920          3HB       ALA 920  -1.698  11.184   6.843
  686    HA   PRO 921           HA       PRO 921   1.137   6.963   4.785
  687   1HB   PRO 921          1HB       PRO 921   3.750   7.175   4.042
  688   2HB   PRO 921          2HB       PRO 921   2.412   7.388   2.866
  689   1HG   PRO 921          1HG       PRO 921   3.899   9.559   4.372
  690   2HG   PRO 921          2HG       PRO 921   3.619   9.458   2.603
  691   1HD   PRO 921          1HD       PRO 921   1.989  10.928   4.219
  692   2HD   PRO 921          2HD       PRO 921   1.304   9.965   2.875
  693    H    CYS 922           H        CYS 922   1.679   5.908   6.622
  694    HA   CYS 922           HA       CYS 922   3.789   6.998   8.361
  695   1HB   CYS 922          1HB       CYS 922   1.356   7.883   8.945
  696   2HB   CYS 922          2HB       CYS 922   1.178   6.262   9.661
  697    HG   CYS 922           HG       CYS 922   2.102   8.615  11.098
  Start of MODEL   20
    1    H    GLY 835           H        GLY 835  -7.288   0.121  12.393
    2   1HA   GLY 835          1HA       GLY 835  -6.786  -0.990  10.091
    3   2HA   GLY 835          2HA       GLY 835  -8.088  -1.697  11.075
    4    H    SER 836           H        SER 836 -10.280  -1.294  10.535
    5    HA   SER 836           HA       SER 836 -12.049  -0.765   9.172
    6   1HB   SER 836          1HB       SER 836 -10.125   1.347   8.673
    7   2HB   SER 836          2HB       SER 836 -10.985   0.928   7.172
    8    HG   SER 836           HG       SER 836 -12.396   1.213   9.588
    9    H    ALA 837           H        ALA 837  -9.613  -2.675   8.545
   10    HA   ALA 837           HA       ALA 837  -9.346  -3.007   5.786
   11   1HB   ALA 837          1HB       ALA 837  -8.199  -4.224   7.766
   12   2HB   ALA 837          2HB       ALA 837  -9.590  -5.334   7.707
   13   3HB   ALA 837          3HB       ALA 837  -8.527  -5.162   6.289
   14    H    ASP 838           H        ASP 838 -11.944  -4.087   7.989
   15    HA   ASP 838           HA       ASP 838 -13.346  -5.396   5.753
   16   1HB   ASP 838          1HB       ASP 838 -14.854  -6.202   7.443
   17   2HB   ASP 838          2HB       ASP 838 -13.201  -6.393   8.066
   18    H    GLU 839           H        GLU 839 -12.864  -2.295   6.486
   19    HA   GLU 839           HA       GLU 839 -15.711  -1.486   6.243
   20   1HB   GLU 839          1HB       GLU 839 -13.209  -0.236   7.312
   21   2HB   GLU 839          2HB       GLU 839 -14.423   0.841   6.582
   22   1HG   GLU 839          1HG       GLU 839 -15.881  -0.986   8.172
   23   2HG   GLU 839          2HG       GLU 839 -14.475  -0.519   9.153
   24    H    THR 840           H        THR 840 -12.831  -1.963   4.437
   25    HA   THR 840           HA       THR 840 -14.014  -0.392   2.202
   26    HB   THR 840           HB       THR 840 -12.178   0.893   2.105
   27    HG1  THR 840           1HG      THR 840 -11.091  -0.458   0.828
   28   1HG2  THR 840          1HG2      THR 840 -11.416  -0.809   4.497
   29   2HG2  THR 840          2HG2      THR 840 -10.344   0.478   3.895
   30   3HG2  THR 840          3HG2      THR 840 -11.981   0.879   4.468
   31    H    LEU 841           H        LEU 841 -11.141  -2.523   2.590
   32    HA   LEU 841           HA       LEU 841 -11.503  -3.859   0.138
   33   1HB   LEU 841          1HB       LEU 841  -9.379  -4.031   1.142
   34   2HB   LEU 841          2HB       LEU 841 -10.058  -4.521   2.712
   35    HG   LEU 841           HG       LEU 841  -9.053  -6.248   0.782
   36   1HD1  LEU 841          1HD1      LEU 841 -10.856  -6.476   3.176
   37   2HD1  LEU 841          2HD1      LEU 841 -10.604  -7.925   2.174
   38   3HD1  LEU 841          3HD1      LEU 841  -9.212  -7.111   2.929
   39   1HD2  LEU 841          1HD2      LEU 841 -11.424  -5.524  -0.314
   40   2HD2  LEU 841          2HD2      LEU 841 -10.734  -7.154  -0.496
   41   3HD2  LEU 841          3HD2      LEU 841 -11.980  -6.847   0.738
   42    H    CYS 842           H        CYS 842 -13.268  -4.091   3.085
   43    HA   CYS 842           HA       CYS 842 -14.041  -6.747   3.248
   44   1HB   CYS 842          1HB       CYS 842 -14.925  -5.424   4.932
   45   2HB   CYS 842          2HB       CYS 842 -15.376  -4.114   3.813
   46    HG   CYS 842           HG       CYS 842 -17.468  -4.987   2.942
   47    H    GLN 843           H        GLN 843 -14.409  -4.637   0.590
   48    HA   GLN 843           HA       GLN 843 -16.719  -6.165  -0.472
   49   1HB   GLN 843          1HB       GLN 843 -15.454  -3.881  -1.943
   50   2HB   GLN 843          2HB       GLN 843 -17.169  -4.338  -1.803
   51   1HG   GLN 843          1HG       GLN 843 -16.084  -3.681   0.808
   52   2HG   GLN 843          2HG       GLN 843 -15.789  -2.349  -0.330
   53   1HE2  GLN 843          1HE2      GLN 843 -18.296  -4.451   1.101
   54   2HE2  GLN 843          2HE2      GLN 843 -19.639  -3.368   0.805
   55    H    THR 844           H        THR 844 -14.724  -7.881  -0.342
   56    HA   THR 844           HA       THR 844 -13.618  -9.372  -1.701
   57    HB   THR 844           HB       THR 844 -15.177  -7.821  -3.544
   58    HG1  THR 844           1HG      THR 844 -15.173  -9.777  -4.591
   59   1HG2  THR 844          1HG2      THR 844 -12.260  -8.062  -4.161
   60   2HG2  THR 844          2HG2      THR 844 -13.392  -8.464  -5.473
   61   3HG2  THR 844          3HG2      THR 844 -13.445  -6.855  -4.713
   62    H    LYS 845           H        LYS 845 -12.868  -6.300  -3.415
   63    HA   LYS 845           HA       LYS 845 -10.220  -6.216  -2.142
   64   1HB   LYS 845          1HB       LYS 845 -10.578  -7.569  -4.584
   65   2HB   LYS 845          2HB       LYS 845  -9.919  -5.976  -5.027
   66   1HG   LYS 845          1HG       LYS 845  -8.098  -7.584  -4.575
   67   2HG   LYS 845          2HG       LYS 845  -8.099  -6.274  -3.369
   68   1HD   LYS 845          1HD       LYS 845  -9.820  -8.540  -2.609
   69   2HD   LYS 845          2HD       LYS 845  -8.111  -8.999  -2.802
   70   1HE   LYS 845          1HE       LYS 845  -7.425  -7.198  -1.288
   71   2HE   LYS 845          2HE       LYS 845  -9.108  -6.644  -1.148
   72   1HZ   LYS 845          1HZ       LYS 845  -8.016  -9.209  -0.237
   73   2HZ   LYS 845          2HZ       LYS 845  -8.565  -7.970   0.703
   74   3HZ   LYS 845          3HZ       LYS 845  -9.621  -8.829  -0.228
   75    H    VAL 846           H        VAL 846 -12.938  -4.834  -3.719
   76    HA   VAL 846           HA       VAL 846 -13.377  -2.696  -4.502
