NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | position | program | type | subtype | subsubtype |
7114 | 1k0s | 4984 | cing | recoord | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
!Manual restraints ASSI { 776} (( segid " " and resid 2 and name HA )) (( segid " " and resid 3 and name HN )) 1.800 0.000 3.200 peak 776 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 777} (( segid " " and resid 2 and name HB* )) (( segid " " and resid 3 and name HN )) 1.800 0.000 3.200 peak 777 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 778} (( segid " " and resid 2 and name HN )) (( segid " " and resid 3 and name HN )) 1.800 0.000 1.800 peak 778 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 779} (( segid " " and resid 3 and name HA )) (( segid " " and resid 3 and name HN )) 1.800 0.000 3.200 peak 779 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 780} (( segid " " and resid 3 and name HB )) (( segid " " and resid 3 and name HN )) 1.800 0.000 3.200 peak 780 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 781} ( segid " " and resid 3 and name HG2*) (( segid " " and resid 3 and name HA )) 1.800 0.000 1.800 peak 781 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 782} ( segid " " and resid 3 and name HG2*) (( segid " " and resid 3 and name HN )) 1.800 0.000 3.200 peak 782 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 783} (( segid " " and resid 4 and name HA )) (( segid " " and resid 4 and name HN )) 1.800 0.000 3.200 peak 783 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 784} ( segid " " and resid 4 and name HD1*) (( segid " " and resid 4 and name HA )) 1.800 0.000 3.200 peak 784 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 785} ( segid " " and resid 4 and name HD1*) (( segid " " and resid 4 and name HN )) 1.800 0.000 3.200 peak 785 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 786} (( segid " " and resid 4 and name HN )) (( segid " " and resid 5 and name HN )) 1.800 0.000 3.200 peak 786 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 787} (( segid " " and resid 5 and name HA )) (( segid " " and resid 5 and name HN )) 1.800 0.000 1.800 peak 787 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 788} (( segid " " and resid 5 and name HA )) (( segid " " and resid 6 and name HN )) 1.800 0.000 0.900 peak 788 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 791} (( segid " " and resid 5 and name HN )) (( segid " " and resid 6 and name HN )) 1.800 0.000 3.200 peak 791 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 792} (( segid " " and resid 6 and name HA )) (( segid " " and resid 6 and name HN )) 1.800 0.000 1.800 peak 792 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 793} (( segid " " and resid 6 and name HB* )) (( segid " " and resid 6 and name HA )) 1.800 0.000 0.900 peak 793 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 794} (( segid " " and resid 6 and name HB* )) (( segid " " and resid 6 and name HN )) 1.800 0.000 1.800 peak 794 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 795} (( segid " " and resid 7 and name HA )) (( segid " " and resid 7 and name HN )) 1.800 0.000 0.900 peak 795 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 796} ( segid " " and resid 7 and name HB* ) (( segid " " and resid 7 and name HA )) 1.800 0.000 3.200 peak 796 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 798} (( segid " " and resid 7 and name HN )) (( segid " " and resid 6 and name HA )) 1.800 0.000 0.900 peak 798 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 799} (( segid " " and resid 7 and name HN )) (( segid " " and resid 6 and name HB* )) 1.800 0.000 1.800 peak 799 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 800} (( segid " " and resid 8 and name HA )) ( segid " " and resid 8 and name HD2*) 1.800 0.000 0.900 peak 800 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 800} (( segid " " and resid 8 and name HA )) ( segid " " and resid 8 and name HD1*) ASSI { 801} (( segid " " and resid 8 and name HA )) (( segid " " and resid 8 and name HN )) 1.800 0.000 1.800 peak 801 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 802} (( segid " " and resid 8 and name HA )) (( segid " " and resid 9 and name HN )) 1.800 0.000 0.900 peak 802 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 803} (( segid " " and resid 8 and name HB* )) (( segid " " and resid 8 and name HA )) 1.800 0.000 0.900 peak 803 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 804} (( segid " " and resid 8 and name HB* )) ( segid " " and resid 8 and name HD1*) 1.800 0.000 0.900 peak 804 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 804} (( segid " " and resid 8 and name HB* )) ( segid " " and resid 8 and name HD2*) ASSI { 805} (( segid " " and resid 8 and name HB* )) (( segid " " and resid 8 and name HN )) 1.800 0.000 1.800 peak 805 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 806} (( segid " " and resid 8 and name HB* )) (( segid " " and resid 9 and name HN )) 1.800 0.000 3.200 peak 806 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 807} ( segid " " and resid 8 and name HD1*) (( segid " " and resid 113 and name HN )) 1.800 0.000 3.200 peak 807 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 807} ( segid " " and resid 8 and name HD2*) (( segid " " and resid 113 and name HN )) ASSI { 808} ( segid " " and resid 8 and name HD1*) (( segid " " and resid 111 and name HN )) 1.800 0.000 3.200 peak 808 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 808} ( segid " " and resid 8 and name HD2*) (( segid " " and resid 111 and name HN )) ASSI { 809} ( segid " " and resid 8 and name HD2*) (( segid " " and resid 9 and name HN )) 1.800 0.000 3.200 peak 809 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 809} ( segid " " and resid 8 and name HD1*) (( segid " " and resid 9 and name HN )) ASSI { 810} ( segid " " and resid 8 and name HD2*) (( segid " " and resid 8 and name HA )) 1.800 0.000 0.900 peak 810 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 811} ( segid " " and resid 8 and name HD2*) (( segid " " and resid 8 and name HB* )) 1.800 0.000 0.900 peak 811 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 812} ( segid " " and resid 8 and name HD2*) (( segid " " and resid 8 and name HN )) 1.800 0.000 3.200 peak 812 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 813} (( segid " " and resid 8 and name HN )) ( segid " " and resid 8 and name HD2*) 1.800 0.000 1.800 peak 813 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 813} (( segid " " and resid 8 and name HN )) ( segid " " and resid 8 and name HD1*) ASSI { 814} (( segid " " and resid 8 and name HN )) (( segid " " and resid 9 and name HN )) 1.800 0.000 1.800 peak 814 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 816} (( segid " " and resid 9 and name HA )) (( segid " " and resid 9 and name HN )) 1.800 0.000 1.800 peak 816 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 817} (( segid " " and resid 9 and name HB* )) (( segid " " and resid 10 and name HA )) 1.800 0.000 3.200 peak 817 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 818} (( segid " " and resid 9 and name HB* )) (( segid " " and resid 10 and name HN )) 1.800 0.000 3.200 peak 818 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 819} (( segid " " and resid 9 and name HB* )) (( segid " " and resid 9 and name HA )) 1.800 0.000 3.200 peak 819 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 820} (( segid " " and resid 9 and name HB* )) (( segid " " and resid 9 and name HN )) 1.800 0.000 0.900 peak 820 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 821} (( segid " " and resid 9 and name HD* )) (( segid " " and resid 9 and name HN )) 1.800 0.000 3.200 peak 821 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 822} (( segid " " and resid 9 and name HE* )) (( segid " " and resid 10 and name HG* )) 1.800 0.000 1.800 peak 822 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 823} (( segid " " and resid 9 and name HG* )) (( segid " " and resid 9 and name HN )) 1.800 0.000 3.200 peak 823 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 824} (( segid " " and resid 9 and name HN )) (( segid " " and resid 10 and name HN )) 1.800 0.000 0.900 peak 824 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 826} (( segid " " and resid 10 and name HA )) ( segid " " and resid 11 and name HD* ) 1.800 0.000 3.200 peak 826 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 828} (( segid " " and resid 10 and name HA )) (( segid " " and resid 105 and name HA )) 1.800 0.000 0.900 peak 828 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 829} (( segid " " and resid 10 and name HA )) (( segid " " and resid 105 and name HB )) 1.800 0.000 1.800 peak 829 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 830} (( segid " " and resid 10 and name HA )) ( segid " " and resid 105 and name HG2*) 1.800 0.000 1.800 peak 830 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 831} (( segid " " and resid 10 and name HB* )) (( segid " " and resid 10 and name HA )) 1.800 0.000 0.900 peak 831 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 832} (( segid " " and resid 10 and name HB* )) (( segid " " and resid 10 and name HN )) 1.800 0.000 0.900 peak 832 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 833} (( segid " " and resid 10 and name HB* )) (( segid " " and resid 11 and name HN )) 1.800 0.000 1.800 peak 833 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 834} (( segid " " and resid 10 and name HB* )) (( segid " " and resid 105 and name HA )) 1.800 0.000 1.800 peak 834 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 835} (( segid " " and resid 10 and name HB* )) ( segid " " and resid 105 and name HG2*) 1.800 0.000 0.900 peak 835 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 836} (( segid " " and resid 10 and name HG* )) (( segid " " and resid 10 and name HA )) 1.800 0.000 0.900 peak 836 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 837} (( segid " " and resid 10 and name HG* )) (( segid " " and resid 10 and name HB* )) 1.800 0.000 0.900 peak 837 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 838} (( segid " " and resid 10 and name HG* )) (( segid " " and resid 10 and name HN )) 1.800 0.000 3.200 peak 838 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 839} (( segid " " and resid 10 and name HG* )) (( segid " " and resid 105 and name HA )) 1.800 0.000 1.800 peak 839 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 840} (( segid " " and resid 10 and name HG* )) ( segid " " and resid 105 and name HG2*) 1.800 0.000 0.900 peak 840 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 843} (( segid " " and resid 10 and name HG* )) (( segid " " and resid 105 and name HA )) 1.800 0.000 3.200 peak 843 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 844} (( segid " " and resid 10 and name HG* )) ( segid " " and resid 105 and name HG2*) 1.800 0.000 3.200 peak 844 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 845} (( segid " " and resid 10 and name HN )) (( segid " " and resid 11 and name HN )) 1.800 0.000 3.200 peak 845 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 846} (( segid " " and resid 11 and name HA )) (( segid " " and resid 12 and name HA )) 1.800 0.000 3.200 peak 846 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 847} (( segid " " and resid 11 and name HA )) (( segid " " and resid 12 and name HN )) 1.800 0.000 0.900 peak 847 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 848} (( segid " " and resid 11 and name HA )) (( segid " " and resid 11 and name HB* )) 1.800 0.000 0.900 peak 848 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 849} (( segid " " and resid 11 and name HA )) (( segid " " and resid 11 and name HN )) 1.800 0.000 1.800 peak 849 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 850} (( segid " " and resid 11 and name HA )) ( segid " " and resid 13 and name HG1*) 1.800 0.000 3.200 peak 850 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 851} (( segid " " and resid 11 and name HB* )) ( segid " " and resid 11 and name HD* ) 1.800 0.000 1.800 peak 851 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 855} (( segid " " and resid 11 and name HB* )) (( segid " " and resid 12 and name HN )) 1.800 0.000 3.200 peak 855 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 856} (( segid " " and resid 11 and name HB* )) (( segid " " and resid 11 and name HA )) 1.800 0.000 1.800 peak 856 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 858} (( segid " " and resid 11 and name HB* )) (( segid " " and resid 11 and name HN )) 1.800 0.000 3.200 peak 858 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 859} ( segid " " and resid 11 and name HD* ) (( segid " " and resid 12 and name HN )) 1.800 0.000 3.200 peak 859 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 860} ( segid " " and resid 11 and name HD* ) (( segid " " and resid 106 and name HA )) 1.800 0.000 3.200 peak 860 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 861} ( segid " " and resid 11 and name HD* ) ( segid " " and resid 104 and name HD1*) 1.800 0.000 3.200 peak 861 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 862} ( segid " " and resid 11 and name HD* ) ( segid " " and resid 104 and name HG2*) 1.800 0.000 1.800 peak 862 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 863} ( segid " " and resid 11 and name HD* ) (( segid " " and resid 11 and name HA )) 1.800 0.000 0.900 peak 863 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 865} ( segid " " and resid 11 and name HD* ) (( segid " " and resid 11 and name HB* )) 1.800 0.000 1.800 peak 865 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 866} ( segid " " and resid 11 and name HD* ) (( segid " " and resid 105 and name HA )) 1.800 0.000 3.200 peak 866 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 867} ( segid " " and resid 11 and name HD* ) ( segid " " and resid 135 and name HD* ) 1.800 0.000 3.200 peak 867 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 869} (( segid " " and resid 11 and name HN )) (( segid " " and resid 12 and name HA )) 1.800 0.000 3.200 peak 869 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 870} (( segid " " and resid 11 and name HN )) (( segid " " and resid 12 and name HN )) 1.800 0.000 3.200 peak 870 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 871} (( segid " " and resid 11 and name HN )) (( segid " " and resid 11 and name HB* )) 1.800 0.000 3.200 peak 871 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 872} (( segid " " and resid 11 and name HN )) ( segid " " and resid 11 and name HD* ) 1.800 0.000 3.200 peak 872 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 873} (( segid " " and resid 11 and name HN )) (( segid " " and resid 105 and name HA )) 1.800 0.000 3.200 peak 873 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 874} (( segid " " and resid 12 and name HA )) (( segid " " and resid 103 and name HA )) 1.800 0.000 1.800 peak 874 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 875} (( segid " " and resid 12 and name HA )) (( segid " " and resid 12 and name HB* )) 1.800 0.000 1.800 peak 875 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 876} (( segid " " and resid 12 and name HA )) (( segid " " and resid 12 and name HN )) 1.800 0.000 1.800 peak 876 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 877} (( segid " " and resid 12 and name HA )) ( segid " " and resid 13 and name HG1*) 1.800 0.000 1.800 peak 877 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 877} (( segid " " and resid 12 and name HA )) ( segid " " and resid 13 and name HG2*) ASSI { 878} (( segid " " and resid 12 and name HA )) ( segid " " and resid 13 and name HG1*) 1.800 0.000 3.200 peak 878 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 879} (( segid " " and resid 12 and name HB* )) (( segid " " and resid 12 and name HN )) 1.800 0.000 3.200 peak 879 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 880} (( segid " " and resid 12 and name HB* )) (( segid " " and resid 13 and name HN )) 1.800 0.000 3.200 peak 880 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 882} (( segid " " and resid 12 and name HB* )) (( segid " " and resid 12 and name HA )) 1.800 0.000 1.800 peak 882 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 883} (( segid " " and resid 12 and name HG* )) (( segid " " and resid 12 and name HA )) 1.800 0.000 1.800 peak 883 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 884} (( segid " " and resid 12 and name HG* )) (( segid " " and resid 12 and name HN )) 1.800 0.000 1.800 peak 884 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 885} (( segid " " and resid 12 and name HN )) (( segid " " and resid 13 and name HN )) 1.800 0.000 3.200 peak 885 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 886} (( segid " " and resid 13 and name HA )) (( segid " " and resid 26 and name HA )) 1.800 0.000 1.800 peak 886 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 887} (( segid " " and resid 13 and name HA )) ( segid " " and resid 13 and name HG1*) 1.800 0.000 1.800 peak 887 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 887} (( segid " " and resid 13 and name HA )) ( segid " " and resid 13 and name HG2*) ASSI { 888} (( segid " " and resid 13 and name HA )) ( segid " " and resid 27 and name HG1*) 1.800 0.000 1.800 peak 888 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 889} (( segid " " and resid 13 and name HA )) (( segid " " and resid 27 and name HN )) 1.800 0.000 1.800 peak 889 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 890} (( segid " " and resid 13 and name HB )) (( segid " " and resid 14 and name HN )) 1.800 0.000 1.800 peak 890 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 891} (( segid " " and resid 13 and name HB )) (( segid " " and resid 13 and name HA )) 1.800 0.000 1.800 peak 891 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 892} ( segid " " and resid 13 and name HG1*) (( segid " " and resid 26 and name HA )) 1.800 0.000 3.200 peak 892 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 893} ( segid " " and resid 13 and name HG1*) ( segid " " and resid 104 and name HD1*) 1.800 0.000 3.200 peak 893 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 894} ( segid " " and resid 13 and name HG1*) ( segid " " and resid 104 and name HG2*) 1.800 0.000 1.800 peak 894 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 895} ( segid " " and resid 13 and name HG1*) (( segid " " and resid 14 and name HN )) 1.800 0.000 1.800 peak 895 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 896} ( segid " " and resid 13 and name HG1*) ( segid " " and resid 102 and name HD1*) 1.800 0.000 1.800 peak 896 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 897} ( segid " " and resid 13 and name HG1*) (( segid " " and resid 102 and name HG )) 1.800 0.000 1.800 peak 897 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 898} ( segid " " and resid 13 and name HG1*) (( segid " " and resid 13 and name HA )) 1.800 0.000 1.800 peak 898 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 899} ( segid " " and resid 13 and name HG1*) (( segid " " and resid 13 and name HB )) 1.800 0.000 0.900 peak 899 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 900} ( segid " " and resid 13 and name HG1*) (( segid " " and resid 13 and name HN )) 1.800 0.000 0.900 peak 900 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 901} ( segid " " and resid 13 and name HG2*) (( segid " " and resid 102 and name HN )) 1.800 0.000 3.200 peak 901 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 902} ( segid " " and resid 13 and name HG2*) (( segid " " and resid 13 and name HA )) 1.800 0.000 3.200 peak 902 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 903} ( segid " " and resid 13 and name HG2*) (( segid " " and resid 13 and name HN )) 1.800 0.000 3.200 peak 903 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 904} (( segid " " and resid 13 and name HN )) (( segid " " and resid 103 and name HA )) 1.800 0.000 3.200 peak 904 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 905} (( segid " " and resid 13 and name HN )) (( segid " " and resid 12 and name HA )) 1.800 0.000 0.900 peak 905 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 906} (( segid " " and resid 13 and name HN )) (( segid " " and resid 104 and name HN )) 1.800 0.000 1.800 peak 906 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 907} (( segid " " and resid 13 and name HN )) (( segid " " and resid 102 and name HN )) 1.800 0.000 3.200 peak 907 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 908} (( segid " " and resid 13 and name HN )) (( segid " " and resid 13 and name HA )) 1.800 0.000 3.200 peak 908 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 909} (( segid " " and resid 13 and name HN )) (( segid " " and resid 13 and name HB )) 1.800 0.000 3.200 peak 909 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 910} (( segid " " and resid 13 and name HN )) ( segid " " and resid 13 and name HG1*) 1.800 0.000 1.800 peak 910 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 910} (( segid " " and resid 13 and name HN )) ( segid " " and resid 13 and name HG2*) ASSI { 912} (( segid " " and resid 14 and name HA )) (( segid " " and resid 15 and name HB* )) 1.800 0.000 3.200 peak 912 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 913} (( segid " " and resid 14 and name HA )) (( segid " " and resid 15 and name HN )) 1.800 0.000 0.900 peak 913 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 914} (( segid " " and resid 14 and name HB* )) (( segid " " and resid 14 and name HA )) 1.800 0.000 1.800 peak 914 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 915} (( segid " " and resid 14 and name HB* )) (( segid " " and resid 14 and name HN )) 1.800 0.000 1.800 peak 915 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 916} ( segid " " and resid 14 and name HD1*) (( segid " " and resid 14 and name HN )) 1.800 0.000 3.200 peak 916 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 916} ( segid " " and resid 14 and name HD2*) (( segid " " and resid 14 and name HN )) ASSI { 917} (( segid " " and resid 14 and name HG )) (( segid " " and resid 14 and name HN )) 1.800 0.000 3.200 peak 917 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 918} (( segid " " and resid 14 and name HN )) (( segid " " and resid 26 and name HA )) 1.800 0.000 3.200 peak 918 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 919} (( segid " " and resid 14 and name HN )) (( segid " " and resid 14 and name HA )) 1.800 0.000 3.200 peak 919 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 920} (( segid " " and resid 14 and name HN )) (( segid " " and resid 15 and name HN )) 1.800 0.000 3.200 peak 920 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 921} (( segid " " and resid 14 and name HN )) (( segid " " and resid 13 and name HA )) 1.800 0.000 0.900 peak 921 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 922} (( segid " " and resid 14 and name HN )) ( segid " " and resid 27 and name HG1*) 1.800 0.000 1.800 peak 922 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 923} (( segid " " and resid 15 and name HA )) (( segid " " and resid 24 and name HA )) 1.800 0.000 1.800 peak 923 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 924} (( segid " " and resid 15 and name HA )) ( segid " " and resid 24 and name HB* ) 1.800 0.000 1.800 peak 924 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 925} (( segid " " and resid 15 and name HA )) (( segid " " and resid 23 and name HN )) 1.800 0.000 3.200 peak 925 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 927} (( segid " " and resid 15 and name HB* )) ( segid " " and resid 24 and name HB* ) 1.800 0.000 1.800 peak 927 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 928} (( segid " " and resid 15 and name HB* )) ( segid " " and resid 133 and name HD1*) 1.800 0.000 1.800 peak 928 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 929} (( segid " " and resid 15 and name HB* )) ( segid " " and resid 133 and name HG2*) 1.800 0.000 1.800 peak 929 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 930} (( segid " " and resid 15 and name HB* )) ( segid " " and resid 102 and name HD1*) 1.800 0.000 0.900 peak 930 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 931} (( segid " " and resid 15 and name HB* )) (( segid " " and resid 15 and name HA )) 1.800 0.000 1.800 peak 931 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 932} (( segid " " and resid 15 and name HN )) (( segid " " and resid 100 and name HN )) 1.800 0.000 3.200 peak 932 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 933} (( segid " " and resid 15 and name HN )) (( segid " " and resid 102 and name HN )) 1.800 0.000 3.200 peak 933 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 934} (( segid " " and resid 15 and name HN )) (( segid " " and resid 15 and name HA )) 1.800 0.000 3.200 peak 934 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 935} (( segid " " and resid 15 and name HN )) (( segid " " and resid 15 and name HB* )) 1.800 0.000 1.800 peak 935 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 936} (( segid " " and resid 15 and name HN )) (( segid " " and resid 98 and name HA )) 1.800 0.000 3.200 peak 936 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 937} (( segid " " and resid 16 and name HA )) (( segid " " and resid 16 and name HB* )) 1.800 0.000 3.200 peak 937 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 938} (( segid " " and resid 16 and name HA )) ( segid " " and resid 95 and name HG2*) 1.800 0.000 3.200 peak 938 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 940} (( segid " " and resid 16 and name HA )) ( segid " " and resid 98 and name HG1*) 1.800 0.000 3.200 peak 940 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 941} (( segid " " and resid 16 and name HB* )) (( segid " " and resid 99 and name HN )) 1.800 0.000 3.200 peak 941 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 945} (( segid " " and resid 16 and name HB* )) (( segid " " and resid 17 and name HN )) 1.800 0.000 1.800 peak 945 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 946} (( segid " " and resid 16 and name HB* )) (( segid " " and resid 16 and name HA )) 1.800 0.000 1.800 peak 946 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 947} (( segid " " and resid 16 and name HB* )) (( segid " " and resid 98 and name HA )) 1.800 0.000 3.200 peak 947 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 948} ( segid " " and resid 16 and name HD* ) (( segid " " and resid 97 and name HN )) 1.800 0.000 3.200 peak 948 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 949} ( segid " " and resid 16 and name HD* ) ( segid " " and resid 18 and name HD1*) 1.800 0.000 3.200 peak 949 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 950} ( segid " " and resid 16 and name HD* ) ( segid " " and resid 82 and name HD1*) 1.800 0.000 1.800 peak 950 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 951} ( segid " " and resid 16 and name HD* ) (( segid " " and resid 16 and name HA )) 1.800 0.000 3.200 peak 951 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 952} ( segid " " and resid 16 and name HE* ) (( segid " " and resid 24 and name HA )) 1.800 0.000 3.200 peak 952 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 953} ( segid " " and resid 16 and name HE* ) ( segid " " and resid 18 and name HD1*) 1.800 0.000 1.800 peak 953 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 954} ( segid " " and resid 16 and name HE* ) ( segid " " and resid 82 and name HD1*) 1.800 0.000 1.800 peak 954 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 955} (( segid " " and resid 16 and name HN )) (( segid " " and resid 24 and name HA )) 1.800 0.000 3.200 peak 955 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 956} (( segid " " and resid 16 and name HN )) ( segid " " and resid 24 and name HB* ) 1.800 0.000 3.200 peak 956 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 957} (( segid " " and resid 16 and name HN )) (( segid " " and resid 17 and name HA )) 1.800 0.000 3.200 peak 957 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 958} (( segid " " and resid 16 and name HN )) (( segid " " and resid 16 and name HA )) 1.800 0.000 3.200 peak 958 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 959} (( segid " " and resid 16 and name HN )) ( segid " " and resid 16 and name HD* ) 1.800 0.000 3.200 peak 959 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 960} (( segid " " and resid 16 and name HN )) (( segid " " and resid 15 and name HA )) 1.800 0.000 0.900 peak 960 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 961} (( segid " " and resid 16 and name HN )) (( segid " " and resid 15 and name HB* )) 1.800 0.000 1.800 peak 961 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 962} (( segid " " and resid 16 and name HN )) ( segid " " and resid 98 and name HG2*) 1.800 0.000 1.800 peak 962 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 963} (( segid " " and resid 17 and name HA )) (( segid " " and resid 22 and name HA )) 1.800 0.000 1.800 peak 963 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 964} (( segid " " and resid 17 and name HA )) ( segid " " and resid 22 and name HB* ) 1.800 0.000 1.800 peak 964 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 965} (( segid " " and resid 17 and name HA )) (( segid " " and resid 17 and name HG* )) 1.800 0.000 1.800 peak 965 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 966} (( segid " " and resid 17 and name HB* )) (( segid " " and resid 17 and name HA )) 1.800 0.000 1.800 peak 966 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 968} (( segid " " and resid 17 and name HG* )) (( segid " " and resid 17 and name HA )) 1.800 0.000 3.200 peak 968 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 969} (( segid " " and resid 17 and name HN )) (( segid " " and resid 97 and name HN )) 1.800 0.000 1.800 peak 969 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 970} (( segid " " and resid 17 and name HN )) (( segid " " and resid 17 and name HA )) 1.800 0.000 3.200 peak 970 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 971} (( segid " " and resid 17 and name HN )) (( segid " " and resid 17 and name HG* )) 1.800 0.000 3.200 peak 971 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 972} (( segid " " and resid 17 and name HN )) (( segid " " and resid 18 and name HN )) 1.800 0.000 3.200 peak 972 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 973} (( segid " " and resid 17 and name HN )) ( segid " " and resid 99 and name HD1*) 1.800 0.000 3.200 peak 973 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 975} (( segid " " and resid 17 and name HN )) (( segid " " and resid 16 and name HB* )) 1.800 0.000 1.800 peak 975 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 976} (( segid " " and resid 17 and name HN )) ( segid " " and resid 16 and name HD* ) 1.800 0.000 3.200 peak 976 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 977} (( segid " " and resid 17 and name HN )) (( segid " " and resid 98 and name HA )) 1.800 0.000 3.200 peak 977 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 978} (( segid " " and resid 17 and name HN )) (( segid " " and resid 98 and name HN )) 1.800 0.000 3.200 peak 978 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 979} (( segid " " and resid 18 and name HA )) (( segid " " and resid 19 and name HA )) 1.800 0.000 3.200 peak 979 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 980} (( segid " " and resid 18 and name HA )) ( segid " " and resid 71 and name HD1*) 1.800 0.000 3.200 peak 980 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 981} ( segid " " and resid 18 and name HD1*) (( segid " " and resid 66 and name HA )) 1.800 0.000 3.200 peak 981 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 982} ( segid " " and resid 18 and name HD1*) ( segid " " and resid 66 and name HB* ) 1.800 0.000 0.900 peak 982 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 983} ( segid " " and resid 18 and name HD1*) (( segid " " and resid 66 and name HN )) 1.800 0.000 3.200 peak 983 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 984} ( segid " " and resid 18 and name HD1*) (( segid " " and resid 19 and name HB* )) 1.800 0.000 3.200 peak 984 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 986} ( segid " " and resid 18 and name HD1*) (( segid " " and resid 18 and name HB )) 1.800 0.000 1.800 peak 986 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 988} ( segid " " and resid 18 and name HD1*) ( segid " " and resid 71 and name HD1*) 1.800 0.000 0.900 peak 988 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 989} ( segid " " and resid 18 and name HD1*) ( segid " " and resid 23 and name HD1*) 1.800 0.000 0.900 peak 989 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 989} ( segid " " and resid 18 and name HD1*) ( segid " " and resid 23 and name HD2*) ASSI { 990} ( segid " " and resid 18 and name HD1*) (( segid " " and resid 78 and name HA )) 1.800 0.000 3.200 peak 990 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 991} ( segid " " and resid 18 and name HD1*) ( segid " " and resid 78 and name HE* ) 1.800 0.000 0.900 peak 991 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 992} ( segid " " and resid 18 and name HD1*) ( segid " " and resid 73 and name HD* ) 1.800 0.000 3.200 peak 992 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 993} (( segid " " and resid 18 and name HG1*)) (( segid " " and resid 19 and name HN )) 1.800 0.000 3.200 peak 993 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 994} (( segid " " and resid 18 and name HG1*)) (( segid " " and resid 18 and name HN )) 1.800 0.000 3.200 peak 994 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 995} ( segid " " and resid 18 and name HG2*) (( segid " " and resid 66 and name HA )) 1.800 0.000 3.200 peak 995 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 996} ( segid " " and resid 18 and name HG2*) ( segid " " and resid 66 and name HB* ) 1.800 0.000 1.800 peak 996 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 997} ( segid " " and resid 18 and name HG2*) (( segid " " and resid 19 and name HB* )) 1.800 0.000 1.800 