   77    HB   VAL 846           HB       VAL 846 -13.478  -1.252  -2.706
   78   1HG1  VAL 846          1HG1      VAL 846 -13.632  -3.979  -2.083
   79   2HG1  VAL 846          2HG1      VAL 846 -12.615  -3.297  -0.791
   80   3HG1  VAL 846          3HG1      VAL 846 -14.241  -2.636  -1.087
   81   1HG2  VAL 846          1HG2      VAL 846 -11.693  -0.765  -1.212
   82   2HG2  VAL 846          2HG2      VAL 846 -10.874  -2.307  -1.558
   83   3HG2  VAL 846          3HG2      VAL 846 -10.904  -1.020  -2.787
   84    H    LEU 847           H        LEU 847 -10.054  -2.606  -3.082
   85    HA   LEU 847           HA       LEU 847  -8.095  -1.771  -3.920
   86   1HB   LEU 847          1HB       LEU 847  -9.373  -1.739  -6.666
   87   2HB   LEU 847          2HB       LEU 847  -7.665  -1.996  -6.235
   88    HG   LEU 847           HG       LEU 847  -8.655  -4.147  -6.812
   89   1HD1  LEU 847          1HD1      LEU 847  -8.757  -4.566  -3.911
   90   2HD1  LEU 847          2HD1      LEU 847  -7.582  -5.171  -5.103
   91   3HD1  LEU 847          3HD1      LEU 847  -7.377  -3.551  -4.394
   92   1HD2  LEU 847          1HD2      LEU 847 -11.014  -3.136  -6.012
   93   2HD2  LEU 847          2HD2      LEU 847 -10.712  -4.890  -6.069
   94   3HD2  LEU 847          3HD2      LEU 847 -10.589  -4.015  -4.523
   95    H    LEU 848           H        LEU 848 -10.178  -0.268  -6.407
   96    HA   LEU 848           HA       LEU 848 -10.765   1.920  -6.763
   97   1HB   LEU 848          1HB       LEU 848 -10.443   1.757  -3.845
   98   2HB   LEU 848          2HB       LEU 848 -10.113   3.380  -4.496
   99    HG   LEU 848           HG       LEU 848 -12.556   1.796  -5.348
  100   1HD1  LEU 848          1HD1      LEU 848 -12.013   3.264  -2.799
  101   2HD1  LEU 848          2HD1      LEU 848 -13.579   3.576  -3.586
  102   3HD1  LEU 848          3HD1      LEU 848 -13.131   1.917  -3.123
  103   1HD2  LEU 848          1HD2      LEU 848 -12.517   3.598  -6.754
  104   2HD2  LEU 848          2HD2      LEU 848 -13.192   4.455  -5.348
  105   3HD2  LEU 848          3HD2      LEU 848 -11.446   4.536  -5.685
  106    H    ASP 849           H        ASP 849  -9.753   4.140  -6.975
  107    HA   ASP 849           HA       ASP 849  -6.975   3.788  -7.777
  108   1HB   ASP 849          1HB       ASP 849  -8.805   6.218  -7.810
  109   2HB   ASP 849          2HB       ASP 849  -7.220   6.101  -8.605
  110    H    ILE 850           H        ILE 850  -6.827   3.270  -5.188
  111    HA   ILE 850           HA       ILE 850  -6.460   5.668  -3.582
  112    HB   ILE 850           HB       ILE 850  -5.247   3.136  -2.659
  113   1HG1  ILE 850          1HG1      ILE 850  -7.236   2.490  -4.206
  114   2HG1  ILE 850          2HG1      ILE 850  -7.225   1.839  -2.549
  115   1HG2  ILE 850          1HG2      ILE 850  -6.127   5.433  -1.507
  116   2HG2  ILE 850          2HG2      ILE 850  -7.592   4.435  -1.343
  117   3HG2  ILE 850          3HG2      ILE 850  -6.054   3.879  -0.641
  118   1HD1  ILE 850          1HD1      ILE 850  -8.574   4.019  -1.967
  119   2HD1  ILE 850          2HD1      ILE 850  -8.908   4.063  -3.715
  120   3HD1  ILE 850          3HD1      ILE 850  -9.416   2.658  -2.747
  121    H    PHE 851           H        PHE 851  -4.041   3.104  -3.543
  122    HA   PHE 851           HA       PHE 851  -1.868   4.911  -3.518
  123   1HB   PHE 851          1HB       PHE 851  -1.660   2.076  -4.520
  124   2HB   PHE 851          2HB       PHE 851  -0.510   3.001  -3.540
  125    HD1  PHE 851           1HD      PHE 851  -1.630   3.865  -1.207
  126    HD2  PHE 851           2HD      PHE 851  -2.781   0.377  -3.434
  127    HE1  PHE 851           1HE      PHE 851  -2.576   2.862   0.854
  128    HE2  PHE 851           2HE      PHE 851  -3.727  -0.626  -1.373
  129    HZ   PHE 851           HZ       PHE 851  -3.625   0.616   0.771
  130    H    THR 852           H        THR 852  -3.622   5.602  -5.690
  131    HA   THR 852           HA       THR 852  -3.034   4.759  -8.219
  132    HB   THR 852           HB       THR 852  -4.270   6.953  -7.107
  133    HG1  THR 852           1HG      THR 852  -5.103   6.421  -8.962
  134   1HG2  THR 852          1HG2      THR 852  -3.201   8.901  -8.327
  135   2HG2  THR 852          2HG2      THR 852  -2.244   8.271  -6.966
  136   3HG2  THR 852          3HG2      THR 852  -1.796   7.853  -8.637
  137    H    GLY 853           H        GLY 853  -1.061   4.069  -8.883
  138   1HA   GLY 853          1HA       GLY 853   1.129   4.195  -9.560
  139   2HA   GLY 853          2HA       GLY 853   0.967   5.965  -9.509
  140    H    VAL 854           H        VAL 854   0.105   4.506  -6.544
  141    HA   VAL 854           HA       VAL 854   2.498   5.592  -5.270
  142    HB   VAL 854           HB       VAL 854  -0.112   4.383  -4.349
  143   1HG1  VAL 854          1HG1      VAL 854   0.621   4.184  -2.136
  144   2HG1  VAL 854          2HG1      VAL 854   2.037   3.586  -3.035
  145   3HG1  VAL 854          3HG1      VAL 854   2.024   5.248  -2.399
  146   1HG2  VAL 854          1HG2      VAL 854   0.034   6.622  -3.015
  147   2HG2  VAL 854          2HG2      VAL 854   1.345   7.030  -4.148
  148   3HG2  VAL 854          3HG2      VAL 854  -0.292   6.700  -4.763
  149    H    ARG 855           H        ARG 855   4.308   4.383  -5.583
  150    HA   ARG 855           HA       ARG 855   4.117   1.447  -5.427
  151   1HB   ARG 855          1HB       ARG 855   6.223   1.419  -6.434
  152   2HB   ARG 855          2HB       ARG 855   5.509   2.898  -7.120
  153   1HG   ARG 855          1HG       ARG 855   6.580   4.110  -5.085
  154   2HG   ARG 855          2HG       ARG 855   7.558   2.634  -4.901
  155   1HD   ARG 855          1HD       ARG 855   8.597   4.483  -6.324
  156   2HD   ARG 855          2HD       ARG 855   8.508   2.879  -7.083
  157    HE   ARG 855           HE       ARG 855   6.152   4.243  -7.784
  158   1HH1  ARG 855          2HH2      ARG 855   9.646   4.559  -8.223
  159   2HH1  ARG 855          1HH2      ARG 855   9.517   5.373  -9.765
  160   1HH2  ARG 855          2HH1      ARG 855   5.981   5.319  -9.822
  161   2HH2  ARG 855          1HH1      ARG 855   7.427   5.807 -10.677
  162    H    LEU 856           H        LEU 856   3.633   1.114  -3.222
  163    HA   LEU 856           HA       LEU 856   5.693   2.069  -1.302
  164   1HB   LEU 856          1HB       LEU 856   4.037   2.207   0.245