peak 997 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 998} ( segid " " and resid 18 and name HG2*) (( segid " " and resid 18 and name HA )) 1.800 0.000 0.900 peak 998 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 999} ( segid " " and resid 18 and name HG2*) (( segid " " and resid 18 and name HN )) 1.800 0.000 3.200 peak 999 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1000} ( segid " " and resid 18 and name HG2*) (( segid " " and resid 71 and name HB )) 1.800 0.000 1.800 peak 1000 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1001} ( segid " " and resid 18 and name HG2*) ( segid " " and resid 71 and name HD1*) 1.800 0.000 0.900 peak 1001 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1002} ( segid " " and resid 18 and name HG2*) ( segid " " and resid 23 and name HD1*) 1.800 0.000 3.200 peak 1002 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1002} ( segid " " and resid 18 and name HG2*) ( segid " " and resid 23 and name HD2*) ASSI { 1003} ( segid " " and resid 18 and name HG2*) ( segid " " and resid 78 and name HE* ) 1.800 0.000 3.200 peak 1003 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1004} ( segid " " and resid 18 and name HG2*) ( segid " " and resid 73 and name HD* ) 1.800 0.000 1.800 peak 1004 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1005} (( segid " " and resid 18 and name HN )) (( segid " " and resid 22 and name HA )) 1.800 0.000 3.200 peak 1005 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1006} (( segid " " and resid 18 and name HN )) (( segid " " and resid 19 and name HN )) 1.800 0.000 3.200 peak 1006 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1007} (( segid " " and resid 18 and name HN )) (( segid " " and resid 17 and name HA )) 1.800 0.000 0.900 peak 1007 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1008} (( segid " " and resid 18 and name HN )) (( segid " " and resid 18 and name HA )) 1.800 0.000 3.200 peak 1008 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1009} (( segid " " and resid 18 and name HN )) (( segid " " and resid 18 and name HB )) 1.800 0.000 3.200 peak 1009 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1010} (( segid " " and resid 18 and name HN )) ( segid " " and resid 18 and name HD1*) 1.800 0.000 3.200 peak 1010 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1011} (( segid " " and resid 19 and name HA )) (( segid " " and resid 19 and name HB* )) 1.800 0.000 0.900 peak 1011 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1012} (( segid " " and resid 19 and name HA )) (( segid " " and resid 21 and name HN )) 1.800 0.000 3.200 peak 1012 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1013} (( segid " " and resid 19 and name HA )) ( segid " " and resid 18 and name HG2*) 1.800 0.000 3.200 peak 1013 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1018} (( segid " " and resid 19 and name HB* )) (( segid " " and resid 19 and name HA )) 1.800 0.000 1.800 peak 1018 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1020} (( segid " " and resid 19 and name HB* )) (( segid " " and resid 19 and name HN )) 1.800 0.000 3.200 peak 1020 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1021} (( segid " " and resid 19 and name HB* )) (( segid " " and resid 20 and name HB* )) 1.800 0.000 3.200 peak 1021 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1022} (( segid " " and resid 19 and name HB* )) (( segid " " and resid 20 and name HN )) 1.800 0.000 1.800 peak 1022 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1023} (( segid " " and resid 19 and name HB* )) ( segid " " and resid 18 and name HD1*) 1.800 0.000 3.200 peak 1023 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1024} (( segid " " and resid 19 and name HN )) (( segid " " and resid 19 and name HA )) 1.800 0.000 1.800 peak 1024 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1025} (( segid " " and resid 19 and name HN )) (( segid " " and resid 19 and name HB* )) 1.800 0.000 3.200 peak 1025 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1026} (( segid " " and resid 19 and name HN )) (( segid " " and resid 21 and name HN )) 1.800 0.000 3.200 peak 1026 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1027} (( segid " " and resid 19 and name HN )) (( segid " " and resid 20 and name HN )) 1.800 0.000 3.200 peak 1027 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1028} (( segid " " and resid 19 and name HN )) (( segid " " and resid 18 and name HA )) 1.800 0.000 1.800 peak 1028 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1029} (( segid " " and resid 20 and name HB* )) (( segid " " and resid 20 and name HA )) 1.800 0.000 0.900 peak 1029 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1030} (( segid " " and resid 20 and name HB* )) (( segid " " and resid 20 and name HN )) 1.800 0.000 3.200 peak 1030 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1031} (( segid " " and resid 20 and name HG* )) (( segid " " and resid 20 and name HA )) 1.800 0.000 0.900 peak 1031 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1032} (( segid " " and resid 20 and name HG* )) (( segid " " and resid 20 and name HB* )) 1.800 0.000 0.900 peak 1032 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1033} (( segid " " and resid 20 and name HN )) (( segid " " and resid 19 and name HA )) 1.800 0.000 1.800 peak 1033 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1034} (( segid " " and resid 20 and name HN )) (( segid " " and resid 19 and name HB* )) 1.800 0.000 3.200 peak 1034 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1035} (( segid " " and resid 20 and name HN )) (( segid " " and resid 21 and name HN )) 1.800 0.000 1.800 peak 1035 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1036} (( segid " " and resid 20 and name HN )) (( segid " " and resid 20 and name HA )) 1.800 0.000 0.900 peak 1036 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1037} (( segid " " and resid 20 and name HN )) (( segid " " and resid 20 and name HG* )) 1.800 0.000 1.800 peak 1037 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1038} (( segid " " and resid 21 and name HB* )) ( segid " " and resid 22 and name HB* ) 1.800 0.000 3.200 peak 1038 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1039} (( segid " " and resid 21 and name HB* )) (( segid " " and resid 21 and name HA )) 1.800 0.000 0.900 peak 1039 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1040} (( segid " " and resid 21 and name HE2*)) (( segid " " and resid 22 and name HN )) 1.800 0.000 3.200 peak 1040 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1041} (( segid " " and resid 21 and name HE2*)) (( segid " " and resid 21 and name HB* )) 1.800 0.000 1.800 peak 1041 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1042} (( segid " " and resid 21 and name HE2*)) (( segid " " and resid 21 and name HG* )) 1.800 0.000 1.800 peak 1042 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1043} (( segid " " and resid 21 and name HG* )) (( segid " " and resid 21 and name HA )) 1.800 0.000 1.800 peak 1043 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1044} (( segid " " and resid 21 and name HG* )) (( segid " " and resid 21 and name HB* )) 1.800 0.000 3.200 peak 1044 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1045} (( segid " " and resid 21 and name HG* )) ( segid " " and resid 134 and name HD1*) 1.800 0.000 0.900 peak 1045 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1046} (( segid " " and resid 21 and name HG* )) ( segid " " and resid 23 and name HD2*) 1.800 0.000 3.200 peak 1046 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1049} (( segid " " and resid 21 and name HG* )) ( segid " " and resid 134 and name HD1*) 1.800 0.000 1.800 peak 1049 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1050} (( segid " " and resid 21 and name HN )) (( segid " " and resid 21 and name HA )) 1.800 0.000 1.800 peak 1050 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1051} (( segid " " and resid 21 and name HN )) (( segid " " and resid 21 and name HB* )) 1.800 0.000 1.800 peak 1051 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1052} (( segid " " and resid 21 and name HN )) (( segid " " and resid 21 and name HG* )) 1.800 0.000 1.800 peak 1052 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1053} (( segid " " and resid 21 and name HN )) (( segid " " and resid 20 and name HA )) 1.800 0.000 3.200 peak 1053 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1054} ( segid " " and resid 22 and name HB* ) (( segid " " and resid 22 and name HA )) 1.800 0.000 0.900 peak 1054 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1055} ( segid " " and resid 22 and name HB* ) (( segid " " and resid 133 and name HA )) 1.800 0.000 1.800 peak 1055 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1056} ( segid " " and resid 22 and name HB* ) ( segid " " and resid 133 and name HD1*) 1.800 0.000 0.900 peak 1056 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1057} ( segid " " and resid 22 and name HB* ) ( segid " " and resid 133 and name HG2*) 1.800 0.000 1.800 peak 1057 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1058} ( segid " " and resid 22 and name HB* ) ( segid " " and resid 126 and name HG2*) 1.800 0.000 3.200 peak 1058 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1059} (( segid " " and resid 22 and name HN )) (( segid " " and resid 22 and name HA )) 1.800 0.000 1.800 peak 1059 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1060} (( segid " " and resid 22 and name HN )) ( segid " " and resid 22 and name HB* ) 1.800 0.000 0.900 peak 1060 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1061} (( segid " " and resid 22 and name HN )) (( segid " " and resid 21 and name HA )) 1.800 0.000 0.900 peak 1061 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1062} (( segid " " and resid 23 and name HA )) (( segid " " and resid 133 and name HA )) 1.800 0.000 3.200 peak 1062 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1063} (( segid " " and resid 23 and name HA )) ( segid " " and resid 133 and name HG2*) 1.800 0.000 1.800 peak 1063 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1064} (( segid " " and resid 23 and name HA )) (( segid " " and resid 134 and name HA )) 1.800 0.000 3.200 peak 1064 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1065} (( segid " " and resid 23 and name HA )) (( segid " " and resid 23 and name HN )) 1.800 0.000 3.200 peak 1065 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1066} (( segid " " and resid 23 and name HB* )) (( segid " " and resid 23 and name HA )) 1.800 0.000 3.200 peak 1066 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1067} ( segid " " and resid 23 and name HD2*) ( segid " " and resid 66 and name HB* ) 1.800 0.000 3.200 peak 1067 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1068} ( segid " " and resid 23 and name HD2*) ( segid " " and resid 18 and name HD1*) 1.800 0.000 0.900 peak 1068 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1069} ( segid " " and resid 23 and name HD2*) ( segid " " and resid 18 and name HG2*) 1.800 0.000 0.900 peak 1069 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1070} ( segid " " and resid 23 and name HD2*) ( segid " " and resid 71 and name HD1*) 1.800 0.000 0.900 peak 1070 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1071} ( segid " " and resid 23 and name HD2*) (( segid " " and resid 134 and name HA )) 1.800 0.000 3.200 peak 1071 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1072} ( segid " " and resid 23 and name HD2*) (( segid " " and resid 23 and name HA )) 1.800 0.000 1.800 peak 1072 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1073} ( segid " " and resid 23 and name HD2*) (( segid " " and resid 23 and name HB* )) 1.800 0.000 1.800 peak 1073 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1074} ( segid " " and resid 23 and name HD2*) (( segid " " and resid 23 and name HG )) 1.800 0.000 3.200 peak 1074 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1075} ( segid " " and resid 23 and name HD2*) ( segid " " and resid 16 and name HD* ) 1.800 0.000 1.800 peak 1075 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1076} ( segid " " and resid 23 and name HD2*) ( segid " " and resid 25 and name HD* ) 1.800 0.000 3.200 peak 1076 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1077} (( segid " " and resid 23 and name HG )) (( segid " " and resid 23 and name HB* )) 1.800 0.000 3.200 peak 1077 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1078} (( segid " " and resid 23 and name HN )) (( segid " " and resid 22 and name HA )) 1.800 0.000 0.900 peak 1078 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1079} (( segid " " and resid 23 and name HN )) (( segid " " and resid 17 and name HA )) 1.800 0.000 1.800 peak 1079 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1080} (( segid " " and resid 23 and name HN )) (( segid " " and resid 23 and name HB* )) 1.800 0.000 3.200 peak 1080 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1081} (( segid " " and resid 23 and name HN )) ( segid " " and resid 23 and name HD2*) 1.800 0.000 3.200 peak 1081 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1082} (( segid " " and resid 23 and name HN )) (( segid " " and resid 23 and name HG )) 1.800 0.000 3.200 peak 1082 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1083} (( segid " " and resid 23 and name HN )) (( segid " " and resid 16 and name HN )) 1.800 0.000 1.800 peak 1083 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1084} (( segid " " and resid 24 and name HA )) ( segid " " and resid 135 and name HD* ) 1.800 0.000 3.200 peak 1084 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1085} (( segid " " and resid 24 and name HA )) ( segid " " and resid 135 and name HE* ) 1.800 0.000 3.200 peak 1085 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1086} ( segid " " and resid 24 and name HB* ) (( segid " " and resid 24 and name HA )) 1.800 0.000 0.900 peak 1086 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1088} ( segid " " and resid 24 and name HB* ) ( segid " " and resid 104 and name HD1*) 1.800 0.000 0.900 peak 1088 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1089} ( segid " " and resid 24 and name HB* ) ( segid " " and resid 133 and name HD1*) 1.800 0.000 1.800 peak 1089 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1090} ( segid " " and resid 24 and name HB* ) ( segid " " and resid 133 and name HG2*) 1.800 0.000 0.900 peak 1090 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1091} ( segid " " and resid 24 and name HB* ) (( segid " " and resid 25 and name HA )) 1.800 0.000 3.200 peak 1091 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1094} ( segid " " and resid 24 and name HB* ) ( segid " " and resid 135 and name HE* ) 1.800 0.000 1.800 peak 1094 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1095} (( segid " " and resid 24 and name HN )) (( segid " " and resid 24 and name HA )) 1.800 0.000 1.800 peak 1095 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1096} (( segid " " and resid 24 and name HN )) ( segid " " and resid 133 and name HG2*) 1.800 0.000 1.800 peak 1096 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1097} (( segid " " and resid 24 and name HN )) (( segid " " and resid 23 and name HA )) 1.800 0.000 0.900 peak 1097 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1098} (( segid " " and resid 24 and name HN )) (( segid " " and resid 136 and name HN )) 1.800 0.000 3.200 peak 1098 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1099} (( segid " " and resid 24 and name HN )) (( segid " " and resid 135 and name HA )) 1.800 0.000 1.800 peak 1099 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1100} (( segid " " and resid 24 and name HN )) ( segid " " and resid 135 and name HD* ) 1.800 0.000 3.200 peak 1100 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1101} (( segid " " and resid 25 and name HA )) (( segid " " and resid 25 and name HB* )) 1.800 0.000 3.200 peak 1101 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1102} (( segid " " and resid 25 and name HA )) ( segid " " and resid 135 and name HE* ) 1.800 0.000 3.200 peak 1102 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1103} (( segid " " and resid 25 and name HB* )) ( segid " " and resid 30 and name HD1*) 1.800 0.000 1.800 peak 1103 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1104} (( segid " " and resid 25 and name HB* )) ( segid " " and resid 13 and name HG**) 1.800 0.000 3.200 peak 1104 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1108} (( segid " " and resid 25 and name HB* )) (( segid " " and resid 26 and name HN )) 1.800 0.000 1.800 peak 1108 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1109} (( segid " " and resid 25 and name HB* )) (( segid " " and resid 25 and name HA )) 1.800 0.000 1.800 peak 1109 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1111} (( segid " " and resid 25 and name HB* )) (( segid " " and resid 25 and name HN )) 1.800 0.000 1.800 peak 1111 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1112} ( segid " " and resid 25 and name HD* ) ( segid " " and resid 30 and name HD1*) 1.800 0.000 1.800 peak 1112 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1113} ( segid " " and resid 25 and name HD* ) ( segid " " and resid 141 and name HD1*) 1.800 0.000 1.800 peak 1113 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1114} ( segid " " and resid 25 and name HD* ) ( segid " " and resid 65 and name HD2*) 1.800 0.000 3.200 peak 1114 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1115} ( segid " " and resid 25 and name HD* ) (( segid " " and resid 25 and name HA )) 1.800 0.000 1.800 peak 1115 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1116} ( segid " " and resid 25 and name HD* ) (( segid " " and resid 25 and name HB* )) 1.800 0.000 1.800 peak 1116 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1118} ( segid " " and resid 25 and name HD* ) (( segid " " and resid 25 and name HB2 )) 1.800 0.000 1.800 peak 1118 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1120} ( segid " " and resid 25 and name HD* ) (( segid " " and resid 25 and name HN )) 1.800 0.000 3.200 peak 1120 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1121} ( segid " " and resid 25 and name HE* ) ( segid " " and resid 30 and name HD1*) 1.800 0.000 3.200 peak 1121 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1122} ( segid " " and resid 25 and name HE* ) ( segid " " and resid 141 and name HD1*) 1.800 0.000 1.800 peak 1122 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1123} ( segid " " and resid 25 and name HE* ) (( segid " " and resid 25 and name HA )) 1.800 0.000 3.200 peak 1123 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1125} (( segid " " and resid 25 and name HN )) (( segid " " and resid 14 and name HN )) 1.800 0.000 1.800 peak 1125 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1126} (( segid " " and resid 25 and name HN )) (( segid " " and resid 25 and name HA )) 1.800 0.000 3.200 peak 1126 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1127} (( segid " " and resid 25 and name HN )) (( segid " " and resid 25 and name HB* )) 1.800 0.000 3.200 peak 1127 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1128} (( segid " " and resid 25 and name HN )) ( segid " " and resid 25 and name HE* ) 1.800 0.000 3.200 peak 1128 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1129} (( segid " " and resid 25 and name HN )) ( segid " " and resid 135 and name HE* ) 1.800 0.000 1.800 peak 1129 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1130} (( segid " " and resid 26 and name HA )) (( segid " " and resid 27 and name HN )) 1.800 0.000 0.900 peak 1130 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1131} (( segid " " and resid 26 and name HB* )) (( segid " " and resid 26 and name HA )) 1.800 0.000 3.200 peak 1131 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1132} (( segid " " and resid 26 and name HN )) (( segid " " and resid 26 and name HA )) 1.800 0.000 1.800 peak 1132 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1133} (( segid " " and resid 26 and name HN )) (( segid " " and resid 26 and name HB* )) 1.800 0.000 1.800 peak 1133 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1134} (( segid " " and resid 26 and name HN )) (( segid " " and resid 28 and name HN )) 1.800 0.000 3.200 peak 1134 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1135} (( segid " " and resid 26 and name HN )) ( segid " " and resid 30 and name HD1*) 1.800 0.000 3.200 peak 1135 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1136} (( segid " " and resid 26 and name HN )) (( segid " " and resid 25 and name HA )) 1.800 0.000 1.800 peak 1136 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1137} (( segid " " and resid 26 and name HN )) (( segid " " and resid 25 and name HB* )) 1.800 0.000 3.200 peak 1137 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1138} (( segid " " and resid 26 and name HN )) ( segid " " and resid 25 and name HD* ) 1.800 0.000 3.200 peak 1138 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1139} (( segid " " and resid 26 and name HN )) ( segid " " and resid 135 and name HD* ) 1.800 0.000 3.200 peak 1139 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1140} (( segid " " and resid 26 and name HN )) ( segid " " and resid 135 and name HE* ) 1.800 0.000 3.200 peak 1140 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1141} (( segid " " and resid 27 and name HA )) (( segid " " and resid 30 and name HB )) 1.800 0.000 3.200 peak 1141 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1142} (( segid " " and resid 27 and name HA )) ( segid " " and resid 30 and name HD1*) 1.800 0.000 3.200 peak 1142 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1143} (( segid " " and resid 27 and name HA )) (( segid " " and resid 30 and name HG1*)) 1.800 0.000 3.200 peak 1143 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1144} (( segid " " and resid 27 and name HA )) ( segid " " and resid 30 and name HG2*) 1.800 0.000 3.200 peak 1144 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1145} (( segid " " and resid 27 and name HA )) (( segid " " and resid 30 and name HN )) 1.800 0.000 3.200 peak 1145 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1146} (( segid " " and resid 27 and name HA )) (( segid " " and resid 27 and name HN )) 1.800 0.000 1.800 peak 1146 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1147} (( segid " " and resid 27 and name HB )) (( segid " " and resid 27 and name HA )) 1.800 0.000 1.800 peak 1147 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1148} ( segid " " and resid 27 and name HG1*) ( segid " " and resid 30 and name HD1*) 1.800 0.000 3.200 peak 1148 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1148} ( segid " " and resid 27 and name HG2*) ( segid " " and resid 30 and name HD1*) ASSI { 1149} ( segid " " and resid 27 and name HG1*) (( segid " " and resid 27 and name HA )) 1.800 0.000 0.900 peak 1149 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1149} ( segid " " and resid 27 and name HG2*) (( segid " " and resid 27 and name HA )) ASSI { 1150} ( segid " " and resid 27 and name HG1*) (( segid " " and resid 27 and name HB )) 1.800 0.000 3.200 peak 1150 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1150} ( segid " " and resid 27 and name HG2*) (( segid " " and resid 27 and name HB )) ASSI { 1151} ( segid " " and resid 27 and name HG2*) (( segid " " and resid 27 and name HN )) 1.800 0.000 1.800 peak 1151 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1151} ( segid " " and resid 27 and name HG1*) (( segid " " and resid 27 and name HN )) ASSI { 1152} ( segid " " and resid 27 and name HG1*) (( segid " " and resid 28 and name HN )) 1.800 0.000 3.200 peak 1152 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1153} ( segid " " and resid 27 and name HG1*) (( segid " " and resid 27 and name HN )) 1.800 0.000 1.800 peak 1153 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1154} ( segid " " and resid 27 and name HG2*) (( segid " " and resid 28 and name HN )) 1.800 0.000 3.200 peak 1154 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1155} (( segid " " and resid 27 and name HN )) (( segid " " and resid 28 and name HN )) 1.800 0.000 1.800 peak 1155 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1156} (( segid " " and resid 28 and name HB* )) (( segid " " and resid 28 and name HA )) 1.800 0.000 3.200 peak 1156 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1157} (( segid " " and resid 28 and name HN )) (( segid " " and resid 28 and name HA )) 1.800 0.000 1.800 peak 1157 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1158} (( segid " " and resid 28 and name HN )) (( segid " " and resid 28 and name HB* )) 1.800 0.000 1.800 peak 1158 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1159} (( segid " " and resid 28 and name HN )) (( segid " " and resid 27 and name HA )) 1.800 0.000 3.200 peak 1159 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1161} (( segid " " and resid 29 and name HB* )) (( segid " " and resid 29 and name HA )) 1.800 0.000 1.800 peak 1161 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1162} (( segid " " and resid 29 and name HB* )) ( segid " " and resid 138 and name HD1*) 1.800 0.000 3.200 peak 1162 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1165} (( segid " " and resid 29 and name HB* )) (( segid " " and resid 29 and name HA )) 1.800 0.000 1.800 peak 1165 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1167} (( segid " " and resid 29 and name HB* )) (( segid " " and resid 29 and name HN )) 1.800 0.000 1.800 peak 1167 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1168} (( segid " " and resid 29 and name HD21)) (( segid " " and resid 29 and name HA )) 1.800 0.000 1.800 peak 1168 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1168} (( segid " " and resid 29 and name HD22)) (( segid " " and resid 29 and name HA )) ASSI { 1169} (( segid " " and resid 29 and name HN )) (( segid " " and resid 29 and name HA )) 1.800 0.000 3.200 peak 1169 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1170} (( segid " " and resid 29 and name HN )) (( segid " " and resid 29 and name HB* )) 1.800 0.000 3.200 peak 1170 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1171} (( segid " " and resid 29 and name HN )) (( segid " " and resid 28 and name HA )) 1.800 0.000 3.200 peak 1171 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1172} (( segid " " and resid 29 and name HN )) (( segid " " and resid 28 and name HB* )) 1.800 0.000 3.200 peak 1172 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1173} (( segid " " and resid 29 and name HN )) (( segid " " and resid 28 and name HN )) 1.800 0.000 1.800 peak 1173 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1174} (( segid " " and resid 30 and name HA )) (( segid " " and resid 84 and name HA )) 1.800 0.000 1.800 peak 1174 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1175} (( segid " " and resid 30 and name HA )) ( segid " " and resid 84 and name HB* ) 1.800 0.000 1.800 peak 1175 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1176} ( segid " " and resid 30 and name HD1*) (( segid " " and resid 84 and name HA )) 1.800 0.000 1.800 peak 1176 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1177} ( segid " " and resid 30 and name HD1*) ( segid " " and resid 84 and name HB* ) 1.800 0.000 0.900 peak 1177 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1178} ( segid " " and resid 30 and name HD1*) (( segid " " and resid 84 and name HN )) 1.800 0.000 3.200 peak 1178 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1180} ( segid " " and resid 30 and name HD1*) (( segid " " and resid 30 and name HA )) 1.800 0.000 0.900 peak 1180 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1181} ( segid " " and resid 30 and name HD1*) (( segid " " and resid 30 and name HB )) 1.800 0.000 1.800 peak 1181 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1182} ( segid " " and resid 30 and name HD1*) (( segid " " and resid 30 and name HG1*)) 1.800 0.000 0.900 peak 1182 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1185} ( segid " " and resid 30 and name HD1*) ( segid " " and resid 30 and name HG2*) 1.800 0.000 0.900 peak 1185 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1186} (( segid " " and resid 30 and name HG1*)) (( segid " " and resid 30 and name HB )) 1.800 0.000 3.200 peak 1186 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1187} ( segid " " and resid 30 and name HG2*) (( segid " " and resid 84 and name HA )) 1.800 0.000 1.800 peak 1187 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1189} ( segid " " and resid 30 and name HG2*) (( segid " " and resid 30 and name HA )) 1.800 0.000 1.800 peak 1189 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1190} ( segid " " and resid 30 and name HG2*) (( segid " " and resid 30 and name HB )) 1.800 0.000 0.900 peak 1190 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1191} ( segid " " and resid 30 and name HG2*) (( segid " " and resid 30 and name HG1*)) 1.800 0.000 0.900 peak 1191 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1192} ( segid " " and resid 30 and name HG2*) (( segid " " and resid 30 and name HN )) 1.800 0.000 1.800 peak 1192 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1193} ( segid " " and resid 30 and name HG2*) ( segid " " and resid 138 and name HD1*) 1.800 0.000 3.200 peak 1193 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1194} ( segid " " and resid 30 and name HG2*) (( segid " " and resid 32 and name HN )) 1.800 0.000 1.800 peak 1194 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1195} (( segid " " and resid 30 and name HN )) (( segid " " and resid 29 and name HN )) 1.800 0.000 1.800 peak 1195 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1196} (( segid " " and resid 30 and name HN )) (( segid " " and resid 30 and name HA )) 1.800 0.000 3.200 peak 1196 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1197} (( segid " " and resid 30 and name HN )) (( segid " " and resid 30 and name HB )) 1.800 0.000 0.900 peak 1197 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1198} (( segid " " and resid 30 and name HN )) ( segid " " and resid 30 and name HD1*) 1.800 0.000 3.200 peak 1198 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1199} (( segid " " and resid 30 and name HN )) (( segid " " and resid 30 and name HG1*)) 1.800 0.000 1.800 peak 1199 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1200} (( segid " " and resid 31 and name HB* )) (( segid " " and resid 32 and name HN )) 1.800 0.000 1.800 peak 1200 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1202} (( segid " " and resid 31 and name HB* )) (( segid " " and resid 31 and name HN )) 1.800 0.000 3.200 peak 1202 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1203} (( segid " " and resid 31 and name HG* )) (( segid " " and resid 31 and name HB* )) 1.800 0.000 3.200 peak 1203 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1204} (( segid " " and resid 31 and name HG* )) (( segid " " and resid 31 and name HN )) 1.800 0.000 1.800 peak 1204 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1206} (( segid " " and resid 31 and name HG* )) (( segid " " and resid 31 and name HA )) 1.800 0.000 3.200 peak 1206 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1207} (( segid " " and resid 31 and name HN )) (( segid " " and resid 84 and name HA )) 1.800 0.000 1.800 peak 1207 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1208} (( segid " " and resid 31 and name HN )) (( segid " " and resid 85 and name HN )) 1.800 0.000 3.200 peak 1208 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1210} (( segid " " and resid 31 and name HN )) (( segid " " and resid 31 and name HB* )) 1.800 0.000 1.800 peak 1210 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1211} (( segid " " and resid 31 and name HN )) (( segid " " and resid 30 and name HA )) 1.800 0.000 1.800 peak 1211 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1212} (( segid " " and resid 32 and name HA )) (( segid " " and resid 32 and name HN )) 1.800 0.000 1.800 peak 1212 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1213} (( segid " " and resid 32 and name HA )) (( segid " " and resid 33 and name HN )) 1.800 0.000 1.800 peak 1213 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1214} (( segid " " and resid 32 and name HB* )) (( segid " " and resid 32 and name HA )) 1.800 0.000 3.200 peak 1214 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1215} ( segid " " and resid 32 and name HE* ) (( segid " " and resid 31 and name HA )) 1.800 0.000 1.800 peak 1215 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1216} ( segid " " and resid 32 and name HE* ) (( segid " " and resid 32 and name HA )) 1.800 0.000 1.800 peak 1216 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1217} ( segid " " and resid 32 and name HE* ) (( segid " " and resid 32 and name HB* )) 1.800 0.000 0.900 peak 1217 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1218} (( segid " " and resid 32 and name HG* )) (( segid " " and resid 32 and name HA )) 1.800 0.000 1.800 peak 1218 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1219} (( segid " " and resid 32 and name HG* )) (( segid " " and resid 32 and name HB* )) 1.800 0.000 3.200 peak 1219 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1220} (( segid " " and resid 32 and name HG* )) (( segid " " and resid 32 and name HN )) 1.800 0.000 3.200 peak 1220 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1221} (( segid " " and resid 32 and name HN )) (( segid " " and resid 31 and name HA )) 1.800 0.000 3.200 peak 1221 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1223} (( segid " " and resid 32 and name HN )) (( segid " " and resid 30 and name HA )) 1.800 0.000 3.200 peak 1223 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1224} (( segid " " and resid 32 and name HN )) (( segid " " and resid 32 and name HB* )) 1.800 0.000 3.200 peak 1224 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1225} (( segid " " and resid 32 and name HN )) (( segid " " and resid 83 and name HN )) 1.800 0.000 1.800 peak 1225 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1227} (( segid " " and resid 33 and name HN )) (( segid " " and resid 32 and name HB* )) 1.800 0.000 0.900 peak 1227 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1228} (( segid " " and resid 33 and name HN )) (( segid " " and resid 32 and name HG* )) 1.800 0.000 1.800 peak 1228 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1229} (( segid " " and resid 33 and name HN )) (( segid " " and resid 33 and name HA )) 1.800 0.000 3.200 peak 1229 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1230} (( segid " " and resid 33 and name HN )) ( segid " " and resid 33 and name HG2*) 1.800 0.000 3.200 peak 1230 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1230} (( segid " " and resid 33 and name HN )) ( segid " " and resid 33 and name HG1*) ASSI { 1231} (( segid " " and resid 34 and name HA )) (( segid " " and resid 81 and name HN )) 1.800 0.000 3.200 peak 1231 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1232} ( segid " " and resid 34 and name HD1*) (( segid " " and resid 34 and name HB )) 1.800 0.000 0.900 peak 1232 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1234} (( segid " " and resid 34 and name HN )) (( segid " " and resid 81 and name HN )) 1.800 0.000 3.200 peak 1234 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1236} (( segid " " and resid 35 and name HA )) (( segid " " and resid 36 and name HN )) 1.800 0.000 0.900 peak 1236 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1237} (( segid " " and resid 35 and name HB* )) (( segid " " and resid 35 and name HN )) 1.800 0.000 3.200 peak 1237 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1238} (( segid " " and resid 35 and name HG* )) (( segid " " and resid 35 and name HA )) 1.800 0.000 3.200 peak 1238 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1239} (( segid " " and resid 35 and name HG* )) (( segid " " and resid 35 and name HB* )) 1.800 0.000 3.200 peak 1239 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1240} (( segid " " and resid 35 and name HN )) (( segid " " and resid 35 and name HG* )) 1.800 0.000 1.800 peak 1240 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1241} (( segid " " and resid 35 and name HN )) (( segid " " and resid 34 and name HA )) 1.800 0.000 0.900 peak 1241 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1242} (( segid " " and resid 35 and name HN )) (( segid " " and resid 36 and name HN )) 1.800 0.000 3.200 peak 1242 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1243} (( segid " " and resid 36 and name HA )) ( segid " " and resid 81 and name HD1*) 1.800 0.000 1.800 peak 1243 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1244} (( segid " " and resid 36 and name HA )) (( segid " " and resid 37 and name HN )) 1.800 0.000 0.900 peak 1244 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1245} (( segid " " and resid 36 and name HN )) (( segid " " and resid 80 and name HA )) 1.800 0.000 1.800 peak 1245 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1246} (( segid " " and resid 37 and name HA )) (( segid " " and resid 38 and name HN )) 1.800 0.000 0.900 peak 1246 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1247} (( segid " " and resid 37 and name HA )) (( segid " " and resid 37 and name HN )) 1.800 0.000 1.800 peak 1247 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1248} (( segid " " and resid 37 and name HB* )) (( segid " " and resid 38 and name HN )) 1.800 0.000 1.800 peak 1248 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1249} (( segid " " and resid 37 and name HB* )) (( segid " " and resid 37 and name HA )) 1.800 0.000 0.900 peak 1249 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1250} (( segid " " and resid 37 and name HB* )) (( segid " " and resid 37 and name HN )) 1.800 0.000 1.800 peak 1250 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1252} (( segid " " and resid 37 and name HB* )) (( segid " " and resid 37 and name HA )) 1.800 0.000 3.200 peak 1252 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1253} (( segid " " and resid 37 and name HN )) ( segid " " and resid 81 and name HD1*) 1.800 0.000 1.800 peak 1253 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1254} (( segid " " and resid 38 and name HA )) (( segid " " and resid 38 and name HN )) 1.800 0.000 0.900 peak 1254 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1255} (( segid " " and resid 38 and name HB* )) (( segid " " and resid 38 and name HA )) 1.800 0.000 1.800 peak 1255 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1256} (( segid " " and resid 38 and name HB* )) (( segid " " and resid 38 and name HN )) 1.800 0.000 0.900 peak 1256 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1257} (( segid " " and resid 39 and name HA )) (( segid " " and resid 40 and name HA )) 1.800 0.000 3.200 peak 1257 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1258} (( segid " " and resid 39 and name HB )) (( segid " " and resid 39 and name HA )) 1.800 0.000 1.800 peak 1258 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1259} ( segid " " and resid 39 and name HD1*) (( segid " " and resid 39 and name HA )) 1.800 0.000 1.800 peak 1259 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1260} ( segid " " and resid 39 and name HD1*) (( segid " " and resid 39 and name HB )) 1.800 0.000 0.900 peak 1260 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1261} ( segid " " and resid 39 and name HD1*) (( segid " " and resid 39 and name HG1*)) 1.800 0.000 0.900 peak 1261 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1264} ( segid " " and resid 39 and name HD1*) (( segid " " and resid 39 and name HN )) 1.800 0.000 3.200 peak 1264 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1265} ( segid " " and resid 39 and name HD1*) (( segid " " and resid 40 and name HB )) 1.800 0.000 3.200 peak 1265 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1266} (( segid " " and resid 39 and name HG1*)) (( segid " " and resid 39 and name HA )) 1.800 0.000 3.200 peak 1266 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1267} ( segid " " and resid 39 and name HG2*) (( segid " " and resid 39 and name HA )) 1.800 0.000 0.900 peak 1267 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1268} ( segid " " and resid 39 and name HG2*) (( segid " " and resid 39 and name HB )) 1.800 0.000 0.900 peak 1268 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1269} ( segid " " and resid 39 and name HG2*) (( segid " " and resid 39 and name HG1*)) 1.800 0.000 0.900 peak 1269 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1272} ( segid " " and resid 39 and name HG2*) (( segid " " and resid 39 and name HN )) 1.800 0.000 3.200 peak 1272 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1273} ( segid " " and resid 39 and name HG2*) (( segid " " and resid 40 and name HA )) 1.800 0.000 1.800 peak 1273 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1274} ( segid " " and resid 39 and name HG2*) (( segid " " and resid 40 and name HB )) 1.800 0.000 0.900 peak 1274 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1275} ( segid " " and resid 39 and name HG2*) (( segid " " and resid 40 and name HN )) 1.800 0.000 1.800 peak 1275 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1276} (( segid " " and resid 39 and name HN )) (( segid " " and resid 39 and name HA )) 1.800 0.000 1.800 peak 1276 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1277} (( segid " " and resid 39 and name HN )) (( segid " " and resid 39 and name HB )) 1.800 0.000 1.800 peak 1277 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1278} (( segid " " and resid 40 and name HA )) (( segid " " and resid 41 and name HD* )) 1.800 0.000 1.800 peak 1278 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1279} (( segid " " and resid 40 and name HA )) (( segid " " and resid 43 and name HG* )) 1.800 0.000 1.800 peak 1279 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1280} (( segid " " and resid 40 and name HA )) ( segid " " and resid 52 and name HG2*) 1.800 0.000 3.200 peak 1280 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1281} (( segid " " and resid 40 and name HB )) (( segid " " and resid 41 and name HD* )) 1.800 0.000 3.200 peak 1281 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1282} (( segid " " and resid 40 and name HB )) (( segid " " and resid 43 and name HG* )) 1.800 0.000 3.200 peak 1282 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1283} (( segid " " and resid 40 and name HB )) (( segid " " and resid 40 and name HA )) 1.800 0.000 1.800 peak 1283 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1284} (( segid " " and resid 40 and name HB )) ( segid " " and resid 52 and name HG2*) 1.800 0.000 0.900 peak 1284 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1285} ( segid " " and resid 40 and name HG2*) (( segid " " and resid 41 and name HD* )) 1.800 0.000 1.800 peak 1285 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1286} ( segid " " and resid 40 and name HG2*) (( segid " " and resid 43 and name HG* )) 1.800 0.000 0.900 peak 1286 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1287} ( segid " " and resid 40 and name HG2*) (( segid " " and resid 40 and name HA )) 1.800 0.000 0.900 peak 1287 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1288} ( segid " " and resid 40 and name HG2*) (( segid " " and resid 40 and name HB )) 1.800 0.000 0.900 peak 1288 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1289} ( segid " " and resid 40 and name HG2*) (( segid " " and resid 40 and name HN )) 1.800 0.000 3.200 peak 1289 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1290} ( segid " " and resid 40 and name HG2*) ( segid " " and resid 52 and name HG1*) 1.800 0.000 0.900 peak 1290 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1291} (( segid " " and resid 40 and name HN )) (( segid " " and resid 39 and name HA )) 1.800 0.000 1.800 peak 1291 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1292} (( segid " " and resid 40 and name HN )) (( segid " " and resid 40 and name HA )) 1.800 0.000 3.200 peak 1292 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1294} (( segid " " and resid 40 and name HN )) ( segid " " and resid 52 and name HG2*) 1.800 0.000 3.200 peak 1294 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1295} (( segid " " and resid 41 and name HD* )) (( segid " " and resid 43 and name HB* )) 1.800 0.000 3.200 peak 1295 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1296} (( segid " " and resid 41 and name HD* )) (( segid " " and resid 43 and name HG* )) 1.800 0.000 1.800 peak 1296 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1297} (( segid " " and resid 42 and name HN )) (( segid " " and resid 43 and name HB* )) 1.800 0.000 3.200 peak 1297 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1298} (( segid " " and resid 43 and name HA )) (( segid " " and resid 45 and name HB* )) 1.800 0.000 3.200 peak 1298 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1299} (( segid " " and resid 43 and name HB* )) (( segid " " and resid 44 and name HN )) 1.800 0.000 1.800 peak 1299 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1300} (( segid " " and resid 43 and name HB* )) (( segid " " and resid 43 and name HA )) 1.800 0.000 0.900 peak 1300 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1301} (( segid " " and resid 43 and name HB* )) (( segid " " and resid 45 and name HB* )) 1.800 0.000 3.200 peak 1301 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1302} (( segid " " and resid 43 and name HD* )) (( segid " " and resid 44 and name HN )) 1.800 0.000 1.800 peak 1302 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1303} (( segid " " and resid 43 and name HD* )) (( segid " " and resid 43 and name HA )) 1.800 0.000 3.200 peak 1303 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1304} (( segid " " and resid 43 and name HD* )) (( segid " " and resid 43 and name HB* )) 1.800 0.000 3.200 peak 1304 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1305} (( segid " " and resid 43 and name HG* )) (( segid " " and resid 44 and name HN )) 1.800 0.000 3.200 peak 1305 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1306} (( segid " " and resid 43 and name HG* )) (( segid " " and resid 43 and name HA )) 1.800 0.000 1.800 peak 1306 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1309} (( segid " " and resid 43 and name HG* )) (( segid " " and resid 43 and name HB* )) 1.800 0.000 3.200 peak 1309 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1310} (( segid " " and resid 44 and name HA )) (( segid " " and resid 45 and name HN )) 1.800 0.000 1.800 peak 1310 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1312} (( segid " " and resid 44 and name HB* )) (( segid " " and resid 45 and name HA )) 1.800 0.000 1.800 peak 1312 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1313} (( segid " " and resid 44 and name HE* )) (( segid " " and resid 44 and name HB* )) 1.800 0.000 1.800 peak 1313 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1314} (( segid " " and resid 44 and name HE* )) (( segid " " and resid 45 and name HA )) 1.800 0.000 1.800 peak 1314 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1315} (( segid " " and resid 44 and name HG* )) (( segid " " and resid 44 and name HA )) 1.800 0.000 3.200 peak 1315 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1316} (( segid " " and resid 44 and name HG* )) (( segid " " and resid 44 and name HB* )) 1.800 0.000 0.900 peak 1316 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1317} (( segid " " and resid 44 and name HN )) (( segid " " and resid 44 and name HA )) 1.800 0.000 0.900 peak 1317 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1318} (( segid " " and resid 44 and name HN )) (( segid " " and resid 43 and name HA )) 1.800 0.000 1.800 peak 1318 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1319} (( segid " " and resid 44 and name HN )) (( segid " " and resid 43 and name HB* )) 1.800 0.000 1.800 peak 1319 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1321} (( segid " " and resid 44 and name HN )) (( segid " " and resid 45 and name HN )) 1.800 0.000 3.200 peak 1321 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1322} (( segid " " and resid 45 and name HA )) (( segid " " and resid 45 and name HG )) 1.800 0.000 3.200 peak 1322 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1323} (( segid " " and resid 45 and name HA )) (( segid " " and resid 45 and name HN )) 1.800 0.000 3.200 peak 1323 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1324} (( segid " " and resid 45 and name HB* )) (( segid " " and resid 45 and name HA )) 1.800 0.000 3.200 peak 1324 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1325} (( segid " " and resid 45 and name HB* )) (( segid " " and resid 45 and name HN )) 1.800 0.000 3.200 peak 1325 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1326} (( segid " " and resid 45 and name HN )) (( segid " " and resid 46 and name HN )) 1.800 0.000 3.200 peak 1326 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1327} (( segid " " and resid 45 and name HN )) (( segid " " and resid 47 and name HN )) 1.800 0.000 3.200 peak 1327 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1328} (( segid " " and resid 47 and name HA )) (( segid " " and resid 47 and name HN )) 1.800 0.000 3.200 peak 1328 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1329} (( segid " " and resid 47 and name HB* )) (( segid " " and resid 47 and name HA )) 1.800 0.000 0.900 peak 1329 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1330} (( segid " " and resid 47 and name HB* )) ( segid " " and resid 48 and name HD* ) 1.800 0.000 3.200 peak 1330 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1331} (( segid " " and resid 47 and name HD2 )) (( segid " " and resid 47 and name HA )) 1.800 0.000 3.200 peak 1331 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1332} (( segid " " and resid 48 and name HA )) (( segid " " and resid 48 and name HB* )) 1.800 0.000 1.800 peak 1332 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1334} (( segid " " and resid 48 and name HB* )) (( segid " " and resid 48 and name HA )) 1.800 0.000 3.200 peak 1334 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1335} ( segid " " and resid 48 and name HD* ) ( segid " " and resid 68 and name HD1*) 1.800 0.000 1.800 peak 1335 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1336} ( segid " " and resid 48 and name HD* ) (( segid " " and resid 48 and name HA )) 1.800 0.000 1.800 peak 1336 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1337} ( segid " " and resid 48 and name HD* ) (( segid " " and resid 48 and name HB* )) 1.800 0.000 1.800 peak 1337 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1338} ( segid " " and resid 48 and name HE* ) ( segid " " and resid 68 and name HD1*) 1.800 0.000 3.200 peak 1338 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1339} ( segid " " and resid 48 and name HE* ) (( segid " " and resid 48 and name HA )) 1.800 0.000 3.200 peak 1339 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1340} (( segid " " and resid 48 and name HN )) (( segid " " and resid 49 and name HN )) 1.800 0.000 3.200 peak 1340 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1341} (( segid " " and resid 49 and name HA )) (( segid " " and resid 63 and name HA )) 1.800 0.000 1.800 peak 1341 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1342} (( segid " " and resid 49 and name HB )) (( segid " " and resid 49 and name HA )) 1.800 0.000 3.200 peak 1342 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1343} ( segid " " and resid 49 and name HG1*) (( segid " " and resid 51 and name HN )) 1.800 0.000 0.900 peak 1343 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1343} ( segid " " and resid 49 and name HG2*) (( segid " " and resid 51 and name HN )) ASSI { 1344} ( segid " " and resid 49 and name HG1*) (( segid " " and resid 49 and name HA )) 1.800 0.000 3.200 peak 1344 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1344} ( segid " " and resid 49 and name HG2*) (( segid " " and resid 49 and name HA )) ASSI { 1345} ( segid " " and resid 49 and name HG1*) (( segid " " and resid 49 and name HB )) 1.800 0.000 0.900 peak 1345 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1345} ( segid " " and resid 49 and name HG2*) (( segid " " and resid 49 and name HB )) ASSI { 1346} ( segid " " and resid 49 and name HG2*) (( segid " " and resid 49 and name HN )) 1.800 0.000 0.900 peak 1346 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1346} ( segid " " and resid 49 and name HG1*) (( segid " " and resid 49 and name HN )) ASSI { 1347} ( segid " " and resid 49 and name HG1*) (( segid " " and resid 62 and name HN )) 1.800 0.000 3.200 peak 1347 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1347} ( segid " " and resid 49 and name HG2*) (( segid " " and resid 62 and name HN )) ASSI { 1348} ( segid " " and resid 49 and name HG2*) (( segid " " and resid 50 and name HN )) 1.800 0.000 3.200 peak 1348 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1349} ( segid " " and resid 49 and name HG2*) (( segid " " and resid 49 and name HA )) 1.800 0.000 0.900 peak 1349 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1350} (( segid " " and resid 49 and name HN )) (( segid " " and resid 48 and name HA )) 1.800 0.000 1.800 peak 1350 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1351} (( segid " " and resid 49 and name HN )) (( segid " " and resid 49 and name HA )) 1.800 0.000 1.800 peak 1351 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1352} (( segid " " and resid 49 and name HN )) (( segid " " and resid 49 and name HB )) 1.800 0.000 0.900 peak 1352 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1353} (( segid " " and resid 49 and name HN )) ( segid " " and resid 49 and name HG2*) 1.800 0.000 1.800 peak 1353 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1354} (( segid " " and resid 50 and name HA )) (( segid " " and resid 50 and name HB* )) 1.800 0.000 0.900 peak 1354 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1355} (( segid " " and resid 50 and name HA )) (( segid " " and resid 51 and name HN )) 1.800 0.000 3.200 peak 1355 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1356} (( segid " " and resid 50 and name HB* )) (( segid " " and resid 51 and name HN )) 1.800 0.000 3.200 peak 1356 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1357} (( segid " " and resid 50 and name HG* )) (( segid " " and resid 50 and name HA )) 1.800 0.000 1.800 peak 1357 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1358} (( segid " " and resid 50 and name HG* )) (( segid " " and resid 50 and name HB* )) 1.800 0.000 0.900 peak 1358 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1359} (( segid " " and resid 50 and name HG* )) (( segid " " and resid 50 and name HN )) 1.800 0.000 1.800 peak 1359 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1360} (( segid " " and resid 50 and name HG* )) (( segid " " and resid 51 and name HN )) 1.800 0.000 1.800 peak 1360 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1361} (( segid " " and resid 50 and name HN )) (( segid " " and resid 50 and name HA )) 1.800 0.000 1.800 peak 1361 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1362} (( segid " " and resid 50 and name HN )) (( segid " " and resid 50 and name HB* )) 1.800 0.000 3.200 peak 1362 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1363} (( segid " " and resid 50 and name HN )) (( segid " " and resid 49 and name HA )) 1.800 0.000 0.900 peak 1363 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1364} (( segid " " and resid 50 and name HN )) (( segid " " and resid 63 and name HA )) 1.800 0.000 1.800 peak 1364 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1365} (( segid " " and resid 51 and name HA* )) ( segid " " and resid 52 and name HG2*) 1.800 0.000 3.200 peak 1365 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1366} (( segid " " and resid 51 and name HN )) (( segid " " and resid 50 and name HN )) 1.800 0.000 1.800 peak 1366 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1367} (( segid " " and resid 51 and name HN )) (( segid " " and resid 51 and name HA* )) 1.800 0.000 0.900 peak 1367 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1368} (( segid " " and resid 51 and name HN )) (( segid " " and resid 62 and name HN )) 1.800 0.000 1.800 peak 1368 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1369} (( segid " " and resid 52 and name HA )) (( segid " " and resid 61 and name HA )) 1.800 0.000 1.800 peak 1369 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1371} (( segid " " and resid 52 and name HB )) (( segid " " and resid 52 and name HA )) 1.800 0.000 1.800 peak 1371 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1372} ( segid " " and resid 52 and name HG2*) (( segid " " and resid 53 and name HN )) 1.800 0.000 3.200 peak 1372 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1372} ( segid " " and resid 52 and name HG1*) (( segid " " and resid 53 and name HN )) ASSI { 1373} ( segid " " and resid 52 and name HG1*) (( segid " " and resid 52 and name HA )) 1.800 0.000 0.900 peak 1373 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1373} ( segid " " and resid 52 and name HG2*) (( segid " " and resid 52 and name HA )) ASSI { 1374} ( segid " " and resid 52 and name HG1*) (( segid " " and resid 61 and name HA )) 1.800 0.000 0.900 peak 1374 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1375} ( segid " " and resid 52 and name HG1*) (( segid " " and resid 40 and name HB )) 1.800 0.000 1.800 peak 1375 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1376} ( segid " " and resid 52 and name HG1*) (( segid " " and resid 52 and name HA )) 1.800 0.000 0.900 peak 1376 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1377} ( segid " " and resid 52 and name HG1*) (( segid " " and resid 52 and name HB )) 1.800 0.000 0.900 peak 1377 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1378} ( segid " " and resid 52 and name HG2*) (( segid " " and resid 53 and name HA )) 1.800 0.000 3.200 peak 1378 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1379} ( segid " " and resid 52 and name HG2*) (( segid " " and resid 53 and name HN )) 1.800 0.000 0.900 peak 1379 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1380} ( segid " " and resid 52 and name HG2*) (( segid " " and resid 61 and name HA )) 1.800 0.000 3.200 peak 1380 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1381} ( segid " " and resid 52 and name HG2*) ( segid " " and resid 40 and name HG2*) 1.800 0.000 1.800 peak 1381 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1382} ( segid " " and resid 52 and name HG2*) (( segid " " and resid 52 and name HA )) 1.800 0.000 1.800 peak 1382 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1383} ( segid " " and resid 52 and name HG2*) (( segid " " and resid 52 and name HB )) 1.800 0.000 0.900 peak 1383 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1384} (( segid " " and resid 52 and name HN )) (( segid " " and resid 51 and name HA* )) 1.800 0.000 0.900 peak 1384 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1385} (( segid " " and resid 52 and name HN )) (( segid " " and resid 52 and name HA )) 1.800 0.000 3.200 peak 1385 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1386} (( segid " " and resid 52 and name HN )) ( segid " " and resid 52 and name HG2*) 1.800 0.000 0.900 peak 1386 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1386} (( segid " " and resid 52 and name HN )) ( segid " " and resid 52 and name HG1*) ASSI { 1387} (( segid " " and resid 52 and name HN )) ( segid " " and resid 52 and name HG1*) 1.800 0.000 3.200 peak 1387 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1388} (( segid " " and resid 52 and name HN )) ( segid " " and resid 52 and name HG2*) 1.800 0.000 0.900 peak 1388 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1389} (( segid " " and resid 53 and name HA )) (( segid " " and resid 53 and name HN )) 1.800 0.000 1.800 peak 1389 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1390} (( segid " " and resid 53 and name HB )) (( segid " " and resid 53 and name HN )) 1.800 0.000 3.200 peak 1390 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1391} (( segid " " and resid 53 and name HN )) (( segid " " and resid 53 and name HG1*)) 1.800 0.000 1.800 peak 1391 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1392} (( segid " " and resid 53 and name HN )) ( segid " " and resid 53 and name HG2*) 1.800 0.000 3.200 peak 1392 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1393} (( segid " " and resid 53 and name HN )) (( segid " " and resid 60 and name HN )) 1.800 0.000 1.800 peak 1393 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1394} (( segid " " and resid 53 and name HN )) (( segid " " and resid 52 and name HA )) 1.800 0.000 0.900 peak 1394 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1395} (( segid " " and resid 54 and name HA )) (( segid " " and resid 58 and name HN )) 1.800 0.000 3.200 peak 1395 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1396} (( segid " " and resid 54 and name HA )) (( segid " " and resid 59 and name HA )) 1.800 0.000 1.800 peak 1396 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1397} (( segid " " and resid 54 and name HA )) ( segid " " and resid 59 and name HD1*) 1.800 0.000 0.900 peak 1397 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1398} (( segid " " and resid 54 and name HA )) (( segid " " and resid 59 and name HG1*)) 1.800 0.000 3.200 peak 1398 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1399} (( segid " " and resid 54 and name HA )) ( segid " " and resid 59 and name HG2*) 1.800 0.000 3.200 peak 1399 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1400} (( segid " " and resid 54 and name HA )) (( segid " " and resid 60 and name HN )) 1.800 0.000 3.200 peak 1400 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1401} (( segid " " and resid 54 and name HB* )) (( segid " " and resid 54 and name HA )) 1.800 0.000 1.800 peak 1401 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1402} (( segid " " and resid 54 and name HB* )) ( segid " " and resid 59 and name HD1*) 1.800 0.000 3.200 peak 1402 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1405} (( segid " " and resid 54 and name HB* )) (( segid " " and resid 54 and name HA )) 1.800 0.000 1.800 peak 1405 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1407} (( segid " " and resid 54 and name HB* )) (( segid " " and resid 54 and name HN )) 1.800 0.000 1.800 peak 1407 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1409} (( segid " " and resid 54 and name HD2*)) (( segid " " and resid 54 and name HB* )) 1.800 0.000 1.800 peak 1409 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1410} (( segid " " and resid 54 and name HN )) (( segid " " and resid 54 and name HA )) 1.800 0.000 1.800 peak 1410 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1411} (( segid " " and resid 54 and name HN )) (( segid " " and resid 54 and name HB* )) 1.800 0.000 0.900 peak 1411 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1412} (( segid " " and resid 54 and name HN )) (( segid " " and resid 53 and name HA )) 1.800 0.000 0.900 peak 1412 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1413} (( segid " " and resid 54 and name HN )) (( segid " " and resid 55 and name HN )) 1.800 0.000 3.200 peak 1413 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1414} (( segid " " and resid 55 and name HA )) ( segid " " and resid 55 and name HD2*) 1.800 0.000 0.900 peak 1414 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1414} (( segid " " and resid 55 and name HA )) ( segid " " and resid 55 and name HD1*) ASSI { 1415} (( segid " " and resid 55 and name HB* )) (( segid " " and resid 56 and name HN )) 1.800 0.000 1.800 peak 1415 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1416} (( segid " " and resid 55 and name HB* )) (( segid " " and resid 55 and name HA )) 1.800 0.000 1.800 peak 1416 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1417} (( segid " " and resid 55 and name HG )) (( segid " " and resid 55 and name HA )) 1.800 0.000 1.800 peak 1417 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1418} (( segid " " and resid 55 and name HN )) (( segid " " and resid 54 and name HA )) 1.800 0.000 0.900 peak 1418 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1419} (( segid " " and resid 55 and name HN )) (( segid " " and resid 57 and name HN )) 1.800 0.000 3.200 peak 1419 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1420} (( segid " " and resid 55 and name HN )) (( segid " " and resid 55 and name HA )) 1.800 0.000 1.800 peak 1420 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1421} (( segid " " and resid 55 and name HN )) (( segid " " and resid 55 and name HB* )) 1.800 0.000 3.200 peak 1421 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1422} (( segid " " and resid 56 and name HN )) (( segid " " and resid 56 and name HA )) 1.800 0.000 0.900 peak 1422 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1423} (( segid " " and resid 56 and name HN )) (( segid " " and resid 57 and name HN )) 1.800 0.000 3.600 peak 1423 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1424} (( segid " " and resid 56 and name HN )) (( segid " " and resid 55 and name HA )) 1.800 0.000 0.900 peak 1424 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1425} (( segid " " and resid 57 and name HA1 )) (( segid " " and resid 57 and name HN )) 1.800 0.000 0.900 peak 1425 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1426} (( segid " " and resid 57 and name HA2 )) (( segid " " and resid 57 and name HA1 )) 1.800 0.000 0.900 peak 1426 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1427} (( segid " " and resid 57 and name HA2 )) (( segid " " and resid 57 and name HN )) 1.800 0.000 0.900 peak 1427 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1428} (( segid " " and resid 57 and name HN )) (( segid " " and resid 56 and name HA )) 1.800 0.000 0.900 peak 1428 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1429} (( segid " " and resid 57 and name HN )) (( segid " " and resid 57 and name HA* )) 1.800 0.000 0.900 peak 1429 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1430} (( segid " " and resid 58 and name HN )) (( segid " " and resid 58 and name HA )) 1.800 0.000 3.200 peak 1430 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1431} (( segid " " and resid 58 and name HN )) (( segid " " and resid 58 and name HB* )) 1.800 0.000 1.800 peak 1431 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1432} (( segid " " and resid 58 and name HN )) (( segid " " and resid 57 and name HA* )) 1.800 0.000 3.200 peak 1432 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1434} (( segid " " and resid 58 and name HN )) (( segid " " and resid 59 and name HN )) 1.800 0.000 3.200 peak 1434 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1435} (( segid " " and resid 58 and name HN )) (( segid " " and resid 55 and name HN )) 1.800 0.000 1.800 peak 1435 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1436} (( segid " " and resid 59 and name HA )) (( segid " " and resid 59 and name HN )) 1.800 0.000 3.200 peak 1436 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1437} (( segid " " and resid 59 and name HB )) (( segid " " and resid 59 and name HA )) 1.800 0.000 3.200 peak 1437 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1438} ( segid " " and resid 59 and name HD1*) (( segid " " and resid 54 and name HB* )) 1.800 0.000 1.800 peak 1438 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1439} ( segid " " and resid 59 and name HD1*) (( segid " " and resid 59 and name HA )) 1.800 0.000 0.900 peak 1439 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1440} ( segid " " and resid 59 and name HD1*) (( segid " " and resid 59 and name HB )) 1.800 0.000 0.900 peak 1440 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1441} ( segid " " and resid 59 and name HD1*) (( segid " " and resid 59 and name HG1*)) 1.800 0.000 0.900 peak 1441 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1445} ( segid " " and resid 59 and name HG2*) (( segid " " and resid 53 and name HN )) 1.800 0.000 3.200 peak 1445 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1446} ( segid " " and resid 59 and name HG2*) (( segid " " and resid 59 and name HA )) 1.800 0.000 0.900 peak 1446 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1447} ( segid " " and resid 59 and name HG2*) (( segid " " and resid 59 and name HB )) 1.800 0.000 0.900 peak 1447 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1448} ( segid " " and resid 59 and name HG2*) (( segid " " and resid 59 and name HG1*)) 1.800 0.000 0.900 peak 1448 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1451} ( segid " " and resid 59 and name HG2*) (( segid " " and resid 59 and name HN )) 1.800 0.000 1.800 peak 1451 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1453} (( segid " " and resid 59 and name HN )) (( segid " " and resid 58 and name HA )) 1.800 0.000 3.200 peak 1453 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1454} (( segid " " and resid 59 and name HN )) (( segid " " and resid 59 and name HB )) 1.800 0.000 1.800 peak 1454 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1455} (( segid " " and resid 59 and name HN )) (( segid " " and resid 60 and name HN )) 1.800 0.000 3.200 peak 1455 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1456} (( segid " " and resid 60 and name HA )) (( segid " " and resid 60 and name HN )) 1.800 0.000 1.800 peak 1456 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1457} ( segid " " and resid 60 and name HD1*) (( segid " " and resid 60 and name HN )) 1.800 0.000 1.800 peak 1457 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1458} ( segid " " and resid 60 and name HG2*) (( segid " " and resid 60 and name HA )) 1.800 0.000 1.800 peak 1458 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1459} ( segid " " and resid 60 and name HG2*) (( segid " " and resid 60 and name HB )) 1.800 0.000 0.900 peak 1459 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1460} ( segid " " and resid 60 and name HG2*) (( segid " " and resid 60 and name HG1*)) 1.800 0.000 0.900 peak 1460 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1461} ( segid " " and resid 60 and name HG2*) (( segid " " and resid 60 and name HN )) 1.800 0.000 1.800 peak 1461 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1462} ( segid " " and resid 60 and name HG2*) (( segid " " and resid 61 and name HG* )) 1.800 0.000 3.200 peak 1462 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1463} ( segid " " and resid 60 and name HG2*) (( segid " " and resid 91 and name HA )) 1.800 0.000 3.200 peak 1463 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1465} (( segid " " and resid 60 and name HN )) (( segid " " and resid 60 and name HB )) 1.800 0.000 3.200 peak 1465 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1466} (( segid " " and resid 60 and name HN )) (( segid " " and resid 60 and name HG1*)) 1.800 0.000 3.200 peak 1466 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1467} (( segid " " and resid 61 and name HB* )) (( segid " " and resid 61 and name HA )) 1.800 0.000 3.200 peak 1467 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1468} (( segid " " and resid 61 and name HB* )) ( segid " " and resid 91 and name HG1*) 1.800 0.000 3.200 peak 1468 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1470} (( segid " " and resid 61 and name HB* )) (( segid " " and resid 62 and name HN )) 1.800 0.000 3.200 peak 1470 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1471} (( segid " " and resid 61 and name HD* )) ( segid " " and resid 60 and name HG2*) 1.800 0.000 1.800 peak 1471 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1472} (( segid " " and resid 61 and name HD* )) (( segid " " and resid 61 and name HB* )) 1.800 0.000 3.200 peak 1472 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1473} (( segid " " and resid 61 and name HD* )) (( segid " " and resid 61 and name HG* )) 1.800 0.000 1.800 peak 1473 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1474} (( segid " " and resid 61 and name HG* )) (( segid " " and resid 61 and name HA )) 1.800 0.000 1.800 peak 1474 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1475} (( segid " " and resid 61 and name HG* )) (( segid " " and resid 61 and name HB* )) 1.800 0.000 0.900 peak 1475 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1476} (( segid " " and resid 61 and name HG* )) ( segid " " and resid 91 and name HG2*) 1.800 0.000 1.800 peak 1476 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1477} (( segid " " and resid 61 and name HG* )) ( segid " " and resid 91 and name HG1*) 1.800 0.000 1.800 peak 1477 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1478} (( segid " " and resid 62 and name HA )) (( segid " " and resid 62 and name HN )) 1.800 0.000 3.200 peak 1478 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1479} (( segid " " and resid 62 and name HB )) (( segid " " and resid 62 and name HN )) 1.800 0.000 1.800 peak 1479 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1480} ( segid " " and resid 62 and name HG2*) (( segid " " and resid 63 and name HN )) 1.800 0.000 3.200 peak 1480 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1480} ( segid " " and resid 62 and name HG1*) (( segid " " and resid 63 and name HN )) ASSI { 1481} ( segid " " and resid 62 and name HG1*) (( segid " " and resid 61 and name HD* )) 1.800 0.000 3.200 peak 1481 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1482} (( segid " " and resid 62 and name HN )) (( segid " " and resid 61 and name HA )) 1.800 0.000 0.900 peak 1482 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1483} (( segid " " and resid 62 and name HN )) (( segid " " and resid 61 and name HB* )) 1.800 0.000 3.200 peak 1483 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1484} (( segid " " and resid 62 and name HN )) (( segid " " and resid 61 and name HG* )) 1.800 0.000 3.200 peak 1484 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1485} (( segid " " and resid 62 and name HN )) (( segid " " and resid 52 and name HA )) 1.800 0.000 3.200 peak 1485 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1486} (( segid " " and resid 62 and name HN )) (( segid " " and resid 52 and name HN )) 1.800 0.000 3.200 peak 1486 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1487} (( segid " " and resid 62 and name HN )) ( segid " " and resid 62 and name HG2*) 1.800 0.000 0.900 peak 1487 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1487} (( segid " " and resid 62 and name HN )) ( segid " " and resid 62 and name HG1*) ASSI { 1488} (( segid " " and resid 62 and name HN )) ( segid " " and resid 62 and name HG2*) 1.800 0.000 3.200 peak 1488 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1489} (( segid " " and resid 62 and name HN )) (( segid " " and resid 63 and name HN )) 1.800 0.000 3.200 peak 1489 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1490} (( segid " " and resid 63 and name HB )) (( segid " " and resid 63 and name HA )) 1.800 0.000 1.800 peak 1490 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1491} ( segid " " and resid 63 and name HG2*) (( segid " " and resid 63 and name HB )) 1.800 0.000 3.200 peak 1491 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1491} ( segid " " and resid 63 and name HG1*) (( segid " " and resid 63 and name HB )) ASSI { 1492} ( segid " " and resid 63 and name HG2*) (( segid " " and resid 63 and name HN )) 1.800 0.000 3.200 peak 1492 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1492} ( segid " " and resid 63 and name HG1*) (( segid " " and resid 63 and name HN )) ASSI { 1493} ( segid " " and resid 63 and name HG2*) (( segid " " and resid 63 and name HA )) 1.800 0.000 1.800 peak 1493 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1494} ( segid " " and resid 63 and name HG1*) (( segid " " and resid 63 and name HA )) 1.800 0.000 1.800 peak 1494 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1495} (( segid " " and resid 63 and name HN )) (( segid " " and resid 64 and name HN )) 1.800 0.000 3.200 peak 1495 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1496} (( segid " " and resid 63 and name HN )) (( segid " " and resid 92 and name HN )) 1.800 0.000 3.200 peak 1496 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1497} (( segid " " and resid 63 and name HN )) (( segid " " and resid 94 and name HN )) 1.800 0.000 3.200 peak 1497 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1498} (( segid " " and resid 63 and name HN )) (( segid " " and resid 93 and name HA )) 1.800 0.000 1.800 peak 1498 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1500} (( segid " " and resid 63 and name HN )) (( segid " " and resid 63 and name HA )) 1.800 0.000 1.800 peak 1500 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1501} (( segid " " and resid 63 and name HN )) (( segid " " and resid 63 and name HB )) 1.800 0.000 1.800 peak 1501 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1502} (( segid " " and resid 64 and name HN )) (( segid " " and resid 64 and name HA )) 1.800 0.000 1.800 peak 1502 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1503} (( segid " " and resid 64 and name HN )) (( segid " " and resid 64 and name HB* )) 1.800 0.000 1.800 peak 1503 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1504} (( segid " " and resid 64 and name HN )) (( segid " " and resid 63 and name HA )) 1.800 0.000 1.800 peak 1504 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1505} (( segid " " and resid 64 and name HN )) ( segid " " and resid 63 and name HG2*) 1.800 0.000 1.800 peak 1505 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1507} (( segid " " and resid 65 and name HA )) ( segid " " and resid 68 and name HD1*) 1.800 0.000 1.800 peak 1507 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1509} (( segid " " and resid 65 and name HA )) (( segid " " and resid 65 and name HN )) 1.800 0.000 1.800 peak 1509 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1510} (( segid " " and resid 65 and name HB* )) (( segid " " and resid 65 and name HA )) 1.800 0.000 3.200 peak 1510 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1512} ( segid " " and resid 65 and name HD1*) (( segid " " and resid 65 and name HB* )) 1.800 0.000 3.200 peak 1512 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1513} ( segid " " and resid 65 and name HD1*) (( segid " " and resid 65 and name HG )) 1.800 0.000 3.200 peak 1513 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1515} ( segid " " and resid 65 and name HD2*) (( segid " " and resid 68 and name HN )) 1.800 0.000 3.200 peak 1515 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1516} ( segid " " and resid 65 and name HD2*) (( segid " " and resid 65 and name HA )) 1.800 0.000 3.200 peak 1516 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1517} ( segid " " and resid 65 and name HD2*) (( segid " " and resid 65 and name HB* )) 1.800 0.000 1.800 peak 1517 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1518} ( segid " " and resid 65 and name HD2*) (( segid " " and resid 65 and name HG )) 1.800 0.000 0.900 peak 1518 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1519} ( segid " " and resid 65 and name HD2*) ( segid " " and resid 25 and name HE* ) 1.800 0.000 1.800 peak 1519 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1520} (( segid " " and resid 65 and name HG )) (( segid " " and resid 68 and name HN )) 1.800 0.000 3.200 peak 1520 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1521} (( segid " " and resid 65 and name HG )) (( segid " " and resid 65 and name HA )) 1.800 0.000 3.200 peak 1521 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1522} (( segid " " and resid 65 and name HN )) (( segid " " and resid 64 and name HA )) 1.800 0.000 1.800 peak 1522 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1523} (( segid " " and resid 65 and name HN )) (( segid " " and resid 65 and name HB* )) 1.800 0.000 3.200 peak 1523 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1524} (( segid " " and resid 65 and name HN )) ( segid " " and resid 65 and name HD1*) 1.800 0.000 3.200 peak 1524 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1525} (( segid " " and resid 65 and name HN )) (( segid " " and resid 65 and name HG )) 1.800 0.000 3.200 peak 1525 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1526} (( segid " " and resid 65 and name HN )) (( segid " " and resid 67 and name HN )) 1.800 0.000 3.200 peak 1526 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1527} (( segid " " and resid 66 and name HA )) ( segid " " and resid 71 and name HD1*) 1.800 0.000 1.800 peak 1527 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1528} (( segid " " and resid 66 and name HA )) ( segid " " and resid 69 and name HD1*) 1.800 0.000 1.800 peak 1528 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1529} ( segid " " and resid 66 and name HB* ) (( segid " " and resid 66 and name HA )) 1.800 0.000 0.900 peak 1529 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1530} ( segid " " and resid 66 and name HB* ) (( segid " " and resid 67 and name HN )) 1.800 0.000 1.800 peak 1530 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1531} ( segid " " and resid 66 and name HB* ) ( segid " " and resid 78 and name HE* ) 1.800 0.000 0.900 peak 1531 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1533} ( segid " " and resid 66 and name HB* ) (( segid " " and resid 73 and name HB* )) 1.800 0.000 3.200 peak 1533 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1534} ( segid " " and resid 66 and name HB* ) ( segid " " and resid 73 and name HD* ) 1.800 0.000 0.900 peak 1534 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1535} ( segid " " and resid 66 and name HB* ) ( segid " " and resid 93 and name HD* ) 1.800 0.000 3.200 peak 1535 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1536} ( segid " " and resid 66 and name HB* ) ( segid " " and resid 93 and name HE* ) 1.800 0.000 1.800 peak 1536 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1537} (( segid " " and resid 66 and name HN )) (( segid " " and resid 66 and name HA )) 1.800 0.000 3.200 peak 1537 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1538} (( segid " " and resid 66 and name HN )) ( segid " " and resid 66 and name HB* ) 1.800 0.000 0.900 peak 1538 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1539} (( segid " " and resid 66 and name HN )) (( segid " " and resid 65 and name HN )) 1.800 0.000 1.800 peak 1539 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1540} (( segid " " and resid 67 and name HB* )) (( segid " " and resid 67 and name HA )) 1.800 0.000 3.200 peak 1540 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1541} (( segid " " and resid 67 and name HE* )) ( segid " " and resid 68 and name HG2*) 1.800 0.000 1.800 peak 1541 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1542} (( segid " " and resid 67 and name HN )) (( segid " " and resid 66 and name HN )) 1.800 0.000 1.800 peak 1542 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1543} (( segid " " and resid 67 and name HN )) (( segid " " and resid 70 and name HN )) 1.800 0.000 3.200 peak 1543 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1544} (( segid " " and resid 67 and name HN )) (( segid " " and resid 68 and name HN )) 1.800 0.000 3.200 peak 1544 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1545} (( segid " " and resid 67 and name HN )) (( segid " " and resid 67 and name HA )) 1.800 0.000 1.800 peak 1545 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1546} (( segid " " and resid 67 and name HN )) (( segid " " and resid 67 and name HB* )) 1.800 0.000 1.800 peak 1546 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1547} (( segid " " and resid 67 and name HN )) (( segid " " and resid 67 and name HE* )) 1.800 0.000 3.200 peak 1547 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1548} (( segid " " and resid 67 and name HN )) (( segid " " and resid 67 and name HG* )) 1.800 0.000 3.200 peak 1548 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1549} (( segid " " and resid 68 and name HA )) (( segid " " and resid 69 and name HN )) 1.800 0.000 3.200 peak 1549 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1550} (( segid " " and resid 68 and name HB )) (( segid " " and resid 68 and name HA )) 1.800 0.000 1.800 peak 1550 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1551} ( segid " " and resid 68 and name HD1*) (( segid " " and resid 68 and name HA )) 1.800 0.000 3.200 peak 1551 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1552} ( segid " " and resid 68 and name HD1*) (( segid " " and resid 68 and name HB )) 1.800 0.000 0.900 peak 1552 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1553} ( segid " " and resid 68 and name HD1*) (( segid " " and resid 68 and name HG1*)) 1.800 0.000 1.800 peak 1553 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1554} ( segid " " and resid 68 and name HD1*) ( segid " " and resid 68 and name HG2*) 1.800 0.000 0.900 peak 1554 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1555} ( segid " " and resid 68 and name HD1*) (( segid " " and resid 68 and name HN )) 1.800 0.000 3.200 peak 1555 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1556} ( segid " " and resid 68 and name HD1*) (( segid " " and resid 69 and name HA )) 1.800 0.000 3.200 peak 1556 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1557} ( segid " " and resid 68 and name HD1*) (( segid " " and resid 148 and name HA )) 1.800 0.000 3.200 peak 1557 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1558} (( segid " " and resid 68 and name HG1*)) (( segid " " and resid 68 and name HA )) 1.800 0.000 1.800 peak 1558 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1559} (( segid " " and resid 68 and name HG1*)) (( segid " " and resid 68 and name HB )) 1.800 0.000 3.200 peak 1559 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1560} (( segid " " and resid 68 and name HG1*)) ( segid " " and resid 68 and name HG2*) 1.800 0.000 0.900 peak 1560 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1564} (( segid " " and resid 68 and name HG1*)) (( segid " " and resid 68 and name HA )) 1.800 0.000 1.800 peak 1564 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1566} (( segid " " and resid 68 and name HG1*)) (( segid " " and resid 68 and name HN )) 1.800 0.000 3.200 peak 1566 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1567} ( segid " " and resid 68 and name HG2*) (( segid " " and resid 68 and name HA )) 1.800 0.000 1.800 peak 1567 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1570} ( segid " " and resid 68 and name HG2*) (( segid " " and resid 69 and name HA )) 1.800 0.000 1.800 peak 1570 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1571} ( segid " " and resid 68 and name HG2*) (( segid " " and resid 69 and name HN )) 1.800 0.000 3.200 peak 1571 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1572} (( segid " " and resid 68 and name HN )) (( segid " " and resid 70 and name HN )) 1.800 0.000 3.200 peak 1572 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1573} (( segid " " and resid 68 and name HN )) (( segid " " and resid 68 and name HA )) 1.800 0.000 1.800 peak 1573 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1574} (( segid " " and resid 68 and name HN )) (( segid " " and resid 68 and name HB )) 1.800 0.000 0.900 peak 1574 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1575} (( segid " " and resid 68 and name HN )) (( segid " " and resid 68 and name HG1*)) 1.800 0.000 3.200 peak 1575 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1576} (( segid " " and resid 68 and name HN )) ( segid " " and resid 68 and name HG2*) 1.800 0.000 1.800 peak 1576 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1577} (( segid " " and resid 68 and name HN )) (( segid " " and resid 69 and name HB* )) 1.800 0.000 3.200 peak 1577 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1578} (( segid " " and resid 68 and name HN )) ( segid " " and resid 69 and name HD1*) 1.800 0.000 3.200 peak 1578 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1578} (( segid " " and resid 68 and name HN )) ( segid " " and resid 69 and name HD2*) ASSI { 1579} (( segid " " and resid 68 and name HN )) (( segid " " and resid 67 and name HB* )) 1.800 0.000 1.800 peak 1579 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1580} (( segid " " and resid 69 and name HB* )) (( segid " " and resid 69 and name HA )) 1.800 0.000 1.800 peak 1580 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1581} ( segid " " and resid 69 and name HD1*) (( segid " " and resid 69 and name HA )) 1.800 0.000 1.800 peak 1581 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1582} ( segid " " and resid 69 and name HD1*) (( segid " " and resid 69 and name HN )) 1.800 0.000 1.800 peak 1582 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1583} ( segid " " and resid 69 and name HD2*) (( segid " " and resid 69 and name HA )) 1.800 0.000 0.900 peak 1583 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1584} ( segid " " and resid 69 and name HD2*) (( segid " " and resid 69 and name HB* )) 1.800 0.000 0.900 peak 1584 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1585} ( segid " " and resid 69 and name HD2*) ( segid " " and resid 69 and name HD1*) 1.800 0.000 3.200 peak 1585 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1586} ( segid " " and resid 69 and name HD2*) (( segid " " and resid 69 and name HG )) 1.800 0.000 3.200 peak 1586 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1587} ( segid " " and resid 69 and name HD2*) (( segid " " and resid 69 and name HN )) 1.800 0.000 3.200 peak 1587 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1588} ( segid " " and resid 69 and name HD2*) (( segid " " and resid 118 and name HA )) 1.800 0.000 3.200 peak 1588 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1589} ( segid " " and resid 69 and name HD2*) ( segid " " and resid 118 and name HD* ) 1.800 0.000 1.800 peak 1589 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1590} ( segid " " and resid 69 and name HD2*) ( segid " " and resid 118 and name HE* ) 1.800 0.000 3.200 peak 1590 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1591} (( segid " " and resid 69 and name HG )) (( segid " " and resid 69 and name HA )) 1.800 0.000 3.200 peak 1591 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1592} (( segid " " and resid 69 and name HN )) (( segid " " and resid 70 and name HN )) 1.800 0.000 1.800 peak 1592 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1593} (( segid " " and resid 69 and name HN )) (( segid " " and resid 68 and name HB )) 1.800 0.000 1.800 peak 1593 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1594} (( segid " " and resid 69 and name HN )) (( segid " " and resid 68 and name HN )) 1.800 0.000 3.200 peak 1594 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1595} (( segid " " and resid 69 and name HN )) (( segid " " and resid 69 and name HA )) 1.800 0.000 1.800 peak 1595 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1596} (( segid " " and resid 70 and name HA1 )) (( segid " " and resid 70 and name HN )) 1.800 0.000 3.200 peak 1596 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1597} (( segid " " and resid 70 and name HA1 )) (( segid " " and resid 71 and name HN )) 1.800 0.000 3.200 peak 1597 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1598} (( segid " " and resid 70 and name HA2 )) (( segid " " and resid 70 and name HN )) 1.800 0.000 3.200 peak 1598 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1599} (( segid " " and resid 70 and name HA2 )) (( segid " " and resid 71 and name HN )) 1.800 0.000 3.200 peak 1599 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1600} (( segid " " and resid 70 and name HN )) (( segid " " and resid 70 and name HA* )) 1.800 0.000 0.900 peak 1600 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1601} (( segid " " and resid 71 and name HB )) (( segid " " and resid 71 and name HA )) 1.800 0.000 1.800 peak 1601 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1602} (( segid " " and resid 71 and name HB )) (( segid " " and resid 71 and name HG1*)) 1.800 0.000 1.800 peak 1602 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1603} (( segid " " and resid 71 and name HB )) (( segid " " and resid 72 and name HB* )) 1.800 0.000 3.200 peak 1603 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1604} ( segid " " and resid 71 and name HD1*) (( segid " " and resid 71 and name HA )) 1.800 0.000 3.200 peak 1604 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1605} ( segid " " and resid 71 and name HD1*) (( segid " " and resid 71 and name HB )) 1.800 0.000 0.900 peak 1605 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1606} ( segid " " and resid 71 and name HD1*) (( segid " " and resid 71 and name HG1*)) 1.800 0.000 0.900 peak 1606 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1607} ( segid " " and resid 71 and name HD1*) (( segid " " and resid 71 and name HN )) 1.800 0.000 3.200 peak 1607 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1608} ( segid " " and resid 71 and name HD1*) ( segid " " and resid 134 and name HD1*) 1.800 0.000 3.200 peak 1608 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1609} ( segid " " and resid 71 and name HD1*) (( segid " " and resid 72 and name HB* )) 1.800 0.000 3.200 peak 1609 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1610} ( segid " " and resid 71 and name HD1*) (( segid " " and resid 72 and name HN )) 1.800 0.000 3.200 peak 1610 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1611} (( segid " " and resid 71 and name HG1*)) (( segid " " and resid 71 and name HA )) 1.800 0.000 3.200 peak 1611 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1612} ( segid " " and resid 71 and name HG2*) (( segid " " and resid 71 and name HA )) 1.800 0.000 0.900 peak 1612 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1613} ( segid " " and resid 71 and name HG2*) (( segid " " and resid 71 and name HB )) 1.800 0.000 0.900 peak 1613 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1614} ( segid " " and resid 71 and name HG2*) (( segid " " and resid 71 and name HG1*)) 1.800 0.000 0.900 peak 1614 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1615} ( segid " " and resid 71 and name HG2*) ( segid " " and resid 134 and name HD1*) 1.800 0.000 3.200 peak 1615 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1616} ( segid " " and resid 71 and name HG2*) ( segid " " and resid 23 and name HD1*) 1.800 0.000 0.900 peak 1616 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1616} ( segid " " and resid 71 and name HG2*) ( segid " " and resid 23 and name HD2*) ASSI { 1617} ( segid " " and resid 71 and name HG2*) ( segid " " and resid 73 and name HD* ) 1.800 0.000 3.200 peak 1617 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1618} ( segid " " and resid 71 and name HG2*) ( segid " " and resid 118 and name HD* ) 1.800 0.000 3.200 peak 1618 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1619} ( segid " " and resid 71 and name HG2*) (( segid " " and resid 72 and name HN )) 1.800 0.000 3.200 peak 1619 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1620} (( segid " " and resid 71 and name HN )) (( segid " " and resid 70 and name HA* )) 1.800 0.000 1.800 peak 1620 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1621} (( segid " " and resid 71 and name HN )) (( segid " " and resid 70 and name HN )) 1.800 0.000 3.200 peak 1621 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1623} (( segid " " and resid 71 and name HN )) (( segid " " and resid 71 and name HB )) 1.800 0.000 3.200 peak 1623 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1624} (( segid " " and resid 71 and name HN )) (( segid " " and resid 71 and name HG1*)) 1.800 0.000 3.200 peak 1624 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1625} (( segid " " and resid 71 and name HN )) ( segid " " and resid 71 and name HG2*) 1.800 0.000 1.800 peak 1625 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1626} (( segid " " and resid 71 and name HN )) (( segid " " and resid 72 and name HN )) 1.800 0.000 3.200 peak 1626 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1627} (( segid " " and resid 72 and name HB* )) ( segid " " and resid 71 and name HG2*) 1.800 0.000 3.200 peak 1627 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1628} (( segid " " and resid 72 and name HB* )) (( segid " " and resid 72 and name HA )) 1.800 0.000 0.900 peak 1628 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1629} (( segid " " and resid 72 and name HN )) (( segid " " and resid 71 and name HA )) 1.800 0.000 1.800 peak 1629 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1631} (( segid " " and resid 72 and name HN )) (( segid " " and resid 73 and name HN )) 1.800 0.000 3.200 peak 1631 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1633} (( segid " " and resid 72 and name HN )) (( segid " " and resid 72 and name HB* )) 1.800 0.000 0.900 peak 1633 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1634} (( segid " " and resid 73 and name HA )) (( segid " " and resid 73 and name HB* )) 1.800 0.000 1.800 peak 1634 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1635} (( segid " " and resid 73 and name HB* )) ( segid " " and resid 66 and name HB* ) 1.800 0.000 0.900 peak 1635 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1636} (( segid " " and resid 73 and name HB* )) (( segid " " and resid 73 and name HN )) 1.800 0.000 0.900 peak 1636 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1637} (( segid " " and resid 73 and name HB* )) ( segid " " and resid 93 and name HE* ) 1.800 0.000 3.200 peak 1637 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1641} (( segid " " and resid 73 and name HB* )) ( segid " " and resid 95 and name HG1*) 1.800 0.000 3.200 peak 1641 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1642} ( segid " " and resid 73 and name HD* ) ( segid " " and resid 78 and name HE* ) 1.800 0.000 0.900 peak 1642 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1643} ( segid " " and resid 73 and name HD* ) (( segid " " and resid 73 and name HB* )) 1.800 0.000 3.200 peak 1643 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1644} ( segid " " and resid 73 and name HD* ) ( segid " " and resid 93 and name HE* ) 1.800 0.000 3.200 peak 1644 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1645} (( segid " " and resid 73 and name HN )) (( segid " " and resid 74 and name HN )) 1.800 0.000 3.200 peak 1645 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1646} (( segid " " and resid 73 and name HN )) (( segid " " and resid 73 and name HA )) 1.800 0.000 1.800 peak 1646 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1647} (( segid " " and resid 73 and name HN )) ( segid " " and resid 73 and name HD* ) 1.800 0.000 3.200 peak 1647 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1648} (( segid " " and resid 73 and name HN )) (( segid " " and resid 72 and name HA )) 1.800 0.000 1.800 peak 1648 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1649} (( segid " " and resid 73 and name HN )) (( segid " " and resid 72 and name HB* )) 1.800 0.000 3.200 peak 1649 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1652} (( segid " " and resid 74 and name HB* )) (( segid " " and resid 74 and name HA )) 1.800 0.000 1.800 peak 1652 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1654} (( segid " " and resid 74 and name HB* )) (( segid " " and resid 74 and name HN )) 1.800 0.000 3.200 peak 1654 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1655} (( segid " " and resid 74 and name HN )) (( segid " " and resid 74 and name HA )) 1.800 0.000 1.800 peak 1655 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1656} (( segid " " and resid 74 and name HN )) (( segid " " and resid 74 and name HB* )) 1.800 0.000 3.200 peak 1656 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1657} (( segid " " and resid 74 and name HN )) (( segid " " and resid 75 and name HB* )) 1.800 0.000 3.200 peak 1657 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1658} (( segid " " and resid 74 and name HN )) (( segid " " and resid 75 and name HN )) 1.800 0.000 3.200 peak 1658 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1659} (( segid " " and resid 74 and name HN )) (( segid " " and resid 73 and name HA )) 1.800 0.000 1.800 peak 1659 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1660} (( segid " " and resid 74 and name HN )) (( segid " " and resid 73 and name HB* )) 1.800 0.000 3.200 peak 1660 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1661} (( segid " " and resid 74 and name HN )) ( segid " " and resid 73 and name HD* ) 1.800 0.000 3.200 peak 1661 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1662} (( segid " " and resid 75 and name HA )) (( segid " " and resid 76 and name HN )) 1.800 0.000 3.200 peak 1662 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1663} (( segid " " and resid 75 and name HA )) (( segid " " and resid 78 and name HB* )) 1.800 0.000 3.200 peak 1663 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1664} (( segid " " and resid 75 and name HA )) (( segid " " and resid 78 and name HN )) 1.800 0.000 3.200 peak 1664 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1665} (( segid " " and resid 75 and name HB* )) (( segid " " and resid 76 and name HN )) 1.800 0.000 3.200 peak 1665 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1666} (( segid " " and resid 75 and name HB* )) (( segid " " and resid 75 and name HA )) 1.800 0.000 0.900 peak 1666 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1667} (( segid " " and resid 75 and name HG* )) (( segid " " and resid 76 and name HN )) 1.800 0.000 3.200 peak 1667 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1668} (( segid " " and resid 75 and name HG* )) (( segid " " and resid 75 and name HA )) 1.800 0.000 1.800 peak 1668 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1669} (( segid " " and resid 75 and name HG* )) (( segid " " and resid 75 and name HB* )) 1.800 0.000 3.200 peak 1669 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1670} (( segid " " and resid 75 and name HG* )) ( segid " " and resid 73 and