  165   2HB   LEU 856          2HB       LEU 856   2.956   2.206  -1.169
  166    HG   LEU 856           HG       LEU 856   2.607  -0.174  -0.999
  167   1HD1  LEU 856          1HD1      LEU 856   3.861  -1.107   1.268
  168   2HD1  LEU 856          2HD1      LEU 856   4.473  -1.329  -0.388
  169   3HD1  LEU 856          3HD1      LEU 856   5.086   0.007   0.615
  170   1HD2  LEU 856          1HD2      LEU 856   2.580   0.511   1.917
  171   2HD2  LEU 856          2HD2      LEU 856   1.664   1.574   0.822
  172   3HD2  LEU 856          3HD2      LEU 856   1.290  -0.165   0.894
  173    H    TYR 857           H        TYR 857   6.969   0.645  -0.197
  174    HA   TYR 857           HA       TYR 857   7.129  -2.058  -1.229
  175   1HB   TYR 857          1HB       TYR 857   9.232  -1.468  -0.676
  176   2HB   TYR 857          2HB       TYR 857   8.687  -0.243   0.483
  177    HD1  TYR 857           1HD      TYR 857   8.134  -3.955   0.384
  178    HD2  TYR 857           2HD      TYR 857   9.844  -0.610   2.467
  179    HE1  TYR 857           1HE      TYR 857   8.770  -5.448   2.260
  180    HE2  TYR 857           2HE      TYR 857  10.480  -2.103   4.342
  181    HH   TYR 857           HH       TYR 857  10.575  -4.262   5.103
  182    H    LEU 858           H        LEU 858   5.447  -3.376  -0.687
  183    HA   LEU 858           HA       LEU 858   4.296  -3.288   1.995
  184   1HB   LEU 858          1HB       LEU 858   2.970  -3.704  -0.102
  185   2HB   LEU 858          2HB       LEU 858   3.816  -5.261  -0.270
  186    HG   LEU 858           HG       LEU 858   2.595  -6.231   1.383
  187   1HD1  LEU 858          1HD1      LEU 858   1.994  -4.963   3.505
  188   2HD1  LEU 858          2HD1      LEU 858   3.738  -5.083   3.172
  189   3HD1  LEU 858          3HD1      LEU 858   2.869  -3.567   2.831
  190   1HD2  LEU 858          1HD2      LEU 858   0.795  -3.830   1.545
  191   2HD2  LEU 858          2HD2      LEU 858   1.000  -4.619  -0.038
  192   3HD2  LEU 858          3HD2      LEU 858   0.380  -5.549   1.347
  193    HA   PRO 859           HA       PRO 859   7.429  -6.169   3.404
  194   1HB   PRO 859          1HB       PRO 859   6.846  -5.969   6.058
  195   2HB   PRO 859          2HB       PRO 859   7.650  -4.638   5.163
  196   1HG   PRO 859          1HG       PRO 859   4.690  -4.931   5.750
  197   2HG   PRO 859          2HG       PRO 859   5.730  -3.507   6.083
  198   1HD   PRO 859          1HD       PRO 859   4.216  -3.666   3.822
  199   2HD   PRO 859          2HD       PRO 859   5.870  -2.986   3.760
  200    HA   PRO 860           HA       PRO 860   4.889  -9.777   3.596
  201   1HB   PRO 860          1HB       PRO 860   6.705 -11.588   4.515
  202   2HB   PRO 860          2HB       PRO 860   6.866 -10.824   2.900
  203   1HG   PRO 860          1HG       PRO 860   8.197  -9.959   5.483
  204   2HG   PRO 860          2HG       PRO 860   8.988 -10.276   3.905
  205   1HD   PRO 860          1HD       PRO 860   8.286  -7.754   4.662
  206   2HD   PRO 860          2HD       PRO 860   8.063  -8.288   2.968
  207    H    SER 861           H        SER 861   6.582  -8.423   6.371
  208    HA   SER 861           HA       SER 861   5.282 -10.149   8.316
  209   1HB   SER 861          1HB       SER 861   7.383  -8.160   8.249
  210   2HB   SER 861          2HB       SER 861   6.227  -7.779   9.548
  211    HG   SER 861           HG       SER 861   7.885  -9.993   9.209
  212    H    THR 862           H        THR 862   4.383  -7.410   6.452
  213    HA   THR 862           HA       THR 862   2.655  -6.112   8.328
  214    HB   THR 862           HB       THR 862   3.335  -5.957   5.487
  215    HG1  THR 862           1HG      THR 862   2.202  -4.145   7.360
  216   1HG2  THR 862          1HG2      THR 862   0.986  -6.694   5.219
  217   2HG2  THR 862          2HG2      THR 862   0.457  -5.413   6.335
  218   3HG2  THR 862          3HG2      THR 862   1.175  -4.984   4.764
  219    HA   PRO 863           HA       PRO 863  -0.694  -8.967   8.455
  220   1HB   PRO 863          1HB       PRO 863  -2.650  -7.336   9.422
  221   2HB   PRO 863          2HB       PRO 863  -1.215  -7.777  10.404
  222   1HG   PRO 863          1HG       PRO 863  -1.603  -5.275   8.737
  223   2HG   PRO 863          2HG       PRO 863  -1.115  -5.369  10.461
  224   1HD   PRO 863          1HD       PRO 863   0.733  -5.129   8.472
  225   2HD   PRO 863          2HD       PRO 863   1.042  -6.198   9.874
  226    H    ASP 864           H        ASP 864  -2.480  -9.576   7.199
  227    HA   ASP 864           HA       ASP 864  -3.892  -9.574   5.397
  228   1HB   ASP 864          1HB       ASP 864  -4.101  -6.989   6.533
  229   2HB   ASP 864          2HB       ASP 864  -3.973  -6.747   4.777
  230    H    PHE 865           H        PHE 865  -0.765  -9.080   5.303
  231    HA   PHE 865           HA       PHE 865   0.058  -7.723   3.080
  232   1HB   PHE 865          1HB       PHE 865   1.399  -9.186   4.671
  233   2HB   PHE 865          2HB       PHE 865   0.907 -10.570   3.680
  234    HD1  PHE 865           1HD      PHE 865   2.236  -7.103   3.048
  235    HD2  PHE 865           2HD      PHE 865   2.517 -11.305   2.203
  236    HE1  PHE 865           1HE      PHE 865   4.121  -6.665   1.497
  237    HE2  PHE 865           2HE      PHE 865   4.402 -10.867   0.652
  238    HZ   PHE 865           HZ       PHE 865   5.205  -8.547   0.300
  239    H    SER 866           H        SER 866  -1.210 -11.105   3.054
  240    HA   SER 866           HA       SER 866  -1.125 -11.864   0.504
  241   1HB   SER 866          1HB       SER 866  -2.431 -13.004   2.285
  242   2HB   SER 866          2HB       SER 866  -3.716 -11.787   2.099
  243    HG   SER 866           HG       SER 866  -2.735 -13.379  -0.032
  244    H    ARG 867           H        ARG 867  -3.939  -9.853   1.538
  245    HA   ARG 867           HA       ARG 867  -4.564  -9.118  -1.166
  246   1HB   ARG 867          1HB       ARG 867  -5.429  -7.619   1.319
  247   2HB   ARG 867          2HB       ARG 867  -6.318  -7.859  -0.205
  248   1HG   ARG 867          1HG       ARG 867  -5.864  -9.783   2.071
  249   2HG   ARG 867          2HG       ARG 867  -7.355  -9.439   1.161
  250   1HD   ARG 867          1HD       ARG 867  -5.879 -10.400  -0.862
  251   2HD   ARG 867          2HD       ARG 867  -5.059 -11.240   0.472
  252    HE   ARG 867           HE       ARG 867  -7.757 -11.654   0.943
  253   1HH1  ARG 867          2HH2      ARG 867  -5.513 -12.223  -1.729