name HD* ) 1.800 0.000 3.200 peak 1670 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1671} (( segid " " and resid 75 and name HN )) (( segid " " and resid 74 and name HA )) 1.800 0.000 1.800 peak 1671 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1672} (( segid " " and resid 75 and name HN )) (( segid " " and resid 75 and name HA )) 1.800 0.000 1.800 peak 1672 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1673} (( segid " " and resid 75 and name HN )) (( segid " " and resid 75 and name HB* )) 1.800 0.000 1.800 peak 1673 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1674} (( segid " " and resid 75 and name HN )) (( segid " " and resid 75 and name HG* )) 1.800 0.000 1.800 peak 1674 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1675} (( segid " " and resid 75 and name HN )) (( segid " " and resid 78 and name HN )) 1.800 0.000 3.200 peak 1675 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1676} (( segid " " and resid 75 and name HN )) ( segid " " and resid 73 and name HD* ) 1.800 0.000 3.200 peak 1676 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1677} (( segid " " and resid 76 and name HA )) (( segid " " and resid 78 and name HN )) 1.800 0.000 3.200 peak 1677 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1678} (( segid " " and resid 76 and name HB* )) (( segid " " and resid 76 and name HA )) 1.800 0.000 0.900 peak 1678 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1679} (( segid " " and resid 76 and name HB* )) (( segid " " and resid 77 and name HN )) 1.800 0.000 1.800 peak 1679 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1680} (( segid " " and resid 76 and name HG* )) (( segid " " and resid 76 and name HA )) 1.800 0.000 1.800 peak 1680 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1681} (( segid " " and resid 76 and name HG* )) (( segid " " and resid 76 and name HB* )) 1.800 0.000 0.900 peak 1681 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1682} (( segid " " and resid 76 and name HG* )) (( segid " " and resid 77 and name HE* )) 1.800 0.000 3.200 peak 1682 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1683} (( segid " " and resid 76 and name HG* )) (( segid " " and resid 77 and name HN )) 1.800 0.000 3.200 peak 1683 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1684} (( segid " " and resid 76 and name HN )) (( segid " " and resid 76 and name HA )) 1.800 0.000 0.900 peak 1684 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1685} (( segid " " and resid 76 and name HN )) (( segid " " and resid 76 and name HB* )) 1.800 0.000 0.900 peak 1685 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1686} (( segid " " and resid 76 and name HN )) (( segid " " and resid 76 and name HG* )) 1.800 0.000 0.900 peak 1686 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1687} (( segid " " and resid 76 and name HN )) (( segid " " and resid 75 and name HN )) 1.800 0.000 1.800 peak 1687 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1688} (( segid " " and resid 76 and name HN )) (( segid " " and resid 78 and name HN )) 1.800 0.000 3.200 peak 1688 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1690} (( segid " " and resid 77 and name HB* )) (( segid " " and resid 78 and name HN )) 1.800 0.000 1.800 peak 1690 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1691} (( segid " " and resid 77 and name HE* )) (( segid " " and resid 77 and name HA )) 1.800 0.000 3.200 peak 1691 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1692} (( segid " " and resid 77 and name HG* )) (( segid " " and resid 77 and name HA )) 1.800 0.000 3.200 peak 1692 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1693} (( segid " " and resid 77 and name HG* )) (( segid " " and resid 77 and name HB* )) 1.800 0.000 3.200 peak 1693 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1694} (( segid " " and resid 77 and name HN )) (( segid " " and resid 76 and name HA )) 1.800 0.000 1.800 peak 1694 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1695} (( segid " " and resid 77 and name HN )) (( segid " " and resid 76 and name HN )) 1.800 0.000 1.800 peak 1695 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1696} (( segid " " and resid 77 and name HN )) (( segid " " and resid 77 and name HA )) 1.800 0.000 1.800 peak 1696 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1697} (( segid " " and resid 77 and name HN )) (( segid " " and resid 77 and name HB* )) 1.800 0.000 0.900 peak 1697 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1698} (( segid " " and resid 77 and name HN )) (( segid " " and resid 78 and name HA )) 1.800 0.000 3.200 peak 1698 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1700} ( segid " " and resid 78 and name HE* ) (( segid " " and resid 75 and name HA )) 1.800 0.000 3.200 peak 1700 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1701} ( segid " " and resid 78 and name HE* ) (( segid " " and resid 78 and name HA )) 1.800 0.000 1.800 peak 1701 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1702} ( segid " " and resid 78 and name HE* ) ( segid " " and resid 93 and name HE* ) 1.800 0.000 1.800 peak 1702 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1703} ( segid " " and resid 78 and name HE* ) ( segid " " and resid 95 and name HG2*) 1.800 0.000 3.200 peak 1703 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1704} (( segid " " and resid 78 and name HN )) (( segid " " and resid 77 and name HA )) 1.800 0.000 1.800 peak 1704 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1706} (( segid " " and resid 78 and name HN )) (( segid " " and resid 78 and name HB* )) 1.800 0.000 1.800 peak 1706 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1707} (( segid " " and resid 78 and name HN )) ( segid " " and resid 78 and name HE* ) 1.800 0.000 1.800 peak 1707 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1708} (( segid " " and resid 79 and name HA )) (( segid " " and resid 79 and name HN )) 1.800 0.000 1.800 peak 1708 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1709} (( segid " " and resid 79 and name HE* )) (( segid " " and resid 80 and name HB* )) 1.800 0.000 3.200 peak 1709 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1710} (( segid " " and resid 79 and name HG* )) (( segid " " and resid 79 and name HN )) 1.800 0.000 1.800 peak 1710 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1711} (( segid " " and resid 79 and name HN )) (( segid " " and resid 96 and name HA )) 1.800 0.000 1.800 peak 1711 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1712} (( segid " " and resid 79 and name HN )) (( segid " " and resid 79 and name HB* )) 1.800 0.000 3.200 peak 1712 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1713} (( segid " " and resid 79 and name HN )) (( segid " " and resid 78 and name HA )) 1.800 0.000 1.800 peak 1713 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1714} (( segid " " and resid 80 and name HB* )) (( segid " " and resid 80 and name HA )) 1.800 0.000 1.800 peak 1714 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1715} (( segid " " and resid 80 and name HB* )) ( segid " " and resid 95 and name HG2*) 1.800 0.000 1.800 peak 1715 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1721} (( segid " " and resid 80 and name HB* )) (( segid " " and resid 81 and name HN )) 1.800 0.000 3.200 peak 1721 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1722} (( segid " " and resid 80 and name HB* )) (( segid " " and resid 80 and name HA )) 1.800 0.000 1.800 peak 1722 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1724} (( segid " " and resid 80 and name HB* )) (( segid " " and resid 80 and name HN )) 1.800 0.000 1.800 peak 1724 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1725} (( segid " " and resid 80 and name HN )) (( segid " " and resid 96 and name HA )) 1.800 0.000 3.200 peak 1725 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1726} (( segid " " and resid 80 and name HN )) (( segid " " and resid 79 and name HN )) 1.800 0.000 0.900 peak 1726 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1727} (( segid " " and resid 80 and name HN )) (( segid " " and resid 80 and name HA )) 1.800 0.000 1.800 peak 1727 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1728} (( segid " " and resid 80 and name HN )) (( segid " " and resid 80 and name HB* )) 1.800 0.000 1.800 peak 1728 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1729} (( segid " " and resid 80 and name HN )) ( segid " " and resid 95 and name HG2*) 1.800 0.000 3.200 peak 1729 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1730} (( segid " " and resid 80 and name HN )) (( segid " " and resid 95 and name HN )) 1.800 0.000 3.200 peak 1730 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1731} ( segid " " and resid 81 and name HD1*) (( segid " " and resid 81 and name HA )) 1.800 0.000 3.200 peak 1731 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1732} ( segid " " and resid 81 and name HD1*) ( segid " " and resid 81 and name HG2*) 1.800 0.000 0.900 peak 1732 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1733} ( segid " " and resid 81 and name HG2*) (( segid " " and resid 92 and name HA* )) 1.800 0.000 1.800 peak 1733 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1734} ( segid " " and resid 81 and name HG2*) (( segid " " and resid 92 and name HA1 )) 1.800 0.000 3.200 peak 1734 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1735} ( segid " " and resid 81 and name HG2*) (( segid " " and resid 81 and name HA )) 1.800 0.000 3.200 peak 1735 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1736} ( segid " " and resid 81 and name HG2*) (( segid " " and resid 81 and name HG1*)) 1.800 0.000 0.900 peak 1736 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1737} ( segid " " and resid 81 and name HG2*) (( segid " " and resid 81 and name HN )) 1.800 0.000 3.200 peak 1737 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1738} ( segid " " and resid 81 and name HG2*) (( segid " " and resid 95 and name HN )) 1.800 0.000 3.200 peak 1738 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1739} (( segid " " and resid 81 and name HN )) (( segid " " and resid 81 and name HG1*)) 1.800 0.000 3.200 peak 1739 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1740} (( segid " " and resid 81 and name HN )) (( segid " " and resid 80 and name HA )) 1.800 0.000 0.900 peak 1740 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1741} (( segid " " and resid 82 and name HB )) (( segid " " and resid 82 and name HA )) 1.800 0.000 3.200 peak 1741 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1742} ( segid " " and resid 82 and name HD1*) ( segid " " and resid 30 and name HD1*) 1.800 0.000 1.800 peak 1742 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1743} ( segid " " and resid 82 and name HD1*) (( segid " " and resid 82 and name HB )) 1.800 0.000 1.800 peak 1743 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1744} ( segid " " and resid 82 and name HD1*) (( segid " " and resid 82 and name HG1*)) 1.800 0.000 0.900 peak 1744 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1745} ( segid " " and resid 82 and name HD1*) ( segid " " and resid 82 and name HG2*) 1.800 0.000 3.200 peak 1745 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1746} ( segid " " and resid 82 and name HD1*) (( segid " " and resid 82 and name HN )) 1.800 0.000 3.200 peak 1746 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1747} ( segid " " and resid 82 and name HD1*) ( segid " " and resid 25 and name HD* ) 1.800 0.000 3.200 peak 1747 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1748} ( segid " " and resid 82 and name HD1*) ( segid " " and resid 95 and name HG1*) 1.800 0.000 0.900 peak 1748 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1749} ( segid " " and resid 82 and name HD1*) ( segid " " and resid 95 and name HG2*) 1.800 0.000 0.900 peak 1749 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1750} ( segid " " and resid 82 and name HD1*) ( segid " " and resid 98 and name HG2*) 1.800 0.000 0.900 peak 1750 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1751} (( segid " " and resid 82 and name HG1*)) (( segid " " and resid 82 and name HA )) 1.800 0.000 3.200 peak 1751 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1752} (( segid " " and resid 82 and name HG1*)) (( segid " " and resid 82 and name HB )) 1.800 0.000 3.200 peak 1752 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1753} (( segid " " and resid 82 and name HG1*)) (( segid " " and resid 83 and name HN )) 1.800 0.000 3.200 peak 1753 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1754} ( segid " " and resid 82 and name HG2*) (( segid " " and resid 82 and name HA )) 1.800 0.000 3.200 peak 1754 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1756} ( segid " " and resid 82 and name HG2*) (( segid " " and resid 82 and name HG1*)) 1.800 0.000 3.200 peak 1756 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1757} ( segid " " and resid 82 and name HG2*) (( segid " " and resid 82 and name HN )) 1.800 0.000 3.200 peak 1757 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1758} (( segid " " and resid 82 and name HN )) (( segid " " and resid 81 and name HA )) 1.800 0.000 1.800 peak 1758 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1759} (( segid " " and resid 82 and name HN )) (( segid " " and resid 82 and name HA )) 1.800 0.000 3.200 peak 1759 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1760} (( segid " " and resid 82 and name HN )) (( segid " " and resid 82 and name HB )) 1.800 0.000 1.800 peak 1760 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1761} (( segid " " and resid 82 and name HN )) (( segid " " and resid 82 and name HG1*)) 1.800 0.000 1.800 peak 1761 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1763} (( segid " " and resid 83 and name HA )) (( segid " " and resid 84 and name HN )) 1.800 0.000 0.900 peak 1763 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1764} (( segid " " and resid 83 and name HA )) (( segid " " and resid 93 and name HN )) 1.800 0.000 3.200 peak 1764 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1766} ( segid " " and resid 83 and name HG1*) (( segid " " and resid 84 and name HN )) 1.800 0.000 1.800 peak 1766 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1766} ( segid " " and resid 83 and name HG2*) (( segid " " and resid 84 and name HN )) ASSI { 1767} ( segid " " and resid 83 and name HG1*) (( segid " " and resid 92 and name HA1 )) 1.800 0.000 1.800 peak 1767 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1767} ( segid " " and resid 83 and name HG2*) (( segid " " and resid 92 and name HA1 )) ASSI { 1768} ( segid " " and resid 83 and name HG1*) (( segid " " and resid 92 and name HA* )) 1.800 0.000 1.800 peak 1768 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1768} ( segid " " and resid 83 and name HG2*) (( segid " " and resid 92 and name HA* )) ASSI { 1769} ( segid " " and resid 83 and name HG2*) (( segid " " and resid 93 and name HN )) 1.800 0.000 3.200 peak 1769 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1769} ( segid " " and resid 83 and name HG1*) (( segid " " and resid 93 and name HN )) ASSI { 1770} ( segid " " and resid 83 and name HG2*) (( segid " " and resid 83 and name HN )) 1.800 0.000 0.900 peak 1770 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1770} ( segid " " and resid 83 and name HG1*) (( segid " " and resid 83 and name HN )) ASSI { 1772} (( segid " " and resid 83 and name HN )) (( segid " " and resid 84 and name HN )) 1.800 0.000 3.200 peak 1772 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1773} (( segid " " and resid 83 and name HN )) (( segid " " and resid 82 and name HA )) 1.800 0.000 0.900 peak 1773 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1775} (( segid " " and resid 83 and name HN )) (( segid " " and resid 83 and name HA )) 1.800 0.000 1.800 peak 1775 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1776} (( segid " " and resid 83 and name HN )) (( segid " " and resid 83 and name HB )) 1.800 0.000 3.200 peak 1776 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1777} (( segid " " and resid 84 and name HA )) (( segid " " and resid 84 and name HN )) 1.800 0.000 1.800 peak 1777 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1778} ( segid " " and resid 84 and name HB* ) (( segid " " and resid 84 and name HA )) 1.800 0.000 0.900 peak 1778 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1779} ( segid " " and resid 84 and name HB* ) (( segid " " and resid 84 and name HN )) 1.800 0.000 0.900 peak 1779 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1780} ( segid " " and resid 84 and name HB* ) (( segid " " and resid 85 and name HA )) 1.800 0.000 3.200 peak 1780 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1781} ( segid " " and resid 84 and name HB* ) ( segid " " and resid 138 and name HD1*) 1.800 0.000 0.900 peak 1781 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1782} ( segid " " and resid 84 and name HB* ) ( segid " " and resid 91 and name HG2*) 1.800 0.000 1.800 peak 1782 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1783} ( segid " " and resid 84 and name HB* ) ( segid " " and resid 91 and name HG1*) 1.800 0.000 1.800 peak 1783 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1784} (( segid " " and resid 84 and name HN )) (( segid " " and resid 92 and name HA1 )) 1.800 0.000 3.200 peak 1784 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1784} (( segid " " and resid 84 and name HN )) (( segid " " and resid 92 and name HA2 )) ASSI { 1785} (( segid " " and resid 84 and name HN )) (( segid " " and resid 92 and name HA1 )) 1.800 0.000 3.200 peak 1785 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1786} (( segid " " and resid 84 and name HN )) (( segid " " and resid 92 and name HA2 )) 1.800 0.000 3.200 peak 1786 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1788} (( segid " " and resid 85 and name HA )) (( segid " " and resid 90 and name HB* )) 1.800 0.000 1.800 peak 1788 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1789} (( segid " " and resid 85 and name HA )) (( segid " " and resid 90 and name HG* )) 1.800 0.000 1.800 peak 1789 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1790} (( segid " " and resid 85 and name HA )) ( segid " " and resid 86 and name HG2*) 1.800 0.000 3.200 peak 1790 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1791} (( segid " " and resid 85 and name HA )) (( segid " " and resid 91 and name HN )) 1.800 0.000 3.200 peak 1791 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1792} (( segid " " and resid 85 and name HB* )) (( segid " " and resid 85 and name HA )) 1.800 0.000 0.900 peak 1792 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1793} (( segid " " and resid 85 and name HB* )) (( segid " " and resid 90 and name HA )) 1.800 0.000 1.800 peak 1793 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1794} (( segid " " and resid 85 and name HD* )) (( segid " " and resid 85 and name HA )) 1.800 0.000 3.200 peak 1794 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1795} (( segid " " and resid 85 and name HD* )) (( segid " " and resid 85 and name HN )) 1.800 0.000 3.200 peak 1795 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1796} (( segid " " and resid 85 and name HE )) (( segid " " and resid 85 and name HB* )) 1.800 0.000 1.800 peak 1796 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1797} (( segid " " and resid 85 and name HG* )) (( segid " " and resid 85 and name HA )) 1.800 0.000 1.800 peak 1797 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1798} (( segid " " and resid 85 and name HG* )) (( segid " " and resid 85 and name HB* )) 1.800 0.000 3.200 peak 1798 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1799} (( segid " " and resid 85 and name HN )) (( segid " " and resid 84 and name HA )) 1.800 0.000 0.900 peak 1799 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1801} (( segid " " and resid 85 and name HN )) (( segid " " and resid 84 and name HN )) 1.800 0.000 3.200 peak 1801 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1802} (( segid " " and resid 85 and name HN )) (( segid " " and resid 85 and name HB* )) 1.800 0.000 1.800 peak 1802 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1803} (( segid " " and resid 85 and name HN )) (( segid " " and resid 85 and name HG* )) 1.800 0.000 3.200 peak 1803 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1804} (( segid " " and resid 85 and name HN )) (( segid " " and resid 30 and name HA )) 1.800 0.000 3.200 peak 1804 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1805} (( segid " " and resid 85 and name HN )) (( segid " " and resid 86 and name HN )) 1.800 0.000 3.200 peak 1805 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1806} (( segid " " and resid 86 and name HA )) (( segid " " and resid 87 and name HN )) 1.800 0.000 3.200 peak 1806 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1807} (( segid " " and resid 86 and name HB )) ( segid " " and resid 138 and name HD1*) 1.800 0.000 3.200 peak 1807 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1808} (( segid " " and resid 86 and name HB )) ( segid " " and resid 142 and name HD1*) 1.800 0.000 3.200 peak 1808 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1809} (( segid " " and resid 86 and name HB )) (( segid " " and resid 87 and name HN )) 1.800 0.000 1.800 peak 1809 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1810} (( segid " " and resid 86 and name HB )) (( segid " " and resid 86 and name HA )) 1.800 0.000 0.900 peak 1810 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1811} ( segid " " and resid 86 and name HG2*) (( segid " " and resid 85 and name HN )) 1.800 0.000 1.800 peak 1811 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1812} ( segid " " and resid 86 and name HG2*) ( segid " " and resid 138 and name HD1*) 1.800 0.000 1.800 peak 1812 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1813} ( segid " " and resid 86 and name HG2*) ( segid " " and resid 138 and name HG2*) 1.800 0.000 1.800 peak 1813 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1814} ( segid " " and resid 86 and name HG2*) ( segid " " and resid 142 and name HD1*) 1.800 0.000 0.900 peak 1814 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1815} ( segid " " and resid 86 and name HG2*) (( segid " " and resid 142 and name HG1*)) 1.800 0.000 3.200 peak 1815 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1816} ( segid " " and resid 86 and name HG2*) (( segid " " and resid 86 and name HA )) 1.800 0.000 0.900 peak 1816 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1817} ( segid " " and resid 86 and name HG2*) (( segid " " and resid 86 and name HB )) 1.800 0.000 0.900 peak 1817 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1818} ( segid " " and resid 86 and name HG2*) ( segid " " and resid 91 and name HG2*) 1.800 0.000 3.200 peak 1818 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1819} ( segid " " and resid 86 and name HG2*) ( segid " " and resid 91 and name HG1*) 1.800 0.000 1.800 peak 1819 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1820} (( segid " " and resid 86 and name HN )) (( segid " " and resid 85 and name HA )) 1.800 0.000 0.900 peak 1820 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1821} (( segid " " and resid 86 and name HN )) (( segid " " and resid 85 and name HB* )) 1.800 0.000 1.800 peak 1821 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1822} (( segid " " and resid 86 and name HN )) (( segid " " and resid 90 and name HA )) 1.800 0.000 3.200 peak 1822 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1823} (( segid " " and resid 86 and name HN )) (( segid " " and resid 87 and name HN )) 1.800 0.000 3.200 peak 1823 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1824} (( segid " " and resid 86 and name HN )) (( segid " " and resid 86 and name HA )) 1.800 0.000 3.200 peak 1824 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1825} (( segid " " and resid 86 and name HN )) ( segid " " and resid 86 and name HG2*) 1.800 0.000 1.800 peak 1825 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1826} (( segid " " and resid 87 and name HA )) (( segid " " and resid 87 and name HB* )) 1.800 0.000 0.900 peak 1826 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1827} (( segid " " and resid 87 and name HA )) (( segid " " and resid 87 and name HE* )) 1.800 0.000 1.800 peak 1827 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1831} (( segid " " and resid 87 and name HB* )) (( segid " " and resid 88 and name HN )) 1.800 0.000 3.200 peak 1831 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1832} (( segid " " and resid 87 and name HB* )) (( segid " " and resid 87 and name HA )) 1.800 0.000 1.800 peak 1832 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1833} (( segid " " and resid 87 and name HB* )) (( segid " " and resid 87 and name HN )) 1.800 0.000 3.200 peak 1833 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1834} (( segid " " and resid 87 and name HG* )) (( segid " " and resid 87 and name HA )) 1.800 0.000 1.800 peak 1834 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1835} (( segid " " and resid 87 and name HG* )) (( segid " " and resid 87 and name HB* )) 1.800 0.000 3.200 peak 1835 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1836} (( segid " " and resid 87 and name HN )) (( segid " " and resid 88 and name HA )) 1.800 0.000 3.200 peak 1836 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1837} (( segid " " and resid 87 and name HN )) (( segid " " and resid 88 and name HN )) 1.800 0.000 1.800 peak 1837 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1838} (( segid " " and resid 87 and name HN )) (( segid " " and resid 87 and name HA )) 1.800 0.000 0.900 peak 1838 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1839} (( segid " " and resid 87 and name HN )) (( segid " " and resid 87 and name HB* )) 1.800 0.000 1.800 peak 1839 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1840} (( segid " " and resid 87 and name HN )) (( segid " " and resid 89 and name HN )) 1.800 0.000 3.200 peak 1840 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1841} (( segid " " and resid 88 and name HA )) (( segid " " and resid 89 and name HN )) 1.800 0.000 0.900 peak 1841 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1842} (( segid " " and resid 88 and name HB* )) (( segid " " and resid 89 and name HA )) 1.800 0.000 3.200 peak 1842 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1845} (( segid " " and resid 88 and name HB* )) (( segid " " and resid 88 and name HA )) 1.800 0.000 1.800 peak 1845 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1846} (( segid " " and resid 88 and name HB* )) (( segid " " and resid 88 and name HN )) 1.800 0.000 1.800 peak 1846 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1847} (( segid " " and resid 88 and name HN )) (( segid " " and resid 88 and name HA )) 1.800 0.000 0.900 peak 1847 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1848} (( segid " " and resid 88 and name HN )) (( segid " " and resid 88 and name HB* )) 1.800 0.000 1.800 peak 1848 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1849} (( segid " " and resid 88 and name HN )) (( segid " " and resid 87 and name HA )) 1.800 0.000 1.800 peak 1849 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1851} (( segid " " and resid 88 and name HN )) (( segid " " and resid 89 and name HN )) 1.800 0.000 0.900 peak 1851 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1852} (( segid " " and resid 89 and name HA )) ( segid " " and resid 142 and name HD1*) 1.800 0.000 3.200 peak 1852 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1853} (( segid " " and resid 89 and name HA )) ( segid " " and resid 89 and name HG1*) 1.800 0.000 0.900 peak 1853 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1853} (( segid " " and resid 89 and name HA )) ( segid " " and resid 89 and name HG2*) ASSI { 1854} (( segid " " and resid 89 and name HB )) (( segid " " and resid 90 and name HN )) 1.800 0.000 3.200 peak 1854 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1855} (( segid " " and resid 89 and name HB )) (( segid " " and resid 89 and name HA )) 1.800 0.000 1.800 peak 1855 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1856} ( segid " " and resid 89 and name HG1*) (( segid " " and resid 90 and name HN )) 1.800 0.000 3.200 peak 1856 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1856} ( segid " " and resid 89 and name HG2*) (( segid " " and resid 90 and name HN )) ASSI { 1857} ( segid " " and resid 89 and name HG1*) ( segid " " and resid 91 and name HG1*) 1.800 0.000 3.200 peak 1857 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1857} ( segid " " and resid 89 and name HG2*) ( segid " " and resid 91 and name HG1*) ASSI { 1858} ( segid " " and resid 89 and name HG1*) (( segid " " and resid 90 and name HA )) 1.800 0.000 1.800 peak 1858 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1859} ( segid " " and resid 89 and name HG1*) (( segid " " and resid 89 and name HA )) 1.800 0.000 0.900 peak 1859 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1860} ( segid " " and resid 89 and name HG1*) (( segid " " and resid 89 and name HB )) 1.800 0.000 0.900 peak 1860 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1861} ( segid " " and resid 89 and name HG1*) ( segid " " and resid 91 and name HG1*) 1.800 0.000 0.900 peak 1861 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1862} ( segid " " and resid 89 and name HG2*) (( segid " " and resid 88 and name HB2 )) 1.800 0.000 3.200 peak 1862 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1863} ( segid " " and resid 89 and name HG2*) (( segid " " and resid 89 and name HA )) 1.800 0.000 0.900 peak 1863 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1865} (( segid " " and resid 89 and name HN )) (( segid " " and resid 90 and name HN )) 1.800 0.000 3.200 peak 1865 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1866} (( segid " " and resid 89 and name HN )) (( segid " " and resid 86 and name HN )) 1.800 0.000 1.800 peak 1866 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1867} (( segid " " and resid 89 and name HN )) (( segid " " and resid 89 and name HA )) 1.800 0.000 1.800 peak 1867 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1868} (( segid " " and resid 89 and name HN )) (( segid " " and resid 89 and name HB )) 1.800 0.000 1.800 peak 1868 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1869} (( segid " " and resid 89 and name HN )) ( segid " " and resid 89 and name HG2*) 1.800 0.000 1.800 peak 1869 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1870} (( segid " " and resid 90 and name HB* )) (( segid " " and resid 90 and name HA )) 1.800 0.000 1.800 peak 1870 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1871} (( segid " " and resid 90 and name HB* )) (( segid " " and resid 91 and name HN )) 1.800 0.000 3.200 peak 1871 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1872} (( segid " " and resid 90 and name HG* )) (( segid " " and resid 90 and name HA )) 1.800 0.000 1.800 peak 1872 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1873} (( segid " " and resid 90 and name HG* )) (( segid " " and resid 90 and name HB* )) 1.800 0.000 0.900 peak 1873 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1874} (( segid " " and resid 90 and name HG* )) (( segid " " and resid 91 and name HN )) 1.800 0.000 3.200 peak 1874 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1875} (( segid " " and resid 90 and name HN )) (( segid " " and resid 90 and name HA )) 1.800 0.000 1.800 peak 1875 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1876} (( segid " " and resid 90 and name HN )) (( segid " " and resid 90 and name HB* )) 1.800 0.000 1.800 peak 1876 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1877} (( segid " " and resid 90 and name HN )) (( segid " " and resid 89 and name HA )) 1.800 0.000 0.900 peak 1877 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1878} (( segid " " and resid 91 and name HB )) (( segid " " and resid 92 and name HN )) 1.800 0.000 1.800 peak 1878 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1879} (( segid " " and resid 91 and name HB )) (( segid " " and resid 91 and name HA )) 1.800 0.000 1.800 peak 1879 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1880} ( segid " " and resid 91 and name HG2*) (( segid " " and resid 92 and name HN )) 1.800 0.000 1.800 peak 1880 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1881} ( segid " " and resid 91 and name HG2*) ( segid " " and resid 145 and name HD1*) 1.800 0.000 0.900 peak 1881 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1882} ( segid " " and resid 91 and name HG2*) (( segid " " and resid 91 and name HA )) 1.800 0.000 1.800 peak 1882 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1883} ( segid " " and resid 91 and name HG2*) (( segid " " and resid 91 and name HB )) 1.800 0.000 0.900 peak 1883 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1884} ( segid " " and resid 91 and name HG2*) (( segid " " and resid 91 and name HN )) 1.800 0.000 1.800 peak 1884 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1885} ( segid " " and resid 91 and name HG1*) (( segid " " and resid 92 and name HN )) 1.800 0.000 1.800 peak 1885 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1886} ( segid " " and resid 91 and name HG1*) ( segid " " and resid 138 and name HD1*) 1.800 0.000 1.800 peak 1886 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1887} ( segid " " and resid 91 and name HG1*) ( segid " " and resid 141 and name HG2*) 1.800 0.000 3.200 peak 1887 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1888} ( segid " " and resid 91 and name HG1*) ( segid " " and resid 142 and name HD1*) 1.800 0.000 0.900 peak 1888 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1889} ( segid " " and resid 91 and name HG1*) ( segid " " and resid 142 and name HG2*) 1.800 0.000 3.200 peak 1889 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1890} ( segid " " and resid 91 and name HG1*) (( segid " " and resid 145 and name HA )) 1.800 0.000 3.200 peak 1890 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1891} ( segid " " and resid 91 and name HG1*) ( segid " " and resid 145 and name HD1*) 1.800 0.000 0.900 peak 1891 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1892} ( segid " " and resid 91 and name HG1*) (( segid " " and resid 91 and name HA )) 1.800 0.000 1.800 peak 1892 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1893} ( segid " " and resid 91 and name HG1*) (( segid " " and resid 91 and name HB )) 1.800 0.000 0.900 peak 1893 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1894} ( segid " " and resid 91 and name HG1*) ( segid " " and resid 91 and name HG2*) 1.800 0.000 0.900 peak 1894 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1895} ( segid " " and resid 91 and name HG1*) (( segid " " and resid 91 and name HN )) 1.800 0.000 3.200 peak 1895 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1896} (( segid " " and resid 91 and name HN )) (( segid " " and resid 84 and name HN )) 1.800 0.000 1.800 peak 1896 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1897} (( segid " " and resid 91 and name HN )) (( segid " " and resid 90 and name HA )) 1.800 0.000 0.900 peak 1897 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1898} (( segid " " and resid 91 and name HN )) (( segid " " and resid 91 and name HA )) 1.800 0.000 1.800 peak 1898 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1899} (( segid " " and resid 91 and name HN )) (( segid " " and resid 91 and name HB )) 1.800 0.000 1.800 peak 1899 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1900} (( segid " " and resid 92 and name HA1 )) (( segid " " and resid 92 and name HN )) 1.800 0.000 1.800 peak 1900 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1904} (( segid " " and resid 92 and name HA2 )) ( segid " " and resid 81 and name HG2*) 1.800 0.000 3.200 peak 1904 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1906} (( segid " " and resid 92 and name HN )) (( segid " " and resid 92 and name HA2 )) 1.800 0.000 1.800 peak 1906 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1907} (( segid " " and resid 92 and name HN )) (( segid " " and resid 93 and name HB* )) 1.800 0.000 3.200 peak 1907 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1908} (( segid " " and resid 92 and name HN )) (( segid " " and resid 93 and name HN )) 1.800 0.000 3.200 peak 1908 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1909} (( segid " " and resid 92 and name HN )) (( segid " " and resid 61 and name HB* )) 1.800 0.000 3.200 peak 1909 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1910} (( segid " " and resid 92 and name HN )) (( segid " " and resid 62 and name HA )) 1.800 0.000 1.800 peak 1910 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1911} (( segid " " and resid 92 and name HN )) (( segid " " and resid 91 and name HA )) 1.800 0.000 0.900 peak 1911 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1912} (( segid " " and resid 93 and name HA )) (( segid " " and resid 93 and name HN )) 1.800 0.000 3.200 peak 1912 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1913} (( segid " " and resid 93 and name HB* )) (( segid " " and resid 93 and name HA )) 1.800 0.000 1.800 peak 1913 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1914} (( segid " " and resid 93 and name HB* )) (( segid " " and resid 93 and name HN )) 1.800 0.000 1.800 peak 1914 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1915} ( segid " " and resid 93 and name HD* ) (( segid " " and resid 93 and name HA )) 1.800 0.000 1.800 peak 1915 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1916} ( segid " " and resid 93 and name HD* ) (( segid " " and resid 93 and name HB* )) 1.800 0.000 1.800 peak 1916 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1917} (( segid " " and resid 93 and name HN )) (( segid " " and resid 92 and name HA* )) 1.800 0.000 0.900 peak 1917 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1918} (( segid " " and resid 93 and name HN )) ( segid " " and resid 81 and name HG2*) 1.800 0.000 1.800 peak 1918 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1919} (( segid " " and resid 93 and name HN )) ( segid " " and resid 93 and name HD* ) 1.800 0.000 3.200 peak 1919 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1920} (( segid " " and resid 94 and name HA )) (( segid " " and resid 94 and name HN )) 1.800 0.000 1.800 peak 1920 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1921} (( segid " " and resid 94 and name HB* )) (( segid " " and resid 94 and name HA )) 1.800 0.000 3.200 peak 1921 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1924} (( segid " " and resid 94 and name HB* )) (( segid " " and resid 95 and name HN )) 1.800 0.000 3.200 peak 1924 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1925} (( segid " " and resid 94 and name HN )) (( segid " " and resid 94 and name HB* )) 1.800 0.000 1.800 peak 1925 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1926} (( segid " " and resid 94 and name HN )) ( segid " " and resid 94 and name HD2*) 1.800 0.000 3.200 peak 1926 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1926} (( segid " " and resid 94 and name HN )) ( segid " " and resid 94 and name HD1*) ASSI { 1927} (( segid " " and resid 94 and name HN )) ( segid " " and resid 94 and name HD1*) 1.800 0.000 3.200 peak 1927 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1928} (( segid " " and resid 94 and name HN )) (( segid " " and resid 93 and name HA )) 1.800 0.000 1.800 peak 1928 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1929} (( segid " " and resid 94 and name HN )) (( segid " " and resid 93 and name HB* )) 1.800 0.000 3.200 peak 1929 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1930} (( segid " " and resid 95 and name HB )) (( segid " " and resid 95 and name HN )) 1.800 0.000 3.200 peak 1930 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1931} ( segid " " and resid 95 and name HG1*) ( segid " " and resid 16 and name HD* ) 1.800 0.000 1.800 peak 1931 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1932} ( segid " " and resid 95 and name HG1*) ( segid " " and resid 16 and name HE* ) 1.800 0.000 1.800 peak 1932 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1933} ( segid " " and resid 95 and name HG1*) (( segid " " and resid 73 and name HB* )) 1.800 0.000 3.200 peak 1933 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1934} ( segid " " and resid 95 and name HG1*) (( segid " " and resid 95 and name HA )) 1.800 0.000 0.900 peak 1934 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1935} ( segid " " and resid 95 and name HG1*) (( segid " " and resid 95 and name HB )) 1.800 0.000 1.800 peak 1935 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1936} ( segid " " and resid 95 and name HG2*) (( segid " " and resid 97 and name HN )) 1.800 0.000 1.800 peak 1936 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1938} ( segid " " and resid 95 and name HG2*) (( segid " " and resid 80 and name HB* )) 1.800 0.000 3.200 peak 1938 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1939} ( segid " " and resid 95 and name HG2*) (( segid " " and resid 95 and name HA )) 1.800 0.000 1.800 peak 1939 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1940} ( segid " " and resid 95 and name HG2*) (( segid " " and resid 95 and name HB )) 1.800 0.000 1.800 peak 1940 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1942} (( segid " " and resid 95 and name HN )) (( segid " " and resid 94 and name HB* )) 1.800 0.000 3.200 peak 1942 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1943} (( segid " " and resid 95 and name HN )) (( segid " " and resid 95 and name HA )) 1.800 0.000 3.200 peak 1943 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1944} (( segid " " and resid 95 and name HN )) ( segid " " and resid 95 and name HG1*) 1.800 0.000 1.800 peak 1944 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1945} (( segid " " and resid 95 and name HN )) ( segid " " and resid 95 and name HG2*) 1.800 0.000 0.900 peak 1945 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1946} (( segid " " and resid 96 and name HA )) (( segid " " and resid 97 and name HN )) 1.800 0.000 3.200 peak 1946 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1949} (( segid " " and resid 96 and name HB* )) (( segid " " and resid 97 and name HN )) 1.800 0.000 3.200 peak 1949 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1950} (( segid " " and resid 96 and name HB* )) (( segid " " and resid 96 and name HA )) 1.800 0.000 3.200 peak 1950 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1951} (( segid " " and resid 96 and name HN )) (( segid " " and resid 97 and name HN )) 1.800 0.000 1.800 peak 1951 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1952} (( segid " " and resid 96 and name HN )) (( segid " " and resid 96 and name HA )) 1.800 0.000 3.200 peak 1952 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1953} (( segid " " and resid 96 and name HN )) (( segid " " and resid 96 and name HB* )) 1.800 0.000 1.800 peak 1953 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1955} (( segid " " and resid 96 and name HN )) (( segid " " and resid 95 and name HA )) 1.800 0.000 1.800 peak 1955 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1956} (( segid " " and resid 96 and name HN )) (( segid " " and resid 95 and name HB )) 1.800 0.000 3.200 peak 1956 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1957} (( segid " " and resid 96 and name HN )) (( segid " " and resid 98 and name HB )) 1.800 0.000 3.200 peak 1957 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1958} (( segid " " and resid 97 and name HG* )) ( segid " " and resid 98 and name HG2*) 1.800 0.000 3.200 peak 1958 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1959} (( segid " " and resid 97 and name HN )) (( segid " " and resid 97 and name HA )) 1.800 0.000 1.800 peak 1959 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1960} (( segid " " and resid 97 and name HN )) (( segid " " and resid 97 and name HG* )) 1.800 0.000 3.200 peak 1960 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1961} (( segid " " and resid 97 and name HN )) (( segid " " and resid 96 and name HB* )) 1.800 0.000 1.800 peak 1961 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1962} (( segid " " and resid 98 and name HA )) (( segid " " and resid 100 and name HA* )) 1.800 0.000 3.200 peak 1962 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1964} ( segid " " and resid 98 and name HG1*) (( segid " " and resid 97 and name HG* )) 1.800 0.000 3.200 peak 1964 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1965} ( segid " " and resid 98 and name HG1*) (( segid " " and resid 100 and name HA* )) 1.800 0.000 1.800 peak 1965 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1968} ( segid " " and resid 98 and name HG1*) (( segid " " and resid 16 and name HB* )) 1.800 0.000 3.200 peak 1968 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1970} ( segid " " and resid 98 and name HG1*) (( segid " " and resid 98 and name HB )) 1.800 0.000 0.900 peak 1970 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1972} ( segid " " and resid 98 and name HG2*) (( segid " " and resid 98 and name HA )) 1.800 0.000 3.200 peak 1972 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1973} ( segid " " and resid 98 and name HG2*) (( segid " " and resid 98 and name HB )) 1.800 0.000 0.900 peak 1973 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1974} ( segid " " and resid 98 and name HG2*) (( segid " " and resid 98 and name HN )) 1.800 0.000 3.200 peak 1974 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1975} (( segid " " and resid 98 and name HN )) (( segid " " and resid 97 and name HA )) 1.800 0.000 0.900 peak 1975 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1976} (( segid " " and resid 98 and name HN )) (( segid " " and resid 98 and name HA )) 1.800 0.000 3.200 peak 1976 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1977} (( segid " " and resid 98 and name HN )) (( segid " " and resid 98 and name HB )) 1.800 0.000 0.900 peak 1977 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1978} (( segid " " and resid 98 and name HN )) ( segid " " and resid 98 and name HG1*) 1.800 0.000 1.800 peak 1978 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1978} (( segid " " and resid 98 and name HN )) ( segid " " and resid 98 and name HG2*) ASSI { 1979} (( segid " " and resid 98 and name HN )) ( segid " " and resid 98 and name HG1*) 1.800 0.000 3.200 peak 1979 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1981} (( segid " " and resid 99 and name HB* )) (( segid " " and resid 99 and name HA )) 1.800 0.000 1.800 peak 1981 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1984} ( segid " " and resid 99 and name HD1*) (( segid " " and resid 99 and name HA )) 1.800 0.000 0.900 peak 1984 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1985} ( segid " " and resid 99 and name HD1*) (( segid " " and resid 99 and name HB* )) 1.800 0.000 0.900 peak 1985 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1986} ( segid " " and resid 99 and name HD1*) (( segid " " and resid 99 and name HG )) 1.800 0.000 0.900 peak 1986 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1987} ( segid " " and resid 99 and name HD2*) (( segid " " and resid 100 and name HN )) 1.800 0.000 3.200 peak 1987 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1989} (( segid " " and resid 99 and name HN )) (( segid " " and resid 99 and name HB* )) 1.800 0.000 1.800 peak 1989 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1990} (( segid " " and resid 99 and name HN )) (( segid " " and resid 99 and name HG )) 1.800 0.000 3.200 peak 1990 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1991} (( segid " " and resid 99 and name HN )) (( segid " " and resid 98 and name HA )) 1.800 0.000 1.800 peak 1991 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1993} (( segid " " and resid 100 and name HA1 )) (( segid " " and resid 100 and name HN )) 1.800 0.000 3.200 peak 1993 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1994} (( segid " " and resid 100 and name HA1 )) (( segid " " and resid 101 and name HN )) 1.800 0.000 3.200 peak 1994 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1996} (( segid " " and resid 100 and name HA2 )) (( segid " " and resid 100 and name HN )) 1.800 0.000 3.200 peak 1996 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1997} (( segid " " and resid 100 and name HA2 )) (( segid " " and resid 101 and name HN )) 1.800 0.000 1.800 peak 1997 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1998} (( segid " " and resid 100 and name HN )) (( segid " " and resid 100 and name HA1 )) 1.800 0.000 1.800 peak 1998 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 1998} (( segid " " and resid 100 and name HN )) (( segid " " and resid 100 and name HA2 )) ASSI { 1999} (( segid " " and resid 100 and name HN )) (( segid " " and resid 99 and name HA )) 1.800 0.000 3.200 peak 1999 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2000} (( segid " " and resid 100 and name HN )) (( segid " " and resid 99 and name HB* )) 1.800 0.000 1.800 peak 2000 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2001} (( segid " " and resid 100 and name HN )) (( segid " " and resid 99 and name HN )) 1.800 0.000 0.900 peak 2001 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2002} (( segid " " and resid 100 and name HN )) (( segid " " and resid 98 and name HA )) 1.800 0.000 3.200 peak 2002 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2003} (( segid " " and resid 101 and name HA )) ( segid " " and resid 101 and name HG1*) 1.800 0.000 1.800 peak 2003 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2004} (( segid " " and resid 101 and name HB )) (( segid " " and resid 102 and name HN )) 1.800 0.000 3.200 peak 2004 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2005} (( segid " " and resid 101 and name HB )) (( segid " " and resid 101 and name HA )) 1.800 0.000 3.200 peak 2005 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2006} ( segid " " and resid 101 and name HG1*) (( segid " " and resid 101 and name HB )) 1.800 0.000 3.200 peak 2006 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2007} ( segid " " and resid 101 and name HG2*) (( segid " " and resid 101 and name HA )) 1.800 0.000 1.800 peak 2007 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2008} ( segid " " and resid 101 and name HG2*) (( segid " " and resid 101 and name HB )) 1.800 0.000 3.200 peak 2008 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2009} ( segid " " and resid 101 and name HG2*) (( segid " " and resid 101 and name HN )) 1.800 0.000 1.800 peak 2009 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2010} (( segid " " and resid 101 and name HN )) (( segid " " and resid 100 and name HA* )) 1.800 0.000 1.800 peak 2010 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2011} (( segid " " and resid 101 and name HN )) (( segid " " and resid 101 and name HA )) 1.800 0.000 0.900 peak 2011 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2012} (( segid " " and resid 101 and name HN )) (( segid " " and resid 101 and name HB )) 1.800 0.000 1.800 peak 2012 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2013} (( segid " " and resid 102 and name HB* )) (( segid " " and resid 103 and name HN )) 1.800 0.000 3.200 peak 2013 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2014} (( segid " " and resid 102 and name HB* )) (( segid " " and resid 102 and name HA )) 1.800 0.000 1.800 peak 2014 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2015} ( segid " " and resid 102 and name HD2*) ( segid " " and resid 133 and name HD1*) 1.800 0.000 0.900 peak 2015 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 2015} ( segid " " and resid 102 and name HD1*) ( segid " " and resid 133 and name HD1*) ASSI { 2016} ( segid " " and resid 102 and name HD1*) ( segid " " and resid 133 and name HD1*) 1.800 0.000 3.200 peak 2016 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2017} ( segid " " and resid 102 and name HD1*) ( segid " " and resid 133 and name HG2*) 1.800 0.000 1.800 peak 2017 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2018} ( segid " " and resid 102 and name HD1*) (( segid " " and resid 102 and name HA )) 1.800 0.000 0.900 peak 2018 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2019} ( segid " " and resid 102 and name HD1*) (( segid " " and resid 102 and name HB* )) 1.800 0.000 3.200 peak 2019 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2020} ( segid " " and resid 102 and name HD1*) (( segid " " and resid 102 and name HG )) 1.800 0.000 0.900 peak 2020 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2021} (( segid " " and resid 102 and name HG )) ( segid " " and resid 133 and name HG2*) 1.800 0.000 3.200 peak 2021 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2022} (( segid " " and resid 102 and name HG )) (( segid " " and resid 102 and name HA )) 1.800 0.000 1.800 peak 2022 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2023} (( segid " " and resid 102 and name HG )) ( segid " " and resid 102 and name HD2*) 1.800 0.000 0.900 peak 2023 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 2023} (( segid " " and resid 102 and name HG )) ( segid " " and resid 102 and name HD1*) ASSI { 2024} (( segid " " and resid 102 and name HG )) (( segid " " and resid 13 and name HN )) 1.800 0.000 3.200 peak 2024 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2025} (( segid " " and resid 102 and name HN )) (( segid " " and resid 103 and name HN )) 1.800 0.000 3.200 peak 2025 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2026} (( segid " " and resid 102 and name HN )) (( segid " " and resid 102 and name HA )) 1.800 0.000 1.800 peak 2026 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2027} (( segid " " and resid 102 and name HN )) (( segid " " and resid 102 and name HB* )) 1.800 0.000 1.800 peak 2027 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2028} (( segid " " and resid 102 and name HN )) (( segid " " and resid 13 and name HB )) 1.800 0.000 3.200 peak 2028 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2029} (( segid " " and resid 102 and name HN )) ( segid " " and resid 13 and name HG2*) 1.800 0.000 3.200 peak 2029 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 2029} (( segid " " and resid 102 and name HN )) ( segid " " and resid 13 and name HG1*) ASSI { 2030} (( segid " " and resid 102 and name HN )) (( segid " " and resid 101 and name HA )) 1.800 0.000 0.900 peak 2030 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2031} (( segid " " and resid 103 and name HB* )) (( segid " " and resid 103 and name HA )) 1.800 0.000 1.800 peak 2031 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2032} (( segid " " and resid 103 and name HE )) (( segid " " and resid 103 and name HB* )) 1.800 0.000 1.800 peak 2032 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2033} (( segid " " and resid 103 and name HG* )) (( segid " " and resid 103 and name HB* )) 1.800 0.000 3.200 peak 2033 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2034} (( segid " " and resid 103 and name HN )) (( segid " " and resid 103 and name HA )) 1.800 0.000 1.800 peak 2034 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2035} (( segid " " and resid 103 and name HN )) (( segid " " and resid 103 and name HB* )) 1.800 0.000 1.800 peak 2035 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2036} (( segid " " and resid 103 and name HN )) (( segid " " and resid 103 and name HG* )) 1.800 0.000 1.800 peak 2036 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2037} (( segid " " and resid 103 and name HN )) (( segid " " and resid 102 and name HA )) 1.800 0.000 0.900 peak 2037 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2038} (( segid " " and resid 104 and name HA )) (( segid " " and resid 104 and name HN )) 1.800 0.000 3.200 peak 2038 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2039} (( segid " " and resid 104 and name HB )) (( segid " " and resid 104 and name HA )) 1.800 0.000 1.800 peak 2039 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2041} ( segid " " and resid 104 and name HD1*) (( segid " " and resid 104 and name HA )) 1.800 0.000 0.900 peak 2041 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2042} ( segid " " and resid 104 and name HD1*) (( segid " " and resid 104 and name HB )) 1.800 0.000 1.800 peak 2042 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2043} ( segid " " and resid 104 and name HD1*) (( segid " " and resid 104 and name HG1*)) 1.800 0.000 0.900 peak 2043 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2044} ( segid " " and resid 104 and name HD1*) ( segid " " and resid 104 and name HG2*) 1.800 0.000 0.900 peak 2044 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2045} ( segid " " and resid 104 and name HD1*) (( segid " " and resid 104 and name HN )) 1.800 0.000 3.200 peak 2045 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2046} ( segid " " and resid 104 and name HD1*) ( segid " " and resid 133 and name HD1*) 1.800 0.000 0.900 peak 2046 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2047} ( segid " " and resid 104 and name HD1*) (( segid " " and resid 105 and name HN )) 1.800 0.000 3.200 peak 2047 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2048} ( segid " " and resid 104 and name HD1*) ( segid " " and resid 135 and name HD* ) 1.800 0.000 3.200 peak 2048 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2049} ( segid " " and resid 104 and name HD1*) ( segid " " and resid 135 and name HE* ) 1.800 0.000 3.200 peak 2049 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2050} ( segid " " and resid 104 and name HD1*) (( segid " " and resid 126 and name HB )) 1.800 0.000 1.800 peak 2050 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2052} ( segid " " and resid 104 and name HD1*) ( segid " " and resid 126 and name HG1*) 1.800 0.000 3.200 peak 2052 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2053} (( segid " " and resid 104 and name HG1*)) (( segid " " and resid 104 and name HA )) 1.800 0.000 3.200 peak 2053 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2054} (( segid " " and resid 104 and name HG1*)) (( segid " " and resid 104 and name HB )) 1.800 0.000 3.200 peak 2054 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2055} (( segid " " and resid 104 and name HG1*)) (( segid " " and resid 104 and name HN )) 1.800 0.000 1.800 peak 2055 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2056} ( segid " " and resid 104 and name HG2*) (( segid " " and resid 104 and name HA )) 1.800 0.000 0.900 peak 2056 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2057} ( segid " " and resid 104 and name HG2*) (( segid " " and resid 104 and name HB )) 1.800 0.000 0.900 peak 2057 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2058} ( segid " " and resid 104 and name HG2*) (( segid " " and resid 104 and name HG1*)) 1.800 0.000 3.200 peak 2058 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2059} ( segid " " and resid 104 and name HG2*) (( segid " " and resid 104 and name HN )) 1.800 0.000 1.800 peak 2059 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2060} ( segid " " and resid 104 and name HG2*) (( segid " " and resid 105 and name HN )) 1.800 0.000 1.800 peak 2060 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2061} ( segid " " and resid 104 and name HG2*) (( segid " " and resid 126 and name HB )) 1.800 0.000 1.800 peak 2061 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2062} (( segid " " and resid 104 and name HN )) (( segid " " and resid 103 and name HA )) 1.800 0.000 0.900 peak 2062 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2063} (( segid " " and resid 104 and name HN )) (( segid " " and resid 12 and name HA )) 1.800 0.000 1.800 peak 2063 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2064} (( segid " " and resid 104 and name HN )) (( segid " " and resid 104 and name HB )) 1.800 0.000 1.800 peak 2064 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2065} (( segid " " and resid 104 and name HN )) (( segid " " and resid 11 and name HN )) 1.800 0.000 1.800 peak 2065 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2066} (( segid " " and resid 105 and name HB )) (( segid " " and resid 107 and name HN )) 1.800 0.000 3.200 peak 2066 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2067} (( segid " " and resid 105 and name HB )) (( segid " " and resid 105 and name HA )) 1.800 0.000 0.900 peak 2067 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2068} ( segid " " and resid 105 and name HG2*) (( segid " " and resid 105 and name HA )) 1.800 0.000 0.900 peak 2068 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2069} ( segid " " and resid 105 and name HG2*) (( segid " " and resid 105 and name HB )) 1.800 0.000 0.900 peak 2069 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2070} (( segid " " and resid 105 and name HN )) (( segid " " and resid 106 and name HB* )) 1.800 0.000 3.200 peak 2070 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2071} (( segid " " and resid 105 and name HN )) (( segid " " and resid 106 and name HN )) 1.800 0.000 3.200 peak 2071 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2072} (( segid " " and resid 105 and name HN )) (( segid " " and resid 104 and name HA )) 1.800 0.000 0.900 peak 2072 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2073} (( segid " " and resid 105 and name HN )) (( segid " " and resid 105 and name HA )) 1.800 0.000 1.800 peak 2073 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2074} (( segid " " and resid 105 and name HN )) (( segid " " and resid 105 and name HB )) 1.800 0.000 3.200 peak 2074 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2075} (( segid " " and resid 105 and name HN )) ( segid " " and resid 105 and name HG2*) 1.800 0.000 1.800 peak 2075 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2076} (( segid " " and resid 106 and name HA )) (( segid " " and resid 109 and name HN )) 1.800 0.000 3.200 peak 2076 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2077} (( segid " " and resid 106 and name HB* )) (( segid " " and resid 107 and name HN )) 1.800 0.000 3.200 peak 2077 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2078} (( segid " " and resid 106 and name HB* )) (( segid " " and resid 108 and name HN )) 1.800 0.000 3.200 peak 2078 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2079} (( segid " " and resid 106 and name HB* )) (( segid " " and resid 106 and name HA )) 1.800 0.000 0.900 peak 2079 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2080} (( segid " " and resid 106 and name HG* )) (( segid " " and resid 106 and name HA )) 1.800 0.000 0.900 peak 2080 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2081} (( segid " " and resid 106 and name HG* )) (( segid " " and resid 106 and name HB* )) 1.800 0.000 0.900 peak 2081 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2082} (( segid " " and resid 106 and name HN )) (( segid " " and resid 107 and name HA )) 1.800 0.000 3.200 peak 2082 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2083} (( segid " " and resid 106 and name HN )) (( segid " " and resid 107 and name HD2*)) 1.800 0.000 3.200 peak 2083 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2086} (( segid " " and resid 106 and name HN )) (( segid " " and resid 106 and name HB* )) 1.800 0.000 1.800 peak 2086 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2087} (( segid " " and resid 106 and name HN )) (( segid " " and resid 106 and name HG* )) 1.800 0.000 3.200 peak 2087 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2089} (( segid " " and resid 106 and name HN )) (( segid " " and resid 105 and name HB )) 1.800 0.000 0.900 peak 2089 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2090} (( segid " " and resid 106 and name HN )) ( segid " " and resid 105 and name HG2*) 1.800 0.000 1.800 peak 2090 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2091} (( segid " " and resid 107 and name HB* )) (( segid " " and resid 107 and name HA )) 1.800 0.000 0.900 peak 2091 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2092} (( segid " " and resid 107 and name HD2*)) (( segid " " and resid 107 and name HA )) 1.800 0.000 0.900 peak 2092 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2093} (( segid " " and resid 107 and name HD2*)) (( segid " " and resid 107 and name HB* )) 1.800 0.000 1.800 peak 2093 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2094} (( segid " " and resid 107 and name HN )) (( segid " " and resid 107 and name HA )) 1.800 0.000 0.900 peak 2094 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2095} (( segid " " and resid 107 and name HN )) (( segid " " and resid 107 and name HB* )) 1.800 0.000 1.800 peak 2095 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2096} (( segid " " and resid 107 and name HN )) (( segid " " and resid 106 and name HA )) 1.800 0.000 1.800 peak 2096 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2097} (( segid " " and resid 107 and name HN )) (( segid " " and resid 106 and name HG* )) 1.800 0.000 1.800 peak 2097 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2098} (( segid " " and resid 107 and name HN )) (( segid " " and resid 106 and name HN )) 1.800 0.000 1.800 peak 2098 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2099} (( segid " " and resid 107 and name HN )) (( segid " " and resid 109 and name HN )) 1.800 0.000 3.200 peak 2099 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2100} (( segid " " and resid 108 and name HB* )) (( segid " " and resid 108 and name HA )) 1.800 0.000 3.200 peak 2100 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2101} (( segid " " and resid 108 and name HB* )) (( segid " " and resid 109 and name HN )) 1.800 0.000 1.800 peak 2101 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2102} (( segid " " and resid 108 and name HG* )) (( segid " " and resid 108 and name HA )) 1.800 0.000 1.800 peak 2102 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2103} (( segid " " and resid 108 and name HG* )) (( segid " " and resid 108 and name HB* )) 1.800 0.000 1.800 peak 2103 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2104} (( segid " " and resid 108 and name HG* )) (( segid " " and resid 109 and name HN )) 1.800 0.000 3.200 peak 2104 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2105} (( segid " " and resid 108 and name HG* )) ( segid " " and resid 126 and name HG2*) 1.800 0.000 3.200 peak 2105 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2106} (( segid " " and resid 108 and name HN )) (( segid " " and resid 107 and name HA )) 1.800 0.000 1.800 peak 2106 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2107} (( segid " " and resid 108 and name HN )) (( segid " " and resid 107 and name HB* )) 1.800 0.000 1.800 peak 2107 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2110} (( segid " " and resid 108 and name HN )) (( segid " " and resid 108 and name HB* )) 1.800 0.000 1.800 peak 2110 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2111} (( segid " " and resid 108 and name HN )) (( segid " " and resid 108 and name HG* )) 1.800 0.000 1.800 peak 2111 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2112} (( segid " " and resid 108 and name HN )) (( segid " " and resid 109 and name HN )) 1.800 0.000 0.900 peak 2112 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2113} (( segid " " and resid 109 and name HN )) (( segid " " and resid 110 and name HN )) 1.800 0.000 3.200 peak 2113 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2114} (( segid " " and resid 109 and name HN )) (( segid " " and resid 108 and name HA )) 1.800 0.000 1.800 peak 2114 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2115} (( segid " " and resid 109 and name HN )) (( segid " " and resid 109 and name HA )) 1.800 0.000 0.900 peak 2115 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2116} (( segid " " and resid 109 and name HN )) (( segid " " and resid 109 and name HB* )) 1.800 0.000 1.800 peak 2116 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2117} (( segid " " and resid 109 and name HN )) ( segid " " and