  254   2HH1  ARG 867          1HH2      ARG 867  -6.365 -13.630  -2.325
  255   1HH2  ARG 867          2HH1      ARG 867  -8.882 -13.513   0.156
  256   2HH2  ARG 867          1HH1      ARG 867  -8.285 -14.366  -1.249
  257    H    LEU 868           H        LEU 868  -3.088  -7.342   1.604
  258    HA   LEU 868           HA       LEU 868  -2.696  -4.856   0.676
  259   1HB   LEU 868          1HB       LEU 868  -0.726  -6.738   1.997
  260   2HB   LEU 868          2HB       LEU 868  -0.306  -5.043   1.652
  261    HG   LEU 868           HG       LEU 868  -2.326  -6.166   3.573
  262   1HD1  LEU 868          1HD1      LEU 868  -1.294  -3.584   4.243
  263   2HD1  LEU 868          2HD1      LEU 868  -0.892  -5.152   4.983
  264   3HD1  LEU 868          3HD1      LEU 868   0.058  -4.550   3.604
  265   1HD2  LEU 868          1HD2      LEU 868  -2.579  -3.502   2.113
  266   2HD2  LEU 868          2HD2      LEU 868  -3.735  -4.856   2.066
  267   3HD2  LEU 868          3HD2      LEU 868  -3.492  -3.945   3.576
  268    H    ARG 869           H        ARG 869  -0.725  -7.680  -0.376
  269    HA   ARG 869           HA       ARG 869   0.865  -6.204  -2.228
  270   1HB   ARG 869          1HB       ARG 869   1.209  -8.569  -1.206
  271   2HB   ARG 869          2HB       ARG 869   0.148  -9.128  -2.521
  272   1HG   ARG 869          1HG       ARG 869   2.032  -9.199  -3.784
  273   2HG   ARG 869          2HG       ARG 869   1.910  -7.424  -3.830
  274   1HD   ARG 869          1HD       ARG 869   4.093  -7.762  -3.041
  275   2HD   ARG 869          2HD       ARG 869   3.171  -7.523  -1.541
  276    HE   ARG 869           HE       ARG 869   3.478  -9.775  -0.989
  277   1HH1  ARG 869          2HH2      ARG 869   4.609  -9.066  -4.263
  278   2HH1  ARG 869          1HH2      ARG 869   5.450 -10.589  -4.449
  279   1HH2  ARG 869          2HH1      ARG 869   4.589 -11.787  -1.236
  280   2HH2  ARG 869          1HH1      ARG 869   5.439 -12.140  -2.723
  281    H    ARG 870           H        ARG 870  -1.149  -8.873  -3.410
  282    HA   ARG 870           HA       ARG 870  -1.625  -8.010  -5.928
  283   1HB   ARG 870          1HB       ARG 870  -2.457 -10.139  -5.016
  284   2HB   ARG 870          2HB       ARG 870  -3.684  -9.264  -4.069
  285   1HG   ARG 870          1HG       ARG 870  -4.959  -9.763  -5.930
  286   2HG   ARG 870          2HG       ARG 870  -4.243  -8.233  -6.490
  287   1HD   ARG 870          1HD       ARG 870  -2.369 -10.324  -7.041
  288   2HD   ARG 870          2HD       ARG 870  -3.961 -10.867  -7.613
  289    HE   ARG 870           HE       ARG 870  -3.581  -8.182  -8.447
  290   1HH1  ARG 870          2HH2      ARG 870  -2.292 -11.427  -9.004
  291   2HH1  ARG 870          1HH2      ARG 870  -1.812 -11.101 -10.655
  292   1HH2  ARG 870          2HH1      ARG 870  -2.947  -7.752 -10.627
  293   2HH2  ARG 870          1HH1      ARG 870  -2.185  -9.005 -11.580
  294    H    TYR 871           H        TYR 871  -3.853  -7.234  -3.188
  295    HA   TYR 871           HA       TYR 871  -5.604  -5.549  -4.452
  296   1HB   TYR 871          1HB       TYR 871  -5.474  -6.250  -1.997
  297   2HB   TYR 871          2HB       TYR 871  -4.353  -4.896  -1.772
  298    HD1  TYR 871           1HD      TYR 871  -5.408  -3.178  -0.637
  299    HD2  TYR 871           2HD      TYR 871  -7.554  -5.275  -3.711
  300    HE1  TYR 871           1HE      TYR 871  -7.328  -1.634  -0.350
  301    HE2  TYR 871           2HE      TYR 871  -9.473  -3.731  -3.425
  302    HH   TYR 871           HH       TYR 871  -9.865  -1.655  -0.798
  303    H    PHE 872           H        PHE 872  -2.847  -4.167  -2.588
  304    HA   PHE 872           HA       PHE 872  -2.878  -1.623  -3.588
  305   1HB   PHE 872          1HB       PHE 872  -1.331  -2.600  -1.859
  306   2HB   PHE 872          2HB       PHE 872  -0.360  -3.267  -3.182
  307    HD1  PHE 872           1HD      PHE 872   0.236  -1.421  -5.072
  308    HD2  PHE 872           2HD      PHE 872  -0.614  -0.607  -0.941
  309    HE1  PHE 872           1HE      PHE 872   1.483   0.717  -5.237
  310    HE2  PHE 872           2HE      PHE 872   0.633   1.531  -1.106
  311    HZ   PHE 872           HZ       PHE 872   1.681   2.193  -3.254
  312    H    VAL 873           H        VAL 873  -0.124  -3.454  -4.818
  313    HA   VAL 873           HA       VAL 873   0.337  -2.257  -7.151
  314    HB   VAL 873           HB       VAL 873   1.729  -4.058  -6.907
  315   1HG1  VAL 873          1HG1      VAL 873   0.838  -6.355  -6.249
  316   2HG1  VAL 873          2HG1      VAL 873   0.609  -5.075  -5.033
  317   3HG1  VAL 873          3HG1      VAL 873  -0.757  -5.590  -6.051
  318   1HG2  VAL 873          1HG2      VAL 873   1.433  -5.544  -8.706
  319   2HG2  VAL 873          2HG2      VAL 873  -0.333  -5.600  -8.495
  320   3HG2  VAL 873          3HG2      VAL 873   0.435  -4.151  -9.186
  321    H    ALA 874           H        ALA 874  -2.413  -4.452  -6.561
  322    HA   ALA 874           HA       ALA 874  -3.335  -4.635  -9.230
  323   1HB   ALA 874          1HB       ALA 874  -5.573  -5.065  -8.069
  324   2HB   ALA 874          2HB       ALA 874  -4.224  -6.124  -7.589
  325   3HB   ALA 874          3HB       ALA 874  -4.720  -4.780  -6.533
  326    H    PHE 875           H        PHE 875  -4.020  -2.261  -6.624
  327    HA   PHE 875           HA       PHE 875  -6.033  -0.775  -7.781
  328   1HB   PHE 875          1HB       PHE 875  -3.580   0.297  -6.348
  329   2HB   PHE 875          2HB       PHE 875  -5.129   1.135  -6.536
  330    HD1  PHE 875           1HD      PHE 875  -4.746   1.255  -3.939
  331    HD2  PHE 875           2HD      PHE 875  -5.669  -2.346  -6.092
  332    HE1  PHE 875           1HE      PHE 875  -5.561   0.210  -1.842
  333    HE2  PHE 875           2HE      PHE 875  -6.484  -3.391  -3.996
  334    HZ   PHE 875           HZ       PHE 875  -6.430  -2.113  -1.871
  335    H    ASP 876           H        ASP 876  -2.514  -0.606  -8.468
  336    HA   ASP 876           HA       ASP 876  -2.325  -0.237 -11.052
  337   1HB   ASP 876          1HB       ASP 876  -3.899   2.064  -9.982
  338   2HB   ASP 876          2HB       ASP 876  -2.670   2.431 -11.213
  339    H    GLY 877           H        GLY 877  -1.071  -0.115  -8.191
  340   1HA   GLY 877          1HA       GLY 877   1.069   1.861  -8.805
  341   2HA   GLY 877          2HA       GLY 877   0.689   1.204  -7.197
  342    H    ASP 878           H        ASP 878   2.726   0.354  -6.742