resid 109 and name HD2*) 1.800 0.000 3.200 peak 2117 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2118} (( segid " " and resid 109 and name HN )) (( segid " " and resid 109 and name HG )) 1.800 0.000 1.800 peak 2118 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2119} (( segid " " and resid 109 and name HN )) (( segid " " and resid 114 and name HN )) 1.800 0.000 3.200 peak 2119 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2120} (( segid " " and resid 110 and name HA )) (( segid " " and resid 110 and name HB* )) 1.800 0.000 0.900 peak 2120 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2121} (( segid " " and resid 110 and name HA )) (( segid " " and resid 112 and name HN )) 1.800 0.000 3.200 peak 2121 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2124} (( segid " " and resid 110 and name HB* )) (( segid " " and resid 110 and name HA )) 1.800 0.000 1.800 peak 2124 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2126} (( segid " " and resid 110 and name HB* )) (( segid " " and resid 110 and name HN )) 1.800 0.000 1.800 peak 2126 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2127} (( segid " " and resid 110 and name HN )) (( segid " " and resid 113 and name HN )) 1.800 0.000 3.200 peak 2127 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2128} (( segid " " and resid 110 and name HN )) (( segid " " and resid 110 and name HA )) 1.800 0.000 1.800 peak 2128 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2129} (( segid " " and resid 110 and name HN )) (( segid " " and resid 110 and name HB* )) 1.800 0.000 1.800 peak 2129 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2130} (( segid " " and resid 110 and name HN )) (( segid " " and resid 109 and name HA )) 1.800 0.000 1.800 peak 2130 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2131} (( segid " " and resid 110 and name HN )) (( segid " " and resid 111 and name HN )) 1.800 0.000 3.200 peak 2131 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2133} (( segid " " and resid 111 and name HB* )) (( segid " " and resid 111 and name HN )) 1.800 0.000 1.800 peak 2133 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2134} (( segid " " and resid 111 and name HN )) (( segid " " and resid 110 and name HA )) 1.800 0.000 1.800 peak 2134 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2135} (( segid " " and resid 111 and name HN )) (( segid " " and resid 111 and name HA )) 1.800 0.000 1.800 peak 2135 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2136} (( segid " " and resid 111 and name HN )) (( segid " " and resid 111 and name HB* )) 1.800 0.000 1.800 peak 2136 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2137} (( segid " " and resid 111 and name HN )) ( segid " " and resid 111 and name HD1*) 1.800 0.000 3.200 peak 2137 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2138} (( segid " " and resid 111 and name HN )) (( segid " " and resid 111 and name HG )) 1.800 0.000 3.200 peak 2138 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2139} (( segid " " and resid 112 and name HB )) (( segid " " and resid 112 and name HA )) 1.800 0.000 3.200 peak 2139 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2140} (( segid " " and resid 112 and name HB )) (( segid " " and resid 112 and name HN )) 1.800 0.000 1.800 peak 2140 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2141} ( segid " " and resid 112 and name HG2*) (( segid " " and resid 112 and name HA )) 1.800 0.000 1.800 peak 2141 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2142} ( segid " " and resid 112 and name HG2*) (( segid " " and resid 112 and name HB )) 1.800 0.000 3.200 peak 2142 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2143} (( segid " " and resid 112 and name HN )) (( segid " " and resid 113 and name HN )) 1.800 0.000 1.800 peak 2143 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2144} (( segid " " and resid 112 and name HN )) (( segid " " and resid 111 and name HA )) 1.800 0.000 1.800 peak 2144 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2145} (( segid " " and resid 112 and name HN )) (( segid " " and resid 111 and name HB* )) 1.800 0.000 1.800 peak 2145 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2146} (( segid " " and resid 112 and name HN )) (( segid " " and resid 111 and name HN )) 1.800 0.000 1.800 peak 2146 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2147} (( segid " " and resid 112 and name HN )) (( segid " " and resid 112 and name HA )) 1.800 0.000 0.900 peak 2147 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2148} (( segid " " and resid 112 and name HN )) ( segid " " and resid 112 and name HG2*) 1.800 0.000 1.800 peak 2148 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2149} (( segid " " and resid 112 and name HN )) ( segid " " and resid 114 and name HG2*) 1.800 0.000 3.200 peak 2149 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2150} (( segid " " and resid 113 and name HA )) (( segid " " and resid 113 and name HN )) 1.800 0.000 3.200 peak 2150 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2151} (( segid " " and resid 113 and name HB* )) (( segid " " and resid 113 and name HA )) 1.800 0.000 1.800 peak 2151 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2152} (( segid " " and resid 113 and name HB* )) (( segid " " and resid 113 and name HN )) 1.800 0.000 1.800 peak 2152 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2153} (( segid " " and resid 113 and name HB* )) (( segid " " and resid 114 and name HN )) 1.800 0.000 3.200 peak 2153 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2154} (( segid " " and resid 113 and name HD2*)) (( segid " " and resid 113 and name HA )) 1.800 0.000 3.200 peak 2154 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2155} (( segid " " and resid 113 and name HD2*)) (( segid " " and resid 113 and name HB* )) 1.800 0.000 1.800 peak 2155 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2157} (( segid " " and resid 113 and name HN )) (( segid " " and resid 114 and name HN )) 1.800 0.000 3.200 peak 2157 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2158} (( segid " " and resid 114 and name HA )) (( segid " " and resid 115 and name HN )) 1.800 0.000 1.800 peak 2158 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2159} (( segid " " and resid 114 and name HA )) (( segid " " and resid 114 and name HN )) 1.800 0.000 0.900 peak 2159 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2160} (( segid " " and resid 114 and name HB )) (( segid " " and resid 114 and name HA )) 1.800 0.000 3.200 peak 2160 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2161} ( segid " " and resid 114 and name HG2*) (( segid " " and resid 113 and name HN )) 1.800 0.000 3.200 peak 2161 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 2161} ( segid " " and resid 114 and name HG1*) (( segid " " and resid 113 and name HN )) ASSI { 2162} ( segid " " and resid 114 and name HG2*) (( segid " " and resid 114 and name HA )) 1.800 0.000 0.900 peak 2162 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 2162} ( segid " " and resid 114 and name HG1*) (( segid " " and resid 114 and name HA )) ASSI { 2163} ( segid " " and resid 114 and name HG1*) (( segid " " and resid 114 and name HB )) 1.800 0.000 0.900 peak 2163 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 2163} ( segid " " and resid 114 and name HG2*) (( segid " " and resid 114 and name HB )) ASSI { 2164} ( segid " " and resid 114 and name HG2*) (( segid " " and resid 114 and name HA )) 1.800 0.000 3.200 peak 2164 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2165} ( segid " " and resid 114 and name HG2*) (( segid " " and resid 114 and name HB )) 1.800 0.000 3.200 peak 2165 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2166} (( segid " " and resid 114 and name HN )) (( segid " " and resid 115 and name HN )) 1.800 0.000 1.800 peak 2166 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2167} (( segid " " and resid 114 and name HN )) (( segid " " and resid 114 and name HB )) 1.800 0.000 1.800 peak 2167 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2168} (( segid " " and resid 114 and name HN )) ( segid " " and resid 114 and name HG2*) 1.800 0.000 0.900 peak 2168 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 2168} (( segid " " and resid 114 and name HN )) ( segid " " and resid 114 and name HG1*) ASSI { 2169} (( segid " " and resid 115 and name HB* )) (( segid " " and resid 116 and name HA )) 1.800 0.000 3.200 peak 2169 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2170} (( segid " " and resid 115 and name HB* )) (( segid " " and resid 115 and name HA )) 1.800 0.000 0.900 peak 2170 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2171} (( segid " " and resid 115 and name HB* )) (( segid " " and resid 115 and name HN )) 1.800 0.000 1.800 peak 2171 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2172} (( segid " " and resid 115 and name HB* )) (( segid " " and resid 114 and name HN )) 1.800 0.000 3.200 peak 2172 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2173} (( segid " " and resid 115 and name HN )) (( segid " " and resid 116 and name HA )) 1.800 0.000 3.200 peak 2173 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2174} (( segid " " and resid 115 and name HN )) (( segid " " and resid 115 and name HA )) 1.800 0.000 0.900 peak 2174 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2175} (( segid " " and resid 116 and name HA )) (( segid " " and resid 116 and name HN )) 1.800 0.000 3.200 peak 2175 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2176} (( segid " " and resid 116 and name HA )) (( segid " " and resid 117 and name HN )) 1.800 0.000 1.800 peak 2176 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2177} (( segid " " and resid 116 and name HB* )) (( segid " " and resid 116 and name HA )) 1.800 0.000 3.200 peak 2177 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2178} (( segid " " and resid 116 and name HB* )) (( segid " " and resid 116 and name HN )) 1.800 0.000 0.900 peak 2178 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2179} (( segid " " and resid 116 and name HN )) (( segid " " and resid 117 and name HN )) 1.800 0.000 1.800 peak 2179 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2180} (( segid " " and resid 117 and name HA )) (( segid " " and resid 117 and name HB* )) 1.800 0.000 0.900 peak 2180 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2181} (( segid " " and resid 117 and name HB* )) ( segid " " and resid 118 and name HD* ) 1.800 0.000 3.200 peak 2181 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2186} (( segid " " and resid 117 and name HB* )) (( segid " " and resid 117 and name HA )) 1.800 0.000 1.800 peak 2186 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2187} (( segid " " and resid 117 and name HB* )) (( segid " " and resid 117 and name HN )) 1.800 0.000 1.800 peak 2187 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2188} (( segid " " and resid 117 and name HB* )) ( segid " " and resid 118 and name HD* ) 1.800 0.000 3.200 peak 2188 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2189} (( segid " " and resid 117 and name HB* )) (( segid " " and resid 118 and name HN )) 1.800 0.000 3.200 peak 2189 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2190} (( segid " " and resid 117 and name HE* )) (( segid " " and resid 117 and name HB* )) 1.800 0.000 1.800 peak 2190 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2191} (( segid " " and resid 117 and name HG* )) (( segid " " and resid 117 and name HA )) 1.800 0.000 0.900 peak 2191 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2192} (( segid " " and resid 117 and name HG* )) (( segid " " and resid 117 and name HB* )) 1.800 0.000 0.900 peak 2192 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2193} (( segid " " and resid 117 and name HN )) (( segid " " and resid 116 and name HB* )) 1.800 0.000 1.800 peak 2193 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2194} (( segid " " and resid 117 and name HN )) (( segid " " and resid 117 and name HA )) 1.800 0.000 0.900 peak 2194 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2195} (( segid " " and resid 117 and name HN )) (( segid " " and resid 117 and name HB* )) 1.800 0.000 3.200 peak 2195 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2196} (( segid " " and resid 117 and name HN )) (( segid " " and resid 117 and name HD* )) 1.800 0.000 3.200 peak 2196 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2197} (( segid " " and resid 117 and name HN )) (( segid " " and resid 117 and name HG* )) 1.800 0.000 3.200 peak 2197 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2199} (( segid " " and resid 117 and name HN )) (( segid " " and resid 118 and name HN )) 1.800 0.000 1.800 peak 2199 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2200} (( segid " " and resid 118 and name HA )) (( segid " " and resid 119 and name HN )) 1.800 0.000 1.800 peak 2200 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2201} (( segid " " and resid 118 and name HB* )) (( segid " " and resid 118 and name HA )) 1.800 0.000 1.800 peak 2201 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2202} (( segid " " and resid 118 and name HB* )) ( segid " " and resid 118 and name HD* ) 1.800 0.000 1.800 peak 2202 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2205} (( segid " " and resid 118 and name HB* )) (( segid " " and resid 118 and name HA )) 1.800 0.000 1.800 peak 2205 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2206} (( segid " " and resid 118 and name HB* )) (( segid " " and resid 118 and name HN )) 1.800 0.000 1.800 peak 2206 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2207} ( segid " " and resid 118 and name HD* ) (( segid " " and resid 118 and name HA )) 1.800 0.000 1.800 peak 2207 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2209} ( segid " " and resid 118 and name HD* ) (( segid " " and resid 118 and name HB* )) 1.800 0.000 3.200 peak 2209 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2210} ( segid " " and resid 118 and name HD* ) (( segid " " and resid 118 and name HN )) 1.800 0.000 3.200 peak 2210 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2211} (( segid " " and resid 118 and name HN )) (( segid " " and resid 119 and name HN )) 1.800 0.000 0.900 peak 2211 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2212} (( segid " " and resid 118 and name HN )) (( segid " " and resid 117 and name HA )) 1.800 0.000 1.800 peak 2212 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2213} (( segid " " and resid 118 and name HN )) (( segid " " and resid 118 and name HA )) 1.800 0.000 1.800 peak 2213 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2214} (( segid " " and resid 118 and name HN )) (( segid " " and resid 118 and name HB* )) 1.800 0.000 3.200 peak 2214 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2215} (( segid " " and resid 119 and name HA* )) (( segid " " and resid 120 and name HN )) 1.800 0.000 0.900 peak 2215 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2216} (( segid " " and resid 119 and name HN )) (( segid " " and resid 119 and name HA* )) 1.800 0.000 0.900 peak 2216 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2217} (( segid " " and resid 119 and name HN )) (( segid " " and resid 120 and name HA )) 1.800 0.000 3.200 peak 2217 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2218} (( segid " " and resid 119 and name HN )) (( segid " " and resid 120 and name HN )) 1.800 0.000 3.200 peak 2218 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2219} (( segid " " and resid 119 and name HN )) (( segid " " and resid 118 and name HB* )) 1.800 0.000 1.800 peak 2219 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2220} (( segid " " and resid 120 and name HA )) (( segid " " and resid 120 and name HN )) 1.800 0.000 1.800 peak 2220 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2221} (( segid " " and resid 120 and name HN )) (( segid " " and resid 121 and name HN )) 1.800 0.000 1.800 peak 2221 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2222} (( segid " " and resid 121 and name HA )) (( segid " " and resid 122 and name HB* )) 1.800 0.000 3.200 peak 2222 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2223} (( segid " " and resid 121 and name HB* )) (( segid " " and resid 121 and name HA )) 1.800 0.000 1.800 peak 2223 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2224} (( segid " " and resid 121 and name HE* )) (( segid " " and resid 121 and name HA )) 1.800 0.000 3.200 peak 2224 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2225} (( segid " " and resid 121 and name HN )) (( segid " " and resid 120 and name HA )) 1.800 0.000 3.200 peak 2225 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2226} (( segid " " and resid 121 and name HN )) (( segid " " and resid 121 and name HA )) 1.800 0.000 1.800 peak 2226 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2227} (( segid " " and resid 121 and name HN )) (( segid " " and resid 121 and name HB* )) 1.800 0.000 0.900 peak 2227 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2228} (( segid " " and resid 121 and name HN )) (( segid " " and resid 121 and name HE* )) 1.800 0.000 3.200 peak 2228 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2229} (( segid " " and resid 121 and name HN )) (( segid " " and resid 121 and name HG* )) 1.800 0.000 3.200 peak 2229 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2230} (( segid " " and resid 122 and name HA )) (( segid " " and resid 137 and name HN )) 1.800 0.000 3.200 peak 2230 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2231} (( segid " " and resid 122 and name HA )) (( segid " " and resid 122 and name HB* )) 1.800 0.000 1.800 peak 2231 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2232} (( segid " " and resid 122 and name HB* )) (( segid " " and resid 124 and name HN )) 1.800 0.000 1.800 peak 2232 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2233} (( segid " " and resid 122 and name HB* )) ( segid " " and resid 134 and name HG2*) 1.800 0.000 3.200 peak 2233 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2234} (( segid " " and resid 122 and name HB* )) (( segid " " and resid 141 and name HB )) 1.800 0.000 3.200 peak 2234 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2235} (( segid " " and resid 122 and name HB* )) ( segid " " and resid 141 and name HD1*) 1.800 0.000 3.200 peak 2235 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2236} (( segid " " and resid 122 and name HB* )) ( segid " " and resid 141 and name HG2*) 1.800 0.000 3.200 peak 2236 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2237} (( segid " " and resid 122 and name HB* )) (( segid " " and resid 118 and name HB* )) 1.800 0.000 3.200 peak 2237 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2238} (( segid " " and resid 122 and name HB* )) ( segid " " and resid 118 and name HD* ) 1.800 0.000 3.200 peak 2238 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2242} (( segid " " and resid 122 and name HB* )) ( segid " " and resid 134 and name HG2*) 1.800 0.000 3.200 peak 2242 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2243} (( segid " " and resid 122 and name HB* )) (( segid " " and resid 122 and name HA )) 1.800 0.000 3.200 peak 2243 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2244} (( segid " " and resid 122 and name HB* )) (( segid " " and resid 122 and name HN )) 1.800 0.000 3.200 peak 2244 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2245} (( segid " " and resid 122 and name HN )) (( segid " " and resid 121 and name HA )) 1.800 0.000 3.200 peak 2245 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2246} (( segid " " and resid 122 and name HN )) (( segid " " and resid 121 and name HG* )) 1.800 0.000 3.200 peak 2246 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2247} (( segid " " and resid 122 and name HN )) (( segid " " and resid 121 and name HN )) 1.800 0.000 1.800 peak 2247 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2248} (( segid " " and resid 122 and name HN )) (( segid " " and resid 123 and name HA )) 1.800 0.000 3.200 peak 2248 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2249} (( segid " " and resid 122 and name HN )) (( segid " " and resid 123 and name HN )) 1.800 0.000 3.200 peak 2249 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2250} (( segid " " and resid 122 and name HN )) (( segid " " and resid 122 and name HA )) 1.800 0.000 3.200 peak 2250 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2251} (( segid " " and resid 122 and name HN )) (( segid " " and resid 122 and name HB* )) 1.800 0.000 1.800 peak 2251 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2252} (( segid " " and resid 123 and name HA )) (( segid " " and resid 124 and name HN )) 1.800 0.000 3.200 peak 2252 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2253} (( segid " " and resid 123 and name HN )) (( segid " " and resid 123 and name HA )) 1.800 0.000 3.200 peak 2253 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2254} (( segid " " and resid 123 and name HN )) (( segid " " and resid 122 and name HA )) 1.800 0.000 1.800 peak 2254 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2255} (( segid " " and resid 123 and name HN )) (( segid " " and resid 122 and name HB* )) 1.800 0.000 3.200 peak 2255 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2259} (( segid " " and resid 124 and name HA2 )) (( segid " " and resid 124 and name HA1 )) 1.800 0.000 0.900 peak 2259 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2260} (( segid " " and resid 124 and name HA2 )) (( segid " " and resid 124 and name HN )) 1.800 0.000 1.800 peak 2260 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2261} (( segid " " and resid 124 and name HA2 )) (( segid " " and resid 125 and name HN )) 1.800 0.000 0.900 peak 2261 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2262} (( segid " " and resid 124 and name HN )) (( segid " " and resid 124 and name HA* )) 1.800 0.000 1.800 peak 2262 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2263} (( segid " " and resid 124 and name HN )) (( segid " " and resid 125 and name HN )) 1.800 0.000 3.200 peak 2263 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2264} (( segid " " and resid 124 and name HN )) (( segid " " and resid 136 and name HA )) 1.800 0.000 3.200 peak 2264 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2265} (( segid " " and resid 124 and name HN )) (( segid " " and resid 123 and name HN )) 1.800 0.000 1.800 peak 2265 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2266} (( segid " " and resid 124 and name HN )) (( segid " " and resid 122 and name HA )) 1.800 0.000 3.200 peak 2266 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2267} (( segid " " and resid 124 and name HN )) (( segid " " and resid 135 and name HB* )) 1.800 0.000 3.200 peak 2267 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2269} (( segid " " and resid 125 and name HA )) (( segid " " and resid 134 and name HA )) 1.800 0.000 1.800 peak 2269 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2270} (( segid " " and resid 125 and name HA )) ( segid " " and resid 125 and name HD2*) 1.800 0.000 0.900 peak 2270 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 2270} (( segid " " and resid 125 and name HA )) ( segid " " and resid 125 and name HD1*) ASSI { 2271} (( segid " " and resid 125 and name HA )) ( segid " " and resid 126 and name HG1*) 1.800 0.000 3.200 peak 2271 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 2271} (( segid " " and resid 125 and name HA )) ( segid " " and resid 126 and name HG2*) ASSI { 2272} (( segid " " and resid 125 and name HB* )) (( segid " " and resid 125 and name HA )) 1.800 0.000 3.200 peak 2272 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2275} (( segid " " and resid 125 and name HB2 )) (( segid " " and resid 125 and name HA )) 1.800 0.000 3.200 peak 2275 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2277} ( segid " " and resid 125 and name HD2*) (( segid " " and resid 134 and name HA )) 1.800 0.000 0.900 peak 2277 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2278} ( segid " " and resid 125 and name HD2*) ( segid " " and resid 134 and name HD1*) 1.800 0.000 0.900 peak 2278 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2279} ( segid " " and resid 125 and name HD2*) (( segid " " and resid 125 and name HA )) 1.800 0.000 0.900 peak 2279 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2280} ( segid " " and resid 125 and name HD2*) (( segid " " and resid 125 and name HB* )) 1.800 0.000 0.900 peak 2280 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2281} ( segid " " and resid 125 and name HD2*) ( segid " " and resid 126 and name HG1*) 1.800 0.000 3.200 peak 2281 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2282} (( segid " " and resid 125 and name HN )) (( segid " " and resid 124 and name HA* )) 1.800 0.000 1.800 peak 2282 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2283} (( segid " " and resid 125 and name HN )) (( segid " " and resid 125 and name HA )) 1.800 0.000 1.800 peak 2283 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2284} (( segid " " and resid 125 and name HN )) (( segid " " and resid 125 and name HB* )) 1.800 0.000 1.800 peak 2284 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2285} (( segid " " and resid 125 and name HN )) ( segid " " and resid 125 and name HD1*) 1.800 0.000 3.200 peak 2285 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2286} (( segid " " and resid 126 and name HB )) (( segid " " and resid 133 and name HB )) 1.800 0.000 3.200 peak 2286 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2287} (( segid " " and resid 126 and name HB )) ( segid " " and resid 133 and name HG2*) 1.800 0.000 3.200 peak 2287 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2288} (( segid " " and resid 126 and name HB )) (( segid " " and resid 126 and name HA )) 1.800 0.000 3.200 peak 2288 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2289} (( segid " " and resid 126 and name HB )) ( segid " " and resid 126 and name HG1*) 1.800 0.000 0.900 peak 2289 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 2289} (( segid " " and resid 126 and name HB )) ( segid " " and resid 126 and name HG2*) ASSI { 2290} ( segid " " and resid 126 and name HG2*) (( segid " " and resid 126 and name HA )) 1.800 0.000 1.800 peak 2290 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 2290} ( segid " " and resid 126 and name HG1*) (( segid " " and resid 126 and name HA )) ASSI { 2291} ( segid " " and resid 126 and name HG2*) ( segid " " and resid 104 and name HD1*) 1.800 0.000 0.900 peak 2291 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2292} ( segid " " and resid 126 and name HG2*) (( segid " " and resid 133 and name HA )) 1.800 0.000 3.200 peak 2292 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2293} ( segid " " and resid 126 and name HG2*) (( segid " " and resid 133 and name HB )) 1.800 0.000 3.200 peak 2293 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2294} ( segid " " and resid 126 and name HG2*) ( segid " " and resid 133 and name HG2*) 1.800 0.000 3.200 peak 2294 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2295} ( segid " " and resid 126 and name HG2*) (( segid " " and resid 127 and name HN )) 1.800 0.000 3.200 peak 2295 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2296} ( segid " " and resid 126 and name HG2*) (( segid " " and resid 128 and name HB )) 1.800 0.000 3.200 peak 2296 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2297} ( segid " " and resid 126 and name HG2*) ( segid " " and resid 128 and name HG2*) 1.800 0.000 3.200 peak 2297 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2298} ( segid " " and resid 126 and name HG2*) (( segid " " and resid 126 and name HA )) 1.800 0.000 1.800 peak 2298 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2299} ( segid " " and resid 126 and name HG2*) (( segid " " and resid 126 and name HB )) 1.800 0.000 0.900 peak 2299 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2300} ( segid " " and resid 126 and name HG1*) (( segid " " and resid 133 and name HB )) 1.800 0.000 3.200 peak 2300 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2301} ( segid " " and resid 126 and name HG1*) ( segid " " and resid 133 and name HG2*) 1.800 0.000 3.200 peak 2301 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2302} ( segid " " and resid 126 and name HG1*) (( segid " " and resid 127 and name HN )) 1.800 0.000 1.800 peak 2302 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2304} ( segid " " and resid 126 and name HG1*) (( segid " " and resid 135 and name HB* )) 1.800 0.000 3.200 peak 2304 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2305} ( segid " " and resid 126 and name HG1*) ( segid " " and resid 135 and name HD* ) 1.800 0.000 3.200 peak 2305 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2306} ( segid " " and resid 126 and name HG1*) (( segid " " and resid 126 and name HA )) 1.800 0.000 0.900 peak 2306 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2307} ( segid " " and resid 126 and name HG1*) (( segid " " and resid 126 and name HB )) 1.800 0.000 0.900 peak 2307 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2309} (( segid " " and resid 126 and name HN )) (( segid " " and resid 134 and name HA )) 1.800 0.000 3.200 peak 2309 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2310} (( segid " " and resid 126 and name HN )) (( segid " " and resid 125 and name HA )) 1.800 0.000 0.900 peak 2310 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2311} (( segid " " and resid 126 and name HN )) (( segid " " and resid 125 and name HB* )) 1.800 0.000 3.200 peak 2311 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2312} (( segid " " and resid 126 and name HN )) (( segid " " and resid 126 and name HA )) 1.800 0.000 1.800 peak 2312 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2313} (( segid " " and resid 126 and name HN )) (( segid " " and resid 126 and name HB )) 1.800 0.000 1.800 peak 2313 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2314} (( segid " " and resid 126 and name HN )) ( segid " " and resid 126 and name HG2*) 1.800 0.000 3.200 peak 2314 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2315} (( segid " " and resid 127 and name HA )) (( segid " " and resid 132 and name HA )) 1.800 0.000 3.200 peak 2315 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2316} (( segid " " and resid 127 and name HN )) (( segid " " and resid 127 and name HA )) 1.800 0.000 1.800 peak 2316 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2317} (( segid " " and resid 127 and name HN )) (( segid " " and resid 126 and name HA )) 1.800 0.000 0.900 peak 2317 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2318} (( segid " " and resid 128 and name HA )) (( segid " " and resid 129 and name HN )) 1.800 0.000 0.900 peak 2318 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2319} (( segid " " and resid 128 and name HB )) (( segid " " and resid 129 and name HN )) 1.800 0.000 3.200 peak 2319 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2321} ( segid " " and resid 128 and name HG2*) (( segid " " and resid 129 and name HA )) 1.800 0.000 3.200 peak 2321 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2322} ( segid " " and resid 128 and name HG2*) (( segid " " and resid 129 and name HN )) 1.800 0.000 3.200 peak 2322 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2323} ( segid " " and resid 128 and name HG2*) (( segid " " and resid 130 and name HN )) 1.800 0.000 3.200 peak 2323 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2324} ( segid " " and resid 128 and name HG2*) (( segid " " and resid 128 and name HA )) 1.800 0.000 3.200 peak 2324 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2325} ( segid " " and resid 128 and name HG2*) (( segid " " and resid 128 and name HB )) 1.800 0.000 0.900 peak 2325 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2326} (( segid " " and resid 128 and name HN )) (( segid " " and resid 131 and name HN )) 1.800 0.000 3.200 peak 2326 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2327} (( segid " " and resid 128 and name HN )) (( segid " " and resid 129 and name HN )) 1.800 0.000 3.200 peak 2327 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2328} (( segid " " and resid 128 and name HN )) (( segid " " and resid 130 and name HN )) 1.800 0.000 3.200 peak 2328 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2329} (( segid " " and resid 128 and name HN )) (( segid " " and resid 132 and name HA )) 1.800 0.000 3.200 peak 2329 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2330} (( segid " " and resid 128 and name HN )) (( segid " " and resid 127 and name HA )) 1.800 0.000 0.900 peak 2330 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2331} (( segid " " and resid 128 and name HN )) (( segid " " and resid 128 and name HA )) 1.800 0.000 0.900 peak 2331 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2332} (( segid " " and resid 128 and name HN )) (( segid " " and resid 128 and name HB )) 1.800 0.000 3.200 peak 2332 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2333} (( segid " " and resid 128 and name HN )) ( segid " " and resid 128 and name HG2*) 1.800 0.000 1.800 peak 2333 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2334} (( segid " " and resid 129 and name HA )) (( segid " " and resid 131 and name HB* )) 1.800 0.000 3.200 peak 2334 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2335} (( segid " " and resid 129 and name HA )) (( segid " " and resid 130 and name HN )) 1.800 0.000 3.200 peak 2335 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2340} (( segid " " and resid 129 and name HB* )) (( segid " " and resid 129 and name HN )) 1.800 0.000 3.200 peak 2340 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2341} (( segid " " and resid 129 and name HN )) (( segid " " and resid 131 and name HG* )) 1.800 0.000 3.200 peak 2341 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2342} (( segid " " and resid 129 and name HN )) (( segid " " and resid 131 and name HN )) 1.800 0.000 3.200 peak 