  343    HA   ASP 878           HA       ASP 878   3.311  -2.195  -8.040
  344   1HB   ASP 878          1HB       ASP 878   4.731   0.263  -8.743
  345   2HB   ASP 878          2HB       ASP 878   5.823  -0.971  -8.078
  346    H    LEU 879           H        LEU 879   5.002  -3.389  -6.866
  347    HA   LEU 879           HA       LEU 879   5.506  -2.294  -4.145
  348   1HB   LEU 879          1HB       LEU 879   4.769  -5.184  -4.704
  349   2HB   LEU 879          2HB       LEU 879   4.869  -4.355  -3.132
  350    HG   LEU 879           HG       LEU 879   2.808  -3.972  -5.332
  351   1HD1  LEU 879          1HD1      LEU 879   2.889  -5.003  -2.512
  352   2HD1  LEU 879          2HD1      LEU 879   1.420  -4.155  -3.051
  353   3HD1  LEU 879          3HD1      LEU 879   1.978  -5.607  -3.917
  354   1HD2  LEU 879          1HD2      LEU 879   2.757  -1.778  -4.788
  355   2HD2  LEU 879          2HD2      LEU 879   2.162  -2.281  -3.187
  356   3HD2  LEU 879          3HD2      LEU 879   3.903  -2.019  -3.448
  357    H    VAL 880           H        VAL 880   7.622  -2.294  -3.691
  358    HA   VAL 880           HA       VAL 880   9.376  -4.087  -5.288
  359    HB   VAL 880           HB       VAL 880  10.736  -2.053  -3.714
  360   1HG1  VAL 880          1HG1      VAL 880  11.598  -3.287  -5.716
  361   2HG1  VAL 880          2HG1      VAL 880  10.396  -2.438  -6.718
  362   3HG1  VAL 880          3HG1      VAL 880  11.685  -1.519  -5.906
  363   1HG2  VAL 880          1HG2      VAL 880   8.294  -1.286  -5.284
  364   2HG2  VAL 880          2HG2      VAL 880   8.991  -0.535  -3.828
  365   3HG2  VAL 880          3HG2      VAL 880   9.733  -0.247  -5.420
  366    H    GLN 881           H        GLN 881  10.705  -5.554  -4.295
  367    HA   GLN 881           HA       GLN 881  10.030  -6.418  -1.664
  368   1HB   GLN 881          1HB       GLN 881  12.403  -7.034  -3.465
  369   2HB   GLN 881          2HB       GLN 881  12.022  -7.909  -1.962
  370   1HG   GLN 881          1HG       GLN 881   9.845  -8.571  -2.860
  371   2HG   GLN 881          2HG       GLN 881  10.128  -7.611  -4.328
  372   1HE2  GLN 881          1HE2      GLN 881  11.511  -8.384  -5.947
  373   2HE2  GLN 881          2HE2      GLN 881  12.155 -10.012  -5.940
  374    H    GLU 882           H        GLU 882  10.818  -5.880   0.304
  375    HA   GLU 882           HA       GLU 882  11.949  -3.626   1.081
  376   1HB   GLU 882          1HB       GLU 882  11.469  -5.562   2.572
  377   2HB   GLU 882          2HB       GLU 882  12.992  -6.318   2.044
  378   1HG   GLU 882          1HG       GLU 882  14.000  -3.950   2.732
  379   2HG   GLU 882          2HG       GLU 882  12.550  -3.886   3.757
  380    H    PHE 883           H        PHE 883  14.245  -6.355   0.559
  381    HA   PHE 883           HA       PHE 883  16.480  -4.607   0.243
  382   1HB   PHE 883          1HB       PHE 883  17.674  -6.621  -0.402
  383   2HB   PHE 883          2HB       PHE 883  16.620  -6.960   0.981
  384    HD1  PHE 883           1HD      PHE 883  14.701  -8.430   0.773
  385    HD2  PHE 883           2HD      PHE 883  17.176  -7.534  -2.621
  386    HE1  PHE 883           1HE      PHE 883  13.665 -10.305  -0.477
  387    HE2  PHE 883           2HE      PHE 883  16.141  -9.409  -3.872
  388    HZ   PHE 883           HZ       PHE 883  14.385 -10.794  -2.800
  389    H    ASP 884           H        ASP 884  14.007  -4.262  -1.565
  390    HA   ASP 884           HA       ASP 884  15.570  -3.775  -4.004
  391   1HB   ASP 884          1HB       ASP 884  13.131  -5.587  -3.913
  392   2HB   ASP 884          2HB       ASP 884  13.818  -4.905  -5.403
  393    H    MET 885           H        MET 885  15.238  -1.567  -3.607
  394    HA   MET 885           HA       MET 885  12.517  -0.647  -4.278
  395   1HB   MET 885          1HB       MET 885  13.156   1.139  -2.313
  396   2HB   MET 885          2HB       MET 885  12.117  -0.285  -2.068
  397   1HG   MET 885          1HG       MET 885  14.280  -1.578  -1.587
  398   2HG   MET 885          2HG       MET 885  15.079   0.001  -1.493
  399   1HE   MET 885          1HE       MET 885  12.463  -2.234   1.349
  400   2HE   MET 885          2HE       MET 885  11.380  -1.201   0.386
  401   3HE   MET 885          3HE       MET 885  12.491  -2.328  -0.429
  402    H    THR 886           H        THR 886  15.807   0.449  -3.265
  403    HA   THR 886           HA       THR 886  16.665   2.599  -3.967
  404    HB   THR 886           HB       THR 886  18.216   1.961  -5.629
  405    HG1  THR 886           1HG      THR 886  17.741   0.420  -7.168
  406   1HG2  THR 886          1HG2      THR 886  17.941   0.431  -3.505
  407   2HG2  THR 886          2HG2      THR 886  17.366  -0.778  -4.678
  408   3HG2  THR 886          3HG2      THR 886  19.004  -0.099  -4.831
  409    H    SER 887           H        SER 887  14.856   1.026  -6.669
  410    HA   SER 887           HA       SER 887  14.305   3.704  -7.784
  411   1HB   SER 887          1HB       SER 887  14.469   0.936  -8.784
  412   2HB   SER 887          2HB       SER 887  13.075   1.845  -9.418
  413    HG   SER 887           HG       SER 887  15.442   3.252  -9.315
  414    H    ALA 888           H        ALA 888  12.917   1.395  -5.680
  415    HA   ALA 888           HA       ALA 888  10.218   1.357  -6.249
  416   1HB   ALA 888          1HB       ALA 888  11.772   1.506  -3.661
  417   2HB   ALA 888          2HB       ALA 888   9.993   1.458  -3.651
  418   3HB   ALA 888          3HB       ALA 888  10.914   0.121  -4.379
  419    H    THR 889           H        THR 889   8.535   2.612  -4.732
  420    HA   THR 889           HA       THR 889   9.181   5.515  -4.944
  421    HB   THR 889           HB       THR 889   7.475   4.229  -6.630
  422    HG1  THR 889           1HG      THR 889   7.048   6.803  -5.507
  423   1HG2  THR 889          1HG2      THR 889   5.533   5.467  -4.713
  424   2HG2  THR 889          2HG2      THR 889   5.303   4.126  -5.860
  425   3HG2  THR 889          3HG2      THR 889   6.144   3.843  -4.318
  426    H    HIS 890           H        HIS 890   7.181   2.958  -3.415
  427    HA   HIS 890           HA       HIS 890   7.053   4.697  -0.998
  428   1HB   HIS 890          1HB       HIS 890   4.907   3.022  -2.318
  429   2HB   HIS 890          2HB       HIS 890   4.819   3.481  -0.607
  430    HD1  HIS 890           1HD      HIS 890   5.988   5.833  -3.447
  431    HD2  HIS 890           2HD      HIS 890   2.850   5.226  -0.709
  432    HE1  HIS 890           1HE      HIS 890   4.480   7.893  -3.589
  433    H    VAL 891           H        VAL 891   6.776   3.460   1.034
  434    HA   VAL 891           HA       VAL 891   7.528   0.618   0.896
  435    HB   VAL 891           HB       VAL 891   9.398   1.077   2.567
  436   1HG1  VAL 891          1HG1      VAL 891  10.548   2.419   0.325
  437   2HG1  VAL 891          2HG1      VAL 891  10.622   0.684   0.716
  438   3HG1  VAL 891          3HG1      VAL 891   9.308   1.310  -0.310
  439   1HG2  VAL 891          1HG2      VAL 891  10.368   3.374   2.463
  440   2HG2  VAL 891          2HG2      VAL 891   8.966   3.901   1.500
  441   3HG2  VAL 891          3HG2      VAL 891   8.739   3.364   3.182
  442    H    LEU 892           H        LEU 892   6.274  -0.434   2.313
  443    HA   LEU 892           HA       LEU 892   4.691   1.030   4.240
  444   1HB   LEU 892          1HB       LEU 892   4.500  -1.399   2.894
  445   2HB   LEU 892          2HB       LEU 892   4.824  -1.883   4.576
  446    HG   LEU 892           HG       LEU 892   2.942   0.316   4.549
  447   1HD1  LEU 892          1HD1      LEU 892   1.856  -0.149   2.601
  448   2HD1  LEU 892          2HD1      LEU 892   2.603  -1.758   2.458
  449   3HD1  LEU 892          3HD1      LEU 892   1.183  -1.526   3.506
  450   1HD2  LEU 892          1HD2      LEU 892   3.203  -2.480   5.567
  451   2HD2  LEU 892          2HD2      LEU 892   2.758  -0.989   6.431
  452   3HD2  LEU 892          3HD2      LEU 892   1.549  -1.837   5.438
  453    H    GLY 893           H        GLY 893   5.353   1.663   6.202
  454   1HA   GLY 893          1HA       GLY 893   6.575   1.779   8.144
  455   2HA   GLY 893          2HA       GLY 893   6.557   0.001   8.111
  456    H    SER 894           H        SER 894   8.548   2.684   8.157
  457    HA   SER 894           HA       SER 894  10.849   2.797   8.084
  458   1HB   SER 894          1HB       SER 894  10.375  -0.100   7.553
  459   2HB   SER 894          2HB       SER 894  11.940   0.562   7.025
  460    HG   SER 894           HG       SER 894  11.817   1.573   9.281
  461    H    ARG 895           H        ARG 895  12.645   2.830   6.382
  462    HA   ARG 895           HA       ARG 895  11.618   2.811   3.616
  463   1HB   ARG 895          1HB       ARG 895  12.521   5.123   3.261
  464   2HB   ARG 895          2HB       ARG 895  11.115   5.072   4.352
  465   1HG   ARG 895          1HG       ARG 895  12.426   5.442   6.268
  466   2HG   ARG 895          2HG       ARG 895  13.920   4.894   5.469
  467   1HD   ARG 895          1HD       ARG 895  14.364   6.962   4.682
  468   2HD   ARG 895          2HD       ARG 895  12.706   7.163   4.076
  469    HE   ARG 895           HE       ARG 895  12.198   8.392   5.962
  470   1HH1  ARG 895          2HH2      ARG 895  15.122   6.482   6.515
  471   2HH1  ARG 895          1HH2      ARG 895  15.462   7.203   8.073
  472   1HH2  ARG 895          2HH1      ARG 895  12.649   9.344   8.019
  473   2HH2  ARG 895          1HH1      ARG 895  14.052   8.834   8.930
  474    H    ASP 896           H        ASP 896  14.236   2.985   5.987
  475    HA   ASP 896           HA       ASP 896  16.580   3.234   4.966
  476   1HB   ASP 896          1HB       ASP 896  17.097   0.700   5.625
  477   2HB   ASP 896          2HB       ASP 896  16.703   1.924   6.851
  478    H    LYS 897           H        LYS 897  15.227   0.008   4.134
  479    HA   LYS 897           HA       LYS 897  16.760  -0.730   2.070
  480   1HB   LYS 897          1HB       LYS 897  14.127  -1.112   1.071
  481   2HB   LYS 897          2HB       LYS 897  15.126  -2.267   1.986
  482   1HG   LYS 897          1HG       LYS 897  13.190  -2.065   3.317
  483   2HG   LYS 897          2HG       LYS 897  14.327  -0.933   4.087
  484   1HD   LYS 897          1HD       LYS 897  13.302   0.851   2.498
  485   2HD   LYS 897          2HD       LYS 897  11.983  -0.321   2.266
  486   1HE   LYS 897          1HE       LYS 897  12.194  -0.387   4.972
  487   2HE   LYS 897          2HE       LYS 897  12.720   1.284   4.670
  488   1HZ   LYS 897          1HZ       LYS 897  10.284   0.198   3.477
  489   2HZ   LYS 897          2HZ       LYS 897  10.285   0.866   4.985
  490   3HZ   LYS 897          3HZ       LYS 897  10.718   1.776   3.679
  491    H    ASN 898           H        ASN 898  14.419   1.938   1.983
  492    HA   ASN 898           HA       ASN 898  15.748   3.054  -0.342
  493   1HB   ASN 898          1HB       ASN 898  13.901   1.215  -1.019
  494   2HB   ASN 898          2HB       ASN 898  12.829   2.616  -0.800
  495   1HD2  ASN 898          1HD2      ASN 898  12.379   2.606  -3.089
  496   2HD2  ASN 898          2HD2      ASN 898  13.543   3.249  -4.228
  497    HA   PRO 899           HA       PRO 899  14.074   6.218   2.440
  498   1HB   PRO 899          1HB       PRO 899  16.030   8.058   1.978
  499   2HB   PRO 899          2HB       PRO 899  16.316   6.609   2.998
  500   1HG   PRO 899          1HG       PRO 899  16.959   6.941   0.053
  501   2HG   PRO 899          2HG       PRO 899  18.066   6.394   1.354
  502   1HD   PRO 899          1HD       PRO 899  16.738   4.612  -0.223
  503   2HD   PRO 899          2HD       PRO 899  16.936   4.302   1.528
  504    H    ALA 900           H        ALA 900  14.565   5.913  -0.946
  505    HA   ALA 900           HA       ALA 900  13.504   8.573  -1.594
  506   1HB   ALA 900          1HB       ALA 900  13.612   6.649  -3.784
  507   2HB   ALA 900          2HB       ALA 900  14.479   8.191  -3.586
  508   3HB   ALA 900          3HB       ALA 900  15.147   6.698  -2.884
  509    H    ALA 901           H        ALA 901  12.196   5.773  -0.414
  510    HA   ALA 901           HA       ALA 901   9.791   5.845  -2.135
  511   1HB   ALA 901          1HB       ALA 901  10.145   3.624  -1.789
  512   2HB   ALA 901          2HB       ALA 901  11.093   3.901  -0.308
  513   3HB   ALA 901          3HB       ALA 901   9.314   3.931  -0.246
  514    H    GLN 902           H        GLN 902   8.016   4.905  -0.040
  515    HA   GLN 902           HA       GLN 902   7.821   7.373   1.622
  516   1HB   GLN 902          1HB       GLN 902   5.798   5.970  -0.107
  517   2HB   GLN 902          2HB       GLN 902   5.251   6.778   1.381
  518   1HG   GLN 902          1HG       GLN 902   6.798   8.024  -0.926
  519   2HG   GLN 902          2HG       GLN 902   5.118   8.364  -0.456
  520   1HE2  GLN 902          1HE2      GLN 902   5.825   8.179   2.465
  521   2HE2  GLN 902          2HE2      GLN 902   6.626   9.690   2.839
  522    H    GLN 903           H        GLN 903   7.499   7.055   3.768
  523    HA   GLN 903           HA       GLN 903   7.462   4.267   4.705
  524   1HB   GLN 903          1HB       GLN 903   7.918   6.969   5.998
  525   2HB   GLN 903          2HB       GLN 903   7.716   5.486   6.962
  526   1HG   GLN 903          1HG       GLN 903   9.852   4.911   6.562
  527   2HG   GLN 903          2HG       GLN 903   9.546   4.940   4.812
  528   1HE2  GLN 903          1HE2      GLN 903   9.985   6.853   3.602
  529   2HE2  GLN 903          2HE2      GLN 903  11.016   8.117   4.239
  530    H    VAL 904           H        VAL 904   5.150   4.317   3.613
  531    HA   VAL 904           HA       VAL 904   3.099   5.552   5.290
  532    HB   VAL 904           HB       VAL 904   1.786   5.239   3.482
  533   1HG1  VAL 904          1HG1      VAL 904   4.255   5.626   2.596
  534   2HG1  VAL 904          2HG1      VAL 904   4.072   3.964   1.987
  535   3HG1  VAL 904          3HG1      VAL 904   2.944   5.234   1.458
  536   1HG2  VAL 904          1HG2      VAL 904   2.846   2.402   3.618
  537   2HG2  VAL 904          2HG2      VAL 904   1.196   2.991   3.932
  538   3HG2  VAL 904          3HG2      VAL 904   1.820   2.939   2.266
  539    H    SER 905           H        SER 905   1.187   4.038   5.920
  540    HA   SER 905           HA       SER 905   2.285   1.501   7.029
  541   1HB   SER 905          1HB       SER 905   1.678   3.779   8.514
  542   2HB   SER 905          2HB       SER 905   0.217   2.775   8.670
  543    HG   SER 905           HG       SER 905   2.901   2.039   9.224
  544    HA   PRO 906           HA       PRO 906  -1.550  -0.436   6.001
  545   1HB   PRO 906          1HB       PRO 906  -2.823  -1.261   8.264
  546   2HB   PRO 906          2HB       PRO 906  -1.213  -1.901   7.798
  547   1HG   PRO 906          1HG       PRO 906  -1.803   0.369   9.720
  548   2HG   PRO 906          2HG       PRO 906  -0.776  -1.071  10.019
  549   1HD   PRO 906          1HD       PRO 906   0.301   1.300   9.215
  550   2HD   PRO 906          2HD       PRO 906   0.921  -0.247   8.561
  551    H    GLU 907           H        GLU 907  -1.807   2.255   8.265
  552    HA   GLU 907           HA       GLU 907  -4.665   2.605   7.940
  553   1HB   GLU 907          1HB       GLU 907  -2.546   4.554   8.923
  554   2HB   GLU 907          2HB       GLU 907  -4.302   4.670   9.185
  555   1HG   GLU 907          1HG       GLU 907  -4.187   3.286  10.956
  556   2HG   GLU 907          2HG       GLU 907  -3.342   2.055   9.993
  557    H    TRP 908           H        TRP 908  -1.733   3.663   6.284
  558    HA   TRP 908           HA       TRP 908  -2.899   5.863   4.876
  559   1HB   TRP 908          1HB       TRP 908  -0.483   5.523   5.153
  560   2HB   TRP 908          2HB       TRP 908  -0.570   4.047   4.181
  561    HD1  TRP 908           HD       TRP 908  -0.869   7.855   3.859
  562    HE1  TRP 908           1HE      TRP 908  -0.405   8.555   1.455
  563    HE3  TRP 908           3HE      TRP 908  -0.534   3.218   1.719
  564    HZ2  TRP 908           2HZ      TRP 908   0.056   7.268  -1.096
  565    HZ3  TRP 908           3HZ      TRP 908  -0.082   2.995  -0.697
  566    HH2  TRP 908           HH       TRP 908   0.215   5.005  -2.115
  567    H    ILE 909           H        ILE 909  -2.418   2.394   4.068
  568    HA   ILE 909           HA       ILE 909  -3.383   2.440   1.443
  569    HB   ILE 909           HB       ILE 909  -3.158   0.427   3.635
  570   1HG1  ILE 909          1HG1      ILE 909  -2.488  -0.429   0.950
  571   2HG1  ILE 909          2HG1      ILE 909  -1.801   1.185   1.253
  572   1HG2  ILE 909          1HG2      ILE 909  -4.363  -1.271   2.322
  573   2HG2  ILE 909          2HG2      ILE 909  -5.459   0.062   2.756
  574   3HG2  ILE 909          3HG2      ILE 909  -4.798  -0.044   1.108
  575   1HD1  ILE 909          1HD1      ILE 909  -0.206  -0.515   1.988
  576   2HD1  ILE 909          2HD1      ILE 909  -0.860   0.325   3.414
  577   3HD1  ILE 909          3HD1      ILE 909  -1.454  -1.298   2.987
  578    H    TRP 910           H        TRP 910  -5.223   1.845   4.493
  579    HA   TRP 910           HA       TRP 910  -7.762   1.679   3.233
  580   1HB   TRP 910          1HB       TRP 910  -7.266   2.730   6.020
  581   2HB   TRP 910          2HB       TRP 910  -8.651   1.808   5.420
  582    HD1  TRP 910           HD       TRP 910  -5.977   1.327   7.651
  583    HE1  TRP 910           1HE      TRP 910  -5.200  -1.089   7.858
  584    HE3  TRP 910           3HE      TRP 910  -8.117  -0.574   3.408
  585    HZ2  TRP 910           2HZ      TRP 910  -5.469  -3.557   6.369
  586    HZ3  TRP 910           3HZ      TRP 910  -7.835  -2.958   2.837
  587    HH2  TRP 910           HH       TRP 910  -6.517  -4.459   4.303
  588    H    ALA 911           H        ALA 911  -6.423   4.398   5.200
  589    HA   ALA 911           HA       ALA 911  -8.359   6.290   4.625
  590   1HB   ALA 911          1HB       ALA 911  -6.664   6.768   6.243
  591   2HB   ALA 911          2HB       ALA 911  -5.364   6.559   5.045
  592   3HB   ALA 911          3HB       ALA 911  -6.455   7.961   4.938
  593    H    CYS 912           H        CYS 912  -5.621   5.215   2.622
  594    HA   CYS 912           HA       CYS 912  -5.953   7.275   0.628
  595   1HB   CYS 912          1HB       CYS 912  -4.522   4.592   0.665
  596   2HB   CYS 912          2HB       CYS 912  -4.466   5.720  -0.712
  597    HG   CYS 912           HG       CYS 912  -2.534   6.774   0.129
  598    H    ILE 913           H        ILE 913  -6.284   3.722   0.161
  599    HA   ILE 913           HA       ILE 913  -7.804   3.730  -2.113
  600    HB   ILE 913           HB       ILE 913  -7.000   1.675  -1.121
  601   1HG1  ILE 913          1HG1      ILE 913 -10.029   1.556  -0.927
  602   2HG1  ILE 913          2HG1      ILE 913  -9.186   1.730  -2.485
  603   1HG2  ILE 913          1HG2      ILE 913  -8.119   2.812   1.253
  604   2HG2  ILE 913          2HG2      ILE 913  -8.947   1.263   0.964
  605   3HG2  ILE 913          3HG2      ILE 913  -7.172   1.312   1.096
  606   1HD1  ILE 913          1HD1      ILE 913  -8.180  -0.406  -0.652
  607   2HD1  ILE 913          2HD1      ILE 913  -9.775  -0.680  -1.394
  608   3HD1  ILE 913          3HD1      ILE 913  -8.348  -0.410  -2.424
  609    H    ARG 914           H        ARG 914  -8.832   4.580   1.156
  610    HA   ARG 914           HA       ARG 914 -11.665   4.506   0.542
  611   1HB   ARG 914          1HB       ARG 914 -10.424   4.306   2.839
  612   2HB   ARG 914          2HB       ARG 914 -10.418   6.085   2.793
  613   1HG   ARG 914          1HG       ARG 914 -12.959   5.839   2.218
  614   2HG   ARG 914          2HG       ARG 914 -12.778   4.191   2.865
  615   1HD   ARG 914          1HD       ARG 914 -12.530   4.921   5.010
  616   2HD   ARG 914          2HD       ARG 914 -11.562   6.330   4.524
  617    HE   ARG 914           HE       ARG 914 -14.368   6.545   3.782
  618   1HH1  ARG 914          2HH2      ARG 914 -11.967   7.008   6.336
  619   2HH1  ARG 914          1HH2      ARG 914 -12.893   8.234   7.173
  620   1HH2  ARG 914          2HH1      ARG 914 -15.591   8.164   4.889
  621   2HH2  ARG 914          1HH1      ARG 914 -14.959   8.892   6.348
  622    H    LYS 915           H        LYS 915  -9.070   6.960   0.620
  623    HA   LYS 915           HA       LYS 915 -10.932   9.130   0.045
  624   1HB   LYS 915          1HB       LYS 915  -7.902   8.922   0.164
  625   2HB   LYS 915          2HB       LYS 915  -8.775  10.431  -0.194
  626   1HG   LYS 915          1HG       LYS 915  -9.422   8.776   2.264
  627   2HG   LYS 915          2HG       LYS 915  -8.113   9.982   2.275
  628   1HD   LYS 915          1HD       LYS 915  -9.631  11.767   1.753
  629   2HD   LYS 915          2HD       LYS 915 -10.941  10.628   1.362
  630   1HE   LYS 915          1HE       LYS 915 -11.394  11.488   3.563
  631   2HE   LYS 915          2HE       LYS 915 -10.818   9.819   3.764
  632   1HZ   LYS 915          1HZ       LYS 915  -9.421  12.314   4.318
  633   2HZ   LYS 915          2HZ       LYS 915  -9.632  10.998   5.290
  634   3HZ   LYS 915          3HZ       LYS 915  -8.572  10.930   4.029
  635    H    ARG 916           H        ARG 916  -9.564   6.616  -1.741
  636    HA   ARG 916           HA       ARG 916  -9.469   6.198  -3.990
  637   1HB   ARG 916          1HB       ARG 916 -11.254   8.628  -3.892
  638   2HB   ARG 916          2HB       ARG 916 -10.706   7.988  -5.460
  639   1HG   ARG 916          1HG       ARG 916 -12.845   6.957  -4.867
  640   2HG   ARG 916          2HG       ARG 916 -11.558   5.730  -4.787
  641   1HD   ARG 916          1HD       ARG 916 -13.026   5.568  -2.819
  642   2HD   ARG 916          2HD       ARG 916 -11.392   6.074  -2.340
  643    HE   ARG 916           HE       ARG 916 -12.249   8.099  -1.622
  644   1HH1  ARG 916          2HH2      ARG 916 -14.577   6.454  -3.713
  645   2HH1  ARG 916          1HH2      ARG 916 -15.866   7.597  -3.407
  646   1HH2  ARG 916          2HH1      ARG 916 -13.952   9.608  -1.218
  647   2HH2  ARG 916          1HH1      ARG 916 -15.509   9.395  -1.985
  648    H    ARG 917           H        ARG 917  -7.909   8.646  -2.430
  649    HA   ARG 917           HA       ARG 917  -6.090   9.039  -4.718
  650   1HB   ARG 917          1HB       ARG 917  -6.176  11.571  -3.597
  651   2HB   ARG 917          2HB       ARG 917  -6.960  11.086  -5.119
  652   1HG   ARG 917          1HG       ARG 917  -8.409  10.510  -2.554
  653   2HG   ARG 917          2HG       ARG 917  -8.350  12.199  -3.113
  654   1HD   ARG 917          1HD       ARG 917  -9.041  11.197  -5.429
  655   2HD   ARG 917          2HD       ARG 917  -9.541   9.780  -4.481
  656    HE   ARG 917           HE       ARG 917 -10.751  11.811  -3.137
  657   1HH1  ARG 917          2HH2      ARG 917 -10.574  10.948  -6.561
  658   2HH1  ARG 917          1HH2      ARG 917 -12.146  11.610  -6.949
  659   1HH2  ARG 917          2HH1      ARG 917 -12.827  12.686  -3.650
  660   2HH2  ARG 917          1HH1      ARG 917 -13.430  12.601  -5.290
  661    H    LEU 918           H        LEU 918  -4.108   8.547  -4.003
  662    HA   LEU 918           HA       LEU 918  -3.292   7.800  -1.553
  663   1HB   LEU 918          1HB       LEU 918  -1.869   9.405  -3.681
  664   2HB   LEU 918          2HB       LEU 918  -1.032   8.946  -2.178
  665    HG   LEU 918           HG       LEU 918  -0.594   6.974  -3.208
  666   1HD1  LEU 918          1HD1      LEU 918  -2.458   5.320  -3.180
  667   2HD1  LEU 918          2HD1      LEU 918  -2.391   6.276  -1.681
  668   3HD1  LEU 918          3HD1      LEU 918  -3.612   6.650  -2.920
  669   1HD2  LEU 918          1HD2      LEU 918  -1.042   7.831  -5.414
  670   2HD2  LEU 918          2HD2      LEU 918  -1.881   6.266  -5.290
  671   3HD2  LEU 918          3HD2      LEU 918  -2.800   7.783  -5.141
  672    H    VAL 919           H        VAL 919  -3.189   8.616   0.455
  673    HA   VAL 919           HA       VAL 919  -3.561  11.544   0.761
  674    HB   VAL 919           HB       VAL 919  -4.714  11.082   2.682
  675   1HG1  VAL 919          1HG1      VAL 919  -6.247   9.570   1.991
  676   2HG1  VAL 919          2HG1      VAL 919  -5.155   9.212   0.631
  677   3HG1  VAL 919          3HG1      VAL 919  -5.077   8.234   2.116
  678   1HG2  VAL 919          1HG2      VAL 919  -2.452   9.245   3.087
  679   2HG2  VAL 919          2HG2      VAL 919  -3.385  10.179   4.281
  680   3HG2  VAL 919          3HG2      VAL 919  -3.985   8.600   3.721
  681    H    ALA 920           H        ALA 920  -2.589  11.702   3.429
  682    HA   ALA 920           HA       ALA 920   0.215  12.070   2.886
  683   1HB   ALA 920          1HB       ALA 920  -0.482  13.631   4.411
  684   2HB   ALA 920          2HB       ALA 920  -1.688  12.541   5.136
  685   3HB   ALA 920          3HB       ALA 920   0.032  12.376   5.564
  686    HA   PRO 921           HA       PRO 921   1.213   7.824   3.906
  687   1HB   PRO 921          1HB       PRO 921   3.808   7.917   3.081
  688   2HB   PRO 921          2HB       PRO 921   2.444   7.932   1.916
  689   1HG   PRO 921          1HG       PRO 921   3.951  10.323   3.012
  690   2HG   PRO 921          2HG       PRO 921   3.633   9.934   1.290
  691   1HD   PRO 921          1HD       PRO 921   2.030  11.645   2.681
  692   2HD   PRO 921          2HD       PRO 921   1.322  10.474   1.527
  693    H    CYS 922           H        CYS 922   1.777   7.100   5.889
  694    HA   CYS 922           HA       CYS 922   3.175   6.899   7.767
  695   1HB   CYS 922          1HB       CYS 922   4.976   8.181   6.667
  696   2HB   CYS 922          2HB       CYS 922   4.121   9.701   7.034
  697    HG   CYS 922           HG       CYS 922   6.135   9.395   8.675