2342 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2343} (( segid " " and resid 129 and name HN )) (( segid " " and resid 129 and name HA )) 1.800 0.000 0.900 peak 2343 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2344} (( segid " " and resid 129 and name HN )) (( segid " " and resid 129 and name HB* )) 1.800 0.000 1.800 peak 2344 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2345} (( segid " " and resid 129 and name HN )) (( segid " " and resid 130 and name HN )) 1.800 0.000 1.800 peak 2345 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2346} (( segid " " and resid 130 and name HA* )) (( segid " " and resid 131 and name HN )) 1.800 0.000 3.200 peak 2346 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2347} (( segid " " and resid 130 and name HA* )) (( segid " " and resid 130 and name HN )) 1.800 0.000 0.900 peak 2347 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2348} (( segid " " and resid 130 and name HA* )) (( segid " " and resid 131 and name HN )) 1.800 0.000 3.200 peak 2348 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2350} (( segid " " and resid 130 and name HA* )) (( segid " " and resid 130 and name HN )) 1.800 0.000 0.900 peak 2350 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2351} (( segid " " and resid 130 and name HN )) (( segid " " and resid 131 and name HN )) 1.800 0.000 1.800 peak 2351 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2352} (( segid " " and resid 131 and name HA )) (( segid " " and resid 132 and name HN )) 1.800 0.000 0.900 peak 2352 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2353} (( segid " " and resid 131 and name HD* )) (( segid " " and resid 131 and name HG* )) 1.800 0.000 3.200 peak 2353 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2354} (( segid " " and resid 131 and name HG* )) (( segid " " and resid 131 and name HA )) 1.800 0.000 3.200 peak 2354 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2355} (( segid " " and resid 131 and name HN )) (( segid " " and resid 131 and name HA )) 1.800 0.000 1.800 peak 2355 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2356} (( segid " " and resid 131 and name HN )) (( segid " " and resid 131 and name HB* )) 1.800 0.000 0.900 peak 2356 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2357} (( segid " " and resid 131 and name HN )) (( segid " " and resid 131 and name HG* )) 1.800 0.000 1.800 peak 2357 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2358} (( segid " " and resid 131 and name HN )) (( segid " " and resid 130 and name HA* )) 1.800 0.000 3.200 peak 2358 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2360} (( segid " " and resid 133 and name HB )) (( segid " " and resid 133 and name HA )) 1.800 0.000 3.200 peak 2360 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2361} ( segid " " and resid 133 and name HD1*) (( segid " " and resid 133 and name HA )) 1.800 0.000 1.800 peak 2361 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2362} ( segid " " and resid 133 and name HD1*) (( segid " " and resid 133 and name HB )) 1.800 0.000 3.200 peak 2362 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2363} ( segid " " and resid 133 and name HD1*) (( segid " " and resid 133 and name HG1*)) 1.800 0.000 3.200 peak 2363 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2364} ( segid " " and resid 133 and name HD1*) ( segid " " and resid 133 and name HG2*) 1.800 0.000 0.900 peak 2364 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2365} ( segid " " and resid 133 and name HD1*) (( segid " " and resid 133 and name HN )) 1.800 0.000 3.200 peak 2365 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2366} (( segid " " and resid 133 and name HG1*)) (( segid " " and resid 133 and name HA )) 1.800 0.000 3.200 peak 2366 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2367} (( segid " " and resid 133 and name HG1*)) (( segid " " and resid 133 and name HB )) 1.800 0.000 3.200 peak 2367 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2368} (( segid " " and resid 133 and name HG1*)) (( segid " " and resid 134 and name HN )) 1.800 0.000 3.200 peak 2368 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2369} ( segid " " and resid 133 and name HG2*) (( segid " " and resid 133 and name HA )) 1.800 0.000 1.800 peak 2369 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2370} ( segid " " and resid 133 and name HG2*) (( segid " " and resid 133 and name HB )) 1.800 0.000 3.200 peak 2370 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2371} ( segid " " and resid 133 and name HG2*) (( segid " " and resid 133 and name HG1*)) 1.800 0.000 3.200 peak 2371 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2372} ( segid " " and resid 133 and name HG2*) ( segid " " and resid 102 and name HD2*) 1.800 0.000 3.200 peak 2372 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2373} (( segid " " and resid 133 and name HN )) (( segid " " and resid 133 and name HA )) 1.800 0.000 3.200 peak 2373 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2374} (( segid " " and resid 133 and name HN )) (( segid " " and resid 133 and name HB )) 1.800 0.000 1.800 peak 2374 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2375} (( segid " " and resid 133 and name HN )) (( segid " " and resid 133 and name HG1*)) 1.800 0.000 3.200 peak 2375 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2376} (( segid " " and resid 133 and name HN )) ( segid " " and resid 133 and name HG2*) 1.800 0.000 3.200 peak 2376 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2377} (( segid " " and resid 133 and name HN )) (( segid " " and resid 132 and name HA )) 1.800 0.000 0.900 peak 2377 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2378} (( segid " " and resid 133 and name HN )) (( segid " " and resid 126 and name HN )) 1.800 0.000 3.200 peak 2378 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2379} (( segid " " and resid 134 and name HA )) (( segid " " and resid 134 and name HN )) 1.800 0.000 3.200 peak 2379 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2380} (( segid " " and resid 134 and name HA )) (( segid " " and resid 135 and name HA )) 1.800 0.000 3.200 peak 2380 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2381} (( segid " " and resid 134 and name HB )) (( segid " " and resid 134 and name HA )) 1.800 0.000 3.200 peak 2381 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2382} ( segid " " and resid 134 and name HD1*) (( segid " " and resid 134 and name HA )) 1.800 0.000 1.800 peak 2382 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2383} ( segid " " and resid 134 and name HD1*) (( segid " " and resid 134 and name HB )) 1.800 0.000 1.800 peak 2383 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2384} ( segid " " and resid 134 and name HD1*) (( segid " " and resid 134 and name HG1*)) 1.800 0.000 0.900 peak 2384 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2385} ( segid " " and resid 134 and name HD1*) ( segid " " and resid 134 and name HG2*) 1.800 0.000 1.800 peak 2385 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2386} ( segid " " and resid 134 and name HD1*) (( segid " " and resid 134 and name HN )) 1.800 0.000 3.200 peak 2386 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2387} ( segid " " and resid 134 and name HD1*) ( segid " " and resid 118 and name HE* ) 1.800 0.000 3.200 peak 2387 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2390} (( segid " " and resid 134 and name HG1*)) (( segid " " and resid 134 and name HA )) 1.800 0.000 3.200 peak 2390 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2391} (( segid " " and resid 134 and name HG1*)) (( segid " " and resid 134 and name HN )) 1.800 0.000 3.200 peak 2391 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2392} ( segid " " and resid 134 and name HG2*) (( segid " " and resid 134 and name HA )) 1.800 0.000 1.800 peak 2392 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2393} ( segid " " and resid 134 and name HG2*) (( segid " " and resid 134 and name HB )) 1.800 0.000 0.900 peak 2393 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2394} ( segid " " and resid 134 and name HG2*) (( segid " " and resid 134 and name HG1*)) 1.800 0.000 0.900 peak 2394 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2396} ( segid " " and resid 134 and name HG2*) (( segid " " and resid 134 and name HG1*)) 1.800 0.000 3.200 peak 2396 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2397} ( segid " " and resid 134 and name HG2*) (( segid " " and resid 135 and name HA )) 1.800 0.000 3.200 peak 2397 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2398} ( segid " " and resid 134 and name HG2*) (( segid " " and resid 135 and name HN )) 1.800 0.000 1.800 peak 2398 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2399} (( segid " " and resid 134 and name HN )) (( segid " " and resid 133 and name HA )) 1.800 0.000 0.900 peak 2399 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2400} (( segid " " and resid 134 and name HN )) ( segid " " and resid 133 and name HG2*) 1.800 0.000 1.800 peak 2400 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2401} (( segid " " and resid 134 and name HN )) (( segid " " and resid 134 and name HB )) 1.800 0.000 1.800 peak 2401 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2402} (( segid " " and resid 134 and name HN )) (( segid " " and resid 134 and name HG1*)) 1.800 0.000 1.800 peak 2402 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2403} (( segid " " and resid 134 and name HN )) ( segid " " and resid 134 and name HG2*) 1.800 0.000 3.200 peak 2403 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2404} (( segid " " and resid 134 and name HN )) (( segid " " and resid 23 and name HA )) 1.800 0.000 3.200 peak 2404 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2407} (( segid " " and resid 135 and name HB* )) (( segid " " and resid 135 and name HA )) 1.800 0.000 3.200 peak 2407 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2409} (( segid " " and resid 135 and name HB* )) (( segid " " and resid 135 and name HN )) 1.800 0.000 1.800 peak 2409 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2410} ( segid " " and resid 135 and name HD* ) (( segid " " and resid 135 and name HA )) 1.800 0.000 1.800 peak 2410 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2412} ( segid " " and resid 135 and name HD* ) (( segid " " and resid 135 and name HB* )) 1.800 0.000 3.200 peak 2412 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2413} ( segid " " and resid 135 and name HD* ) (( segid " " and resid 135 and name HN )) 1.800 0.000 3.200 peak 2413 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2414} ( segid " " and resid 135 and name HE* ) (( segid " " and resid 135 and name HA )) 1.800 0.000 3.200 peak 2414 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2415} ( segid " " and resid 135 and name HE* ) ( segid " " and resid 135 and name HD* ) 1.800 0.000 0.900 peak 2415 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2416} (( segid " " and resid 135 and name HN )) (( segid " " and resid 134 and name HA )) 1.800 0.000 0.900 peak 2416 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2417} (( segid " " and resid 135 and name HN )) (( segid " " and resid 125 and name HA )) 1.800 0.000 1.800 peak 2417 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2418} (( segid " " and resid 135 and name HN )) (( segid " " and resid 136 and name HA )) 1.800 0.000 3.200 peak 2418 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2419} (( segid " " and resid 135 and name HN )) (( segid " " and resid 136 and name HN )) 1.800 0.000 3.200 peak 2419 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2420} (( segid " " and resid 135 and name HN )) (( segid " " and resid 135 and name HA )) 1.800 0.000 1.800 peak 2420 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2421} (( segid " " and resid 135 and name HN )) (( segid " " and resid 135 and name HB* )) 1.800 0.000 1.800 peak 2421 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2422} (( segid " " and resid 136 and name HA )) (( segid " " and resid 136 and name HN )) 1.800 0.000 3.200 peak 2422 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2423} ( segid " " and resid 136 and name HD2*) (( segid " " and resid 137 and name HN )) 1.800 0.000 1.800 peak 2423 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2424} ( segid " " and resid 136 and name HD2*) (( segid " " and resid 136 and name HA )) 1.800 0.000 1.800 peak 2424 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2425} ( segid " " and resid 136 and name HD2*) (( segid " " and resid 136 and name HB* )) 1.800 0.000 1.800 peak 2425 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2426} ( segid " " and resid 136 and name HD2*) (( segid " " and resid 136 and name HN )) 1.800 0.000 3.200 peak 2426 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2428} (( segid " " and resid 136 and name HN )) (( segid " " and resid 136 and name HB* )) 1.800 0.000 3.200 peak 2428 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2429} (( segid " " and resid 136 and name HN )) ( segid " " and resid 136 and name HD2*) 1.800 0.000 3.200 peak 2429 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 2429} (( segid " " and resid 136 and name HN )) ( segid " " and resid 136 and name HD1*) ASSI { 2431} (( segid " " and resid 136 and name HN )) (( segid " " and resid 135 and name HA )) 1.800 0.000 1.800 peak 2431 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2433} (( segid " " and resid 137 and name HN )) (( segid " " and resid 137 and name HB* )) 1.800 0.000 1.800 peak 2433 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2434} (( segid " " and resid 137 and name HN )) (( segid " " and resid 136 and name HA )) 1.800 0.000 3.200 peak 2434 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2435} (( segid " " and resid 137 and name HN )) ( segid " " and resid 136 and name HD1*) 1.800 0.000 3.200 peak 2435 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2436} (( segid " " and resid 137 and name HN )) (( segid " " and resid 136 and name HG )) 1.800 0.000 3.200 peak 2436 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2437} (( segid " " and resid 138 and name HA )) (( segid " " and resid 139 and name HN )) 1.800 0.000 3.200 peak 2437 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2438} (( segid " " and resid 138 and name HA )) (( segid " " and resid 141 and name HB )) 1.800 0.000 3.200 peak 2438 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2439} (( segid " " and resid 138 and name HA )) ( segid " " and resid 25 and name HE* ) 1.800 0.000 3.200 peak 2439 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2440} (( segid " " and resid 138 and name HB )) (( segid " " and resid 138 and name HA )) 1.800 0.000 1.800 peak 2440 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2441} (( segid " " and resid 138 and name HB )) ( segid " " and resid 25 and name HD* ) 1.800 0.000 3.200 peak 2441 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2443} ( segid " " and resid 138 and name HD1*) (( segid " " and resid 29 and name HB* )) 1.800 0.000 1.800 peak 2443 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2444} ( segid " " and resid 138 and name HD1*) (( segid " " and resid 138 and name HA )) 1.800 0.000 3.200 peak 2444 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2445} ( segid " " and resid 138 and name HD1*) (( segid " " and resid 138 and name HB )) 1.800 0.000 1.800 peak 2445 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2446} ( segid " " and resid 138 and name HD1*) (( segid " " and resid 138 and name HG1*)) 1.800 0.000 0.900 peak 2446 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2447} ( segid " " and resid 138 and name HD1*) ( segid " " and resid 138 and name HG2*) 1.800 0.000 0.900 peak 2447 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2448} ( segid " " and resid 138 and name HD1*) ( segid " " and resid 141 and name HD1*) 1.800 0.000 0.900 peak 2448 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2449} ( segid " " and resid 138 and name HD1*) ( segid " " and resid 142 and name HD1*) 1.800 0.000 0.900 peak 2449 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2450} ( segid " " and resid 138 and name HD1*) ( segid " " and resid 25 and name HE* ) 1.800 0.000 3.200 peak 2450 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2451} (( segid " " and resid 138 and name HG1*)) (( segid " " and resid 138 and name HA )) 1.800 0.000 1.800 peak 2451 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2452} (( segid " " and resid 138 and name HG1*)) (( segid " " and resid 138 and name HB )) 1.800 0.000 0.900 peak 2452 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2453} ( segid " " and resid 138 and name HG2*) (( segid " " and resid 139 and name HA )) 1.800 0.000 3.200 peak 2453 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2454} ( segid " " and resid 138 and name HG2*) (( segid " " and resid 139 and name HN )) 1.800 0.000 1.800 peak 2454 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2455} ( segid " " and resid 138 and name HG2*) (( segid " " and resid 138 and name HA )) 1.800 0.000 1.800 peak 2455 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2456} ( segid " " and resid 138 and name HG2*) (( segid " " and resid 138 and name HB )) 1.800 0.000 0.900 peak 2456 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2457} ( segid " " and resid 138 and name HG2*) (( segid " " and resid 138 and name HG1*)) 1.800 0.000 3.200 peak 2457 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2458} ( segid " " and resid 138 and name HG2*) (( segid " " and resid 138 and name HN )) 1.800 0.000 1.800 peak 2458 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2459} (( segid " " and resid 138 and name HN )) (( segid " " and resid 137 and name HA )) 1.800 0.000 1.800 peak 2459 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2460} (( segid " " and resid 138 and name HN )) (( segid " " and resid 138 and name HA )) 1.800 0.000 1.800 peak 2460 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2461} (( segid " " and resid 138 and name HN )) (( segid " " and resid 138 and name HB )) 1.800 0.000 0.900 peak 2461 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2463} (( segid " " and resid 139 and name HB* )) (( segid " " and resid 139 and name HA )) 1.800 0.000 1.800 peak 2463 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2464} (( segid " " and resid 139 and name HB* )) (( segid " " and resid 140 and name HA )) 1.800 0.000 3.200 peak 2464 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2465} (( segid " " and resid 139 and name HB* )) (( segid " " and resid 140 and name HN )) 1.800 0.000 1.800 peak 2465 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2466} (( segid " " and resid 139 and name HN )) (( segid " " and resid 139 and name HA )) 1.800 0.000 1.800 peak 2466 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2467} (( segid " " and resid 139 and name HN )) (( segid " " and resid 139 and name HB* )) 1.800 0.000 0.900 peak 2467 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2468} (( segid " " and resid 139 and name HN )) (( segid " " and resid 138 and name HN )) 1.800 0.000 1.800 peak 2468 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2469} (( segid " " and resid 139 and name HN )) (( segid " " and resid 142 and name HN )) 1.800 0.000 3.200 peak 2469 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2470} (( segid " " and resid 139 and name HN )) (( segid " " and resid 140 and name HN )) 1.800 0.000 0.900 peak 2470 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2471} (( segid " " and resid 140 and name HA )) (( segid " " and resid 143 and name HB* )) 1.800 0.000 3.200 peak 2471 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2472} (( segid " " and resid 140 and name HB* )) (( segid " " and resid 141 and name HA )) 1.800 0.000 3.200 peak 2472 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2473} (( segid " " and resid 140 and name HB* )) (( segid " " and resid 141 and name HN )) 1.800 0.000 3.200 peak 2473 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2475} (( segid " " and resid 140 and name HN )) (( segid " " and resid 138 and name HA )) 1.800 0.000 3.200 peak 2475 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2476} (( segid " " and resid 140 and name HN )) (( segid " " and resid 141 and name HB )) 1.800 0.000 3.200 peak 2476 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2478} (( segid " " and resid 140 and name HN )) (( segid " " and resid 140 and name HB* )) 1.800 0.000 1.800 peak 2478 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2479} (( segid " " and resid 140 and name HN )) (( segid " " and resid 122 and name HB* )) 1.800 0.000 3.200 peak 2479 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2480} (( segid " " and resid 141 and name HA )) (( segid " " and resid 141 and name HN )) 1.800 0.000 1.800 peak 2480 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2481} (( segid " " and resid 141 and name HA )) ( segid " " and resid 142 and name HG2*) 1.800 0.000 3.200 peak 2481 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2482} (( segid " " and resid 141 and name HB )) (( segid " " and resid 141 and name HA )) 1.800 0.000 1.800 peak 2482 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2483} (( segid " " and resid 141 and name HB )) (( segid " " and resid 142 and name HN )) 1.800 0.000 3.200 peak 2483 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2484} ( segid " " and resid 141 and name HD1*) (( segid " " and resid 138 and name HA )) 1.800 0.000 1.800 peak 2484 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2485} ( segid " " and resid 141 and name HD1*) (( segid " " and resid 141 and name HA )) 1.800 0.000 1.800 peak 2485 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2486} ( segid " " and resid 141 and name HD1*) (( segid " " and resid 141 and name HN )) 1.800 0.000 1.800 peak 2486 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2487} ( segid " " and resid 141 and name HD1*) (( segid " " and resid 142 and name HA )) 1.800 0.000 1.800 peak 2487 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2488} ( segid " " and resid 141 and name HD1*) (( segid " " and resid 142 and name HN )) 1.800 0.000 1.800 peak 2488 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2489} (( segid " " and resid 141 and name HG1*)) (( segid " " and resid 141 and name HN )) 1.800 0.000 3.200 peak 2489 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2490} ( segid " " and resid 141 and name HG2*) (( segid " " and resid 142 and name HN )) 1.800 0.000 1.800 peak 2490 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2491} (( segid " " and resid 141 and name HN )) (( segid " " and resid 139 and name HN )) 1.800 0.000 3.200 peak 2491 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2492} (( segid " " and resid 141 and name HN )) (( segid " " and resid 138 and name HA )) 1.800 0.000 3.200 peak 2492 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2493} (( segid " " and resid 141 and name HN )) (( segid " " and resid 141 and name HB )) 1.800 0.000 1.800 peak 2493 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2494} (( segid " " and resid 141 and name HN )) ( segid " " and resid 141 and name HG2*) 1.800 0.000 1.800 peak 2494 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2495} (( segid " " and resid 141 and name HN )) ( segid " " and resid 142 and name HG2*) 1.800 0.000 1.800 peak 2495 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2496} (( segid " " and resid 141 and name HN )) (( segid " " and resid 142 and name HN )) 1.800 0.000 1.800 peak 2496 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2497} (( segid " " and resid 141 and name HN )) (( segid " " and resid 140 and name HA )) 1.800 0.000 3.200 peak 2497 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2499} (( segid " " and resid 142 and name HA )) (( segid " " and resid 142 and name HN )) 1.800 0.000 3.200 peak 2499 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2500} ( segid " " and resid 142 and name HD1*) (( segid " " and resid 142 and name HA )) 1.800 0.000 1.800 peak 2500 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2501} ( segid " " and resid 142 and name HD1*) (( segid " " and resid 142 and name HB )) 1.800 0.000 0.900 peak 2501 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2502} ( segid " " and resid 142 and name HD1*) (( segid " " and resid 142 and name HG1*)) 1.800 0.000 0.900 peak 2502 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2504} ( segid " " and resid 142 and name HD1*) (( segid " " and resid 142 and name HG1*)) 1.800 0.000 3.200 peak 2504 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2505} ( segid " " and resid 142 and name HD1*) ( segid " " and resid 142 and name HG2*) 1.800 0.000 3.200 peak 2505 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2506} ( segid " " and resid 142 and name HD1*) (( segid " " and resid 86 and name HG1 )) 1.800 0.000 3.200 peak 2506 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2507} ( segid " " and resid 142 and name HD1*) ( segid " " and resid 91 and name HG2*) 1.800 0.000 1.800 peak 2507 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2510} (( segid " " and resid 142 and name HG1*)) (( segid " " and resid 142 and name HB )) 1.800 0.000 1.800 peak 2510 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2511} ( segid " " and resid 142 and name HG2*) (( segid " " and resid 143 and name HN )) 1.800 0.000 1.800 peak 2511 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2512} ( segid " " and resid 142 and name HG2*) (( segid " " and resid 142 and name HA )) 1.800 0.000 1.800 peak 2512 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2513} ( segid " " and resid 142 and name HG2*) (( segid " " and resid 142 and name HB )) 1.800 0.000 0.900 peak 2513 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2514} ( segid " " and resid 142 and name HG2*) (( segid " " and resid 142 and name HG1*)) 1.800 0.000 0.900 peak 2514 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2516} ( segid " " and resid 142 and name HG2*) (( segid " " and resid 142 and name HG1*)) 1.800 0.000 3.200 peak 2516 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2517} (( segid " " and resid 142 and name HN )) (( segid " " and resid 143 and name HN )) 1.800 0.000 3.200 peak 2517 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2518} (( segid " " and resid 142 and name HN )) (( segid " " and resid 144 and name HN )) 1.800 0.000 3.200 peak 2518 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2519} (( segid " " and resid 142 and name HN )) (( segid " " and resid 141 and name HA )) 1.800 0.000 3.200 peak 2519 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2520} (( segid " " and resid 142 and name HN )) (( segid " " and resid 142 and name HB )) 1.800 0.000 1.800 peak 2520 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2521} (( segid " " and resid 142 and name HN )) ( segid " " and resid 142 and name HD1*) 1.800 0.000 3.200 peak 2521 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2522} (( segid " " and resid 142 and name HN )) (( segid " " and resid 142 and name HG1*)) 1.800 0.000 3.200 peak 2522 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2523} (( segid " " and resid 142 and name HN )) ( segid " " and resid 142 and name HG2*) 1.800 0.000 1.800 peak 2523 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2524} (( segid " " and resid 142 and name HN )) (( segid " " and resid 140 and name HN )) 1.800 0.000 3.200 peak 2524 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2525} (( segid " " and resid 143 and name HA )) (( segid " " and resid 144 and name HA )) 1.800 0.000 3.200 peak 2525 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2526} (( segid " " and resid 143 and name HA )) (( segid " " and resid 144 and name HG* )) 1.800 0.000 3.200 peak 2526 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2528} (( segid " " and resid 143 and name HB* )) (( segid " " and resid 143 and name HA )) 1.800 0.000 0.900 peak 2528 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2529} (( segid " " and resid 143 and name HG* )) (( segid " " and resid 143 and name HA )) 1.800 0.000 0.900 peak 2529 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2530} (( segid " " and resid 143 and name HG* )) (( segid " " and resid 143 and name HB* )) 1.800 0.000 0.900 peak 2530 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2531} (( segid " " and resid 143 and name HN )) (( segid " " and resid 143 and name HA )) 1.800 0.000 0.900 peak 2531 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2532} (( segid " " and resid 143 and name HN )) (( segid " " and resid 143 and name HB* )) 1.800 0.000 0.900 peak 2532 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2533} (( segid " " and resid 143 and name HN )) (( segid " " and resid 143 and name HG* )) 1.800 0.000 3.200 peak 2533 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2534} (( segid " " and resid 143 and name HN )) (( segid " " and resid 144 and name HB* )) 1.800 0.000 3.200 peak 2534 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2535} (( segid " " and resid 143 and name HN )) (( segid " " and resid 144 and name HG* )) 1.800 0.000 3.200 peak 2535 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2536} (( segid " " and resid 143 and name HN )) (( segid " " and resid 144 and name HN )) 1.800 0.000 1.800 peak 2536 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2537} (( segid " " and resid 143 and name HN )) (( segid " " and resid 145 and name HN )) 1.800 0.000 3.200 peak 2537 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2538} (( segid " " and resid 144 and name HA )) (( segid " " and resid 145 and name HN )) 1.800 0.000 1.800 peak 2538 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2539} (( segid " " and resid 144 and name HA )) (( segid " " and resid 146 and name HN )) 1.800 0.000 3.200 peak 2539 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2540} (( segid " " and resid 144 and name HB* )) (( segid " " and resid 144 and name HA )) 1.800 0.000 3.200 peak 2540 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2541} (( segid " " and resid 144 and name HB* )) (( segid " " and resid 144 and name HN )) 1.800 0.000 3.200 peak 2541 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2542} (( segid " " and resid 144 and name HG* )) (( segid " " and resid 144 and name HA )) 1.800 0.000 0.900 peak 2542 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2545} (( segid " " and resid 144 and name HG* )) (( segid " " and resid 144 and name HA )) 1.800 0.000 3.200 peak 2545 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2546} (( segid " " and resid 144 and name HG* )) (( segid " " and resid 144 and name HN )) 1.800 0.000 3.200 peak 2546 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2547} (( segid " " and resid 144 and name HN )) (( segid " " and resid 143 and name HA )) 1.800 0.000 3.200 peak 2547 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2548} (( segid " " and resid 144 and name HN )) (( segid " " and resid 143 and name HB* )) 1.800 0.000 0.900 peak 2548 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2549} (( segid " " and resid 144 and name HN )) (( segid " " and resid 144 and name HA )) 1.800 0.000 1.800 peak 2549 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2550} (( segid " " and resid 144 and name HN )) (( segid " " and resid 144 and name HG* )) 1.800 0.000 0.900 peak 2550 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2551} (( segid " " and resid 145 and name HA )) (( segid " " and resid 145 and name HG1*)) 1.800 0.000 1.800 peak 2551 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2553} (( segid " " and resid 145 and name HB )) (( segid " " and resid 145 and name HA )) 1.800 0.000 1.800 peak 2553 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2554} ( segid " " and resid 145 and name HD1*) (( segid " " and resid 145 and name HA )) 1.800 0.000 1.800 peak 2554 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2555} ( segid " " and resid 145 and name HD1*) (( segid " " and resid 145 and name HB )) 1.800 0.000 0.900 peak 2555 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2557} (( segid " " and resid 145 and name HG1*)) (( segid " " and resid 145 and name HA )) 1.800 0.000 3.200 peak 2557 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2558} ( segid " " and resid 145 and name HG2*) (( segid " " and resid 145 and name HA )) 1.800 0.000 0.900 peak 2558 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2559} ( segid " " and resid 145 and name HG2*) (( segid " " and resid 145 and name HB )) 1.800 0.000 0.900 peak 2559 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2560} ( segid " " and resid 145 and name HG2*) (( segid " " and resid 145 and name HN )) 1.800 0.000 1.800 peak 2560 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2561} (( segid " " and resid 145 and name HN )) (( segid " " and resid 144 and name HN )) 1.800 0.000 0.900 peak 2561 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2562} (( segid " " and resid 145 and name HN )) (( segid " " and resid 142 and name HA )) 1.800 0.000 3.200 peak 2562 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2563} (( segid " " and resid 145 and name HN )) (( segid " " and resid 145 and name HB )) 1.800 0.000 0.900 peak 2563 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2564} (( segid " " and resid 145 and name HN )) (( segid " " and resid 145 and name HG1*)) 1.800 0.000 3.200 peak 2564 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2565} (( segid " " and resid 146 and name HA )) (( segid " " and resid 146 and name HB )) 1.800 0.000 3.200 peak 2565 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2566} ( segid " " and resid 146 and name HG2*) (( segid " " and resid 146 and name HA )) 1.800 0.000 0.900 peak 2566 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2567} (( segid " " and resid 146 and name HN )) (( segid " " and resid 145 and name HA )) 1.800 0.000 3.200 peak 2567 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2568} (( segid " " and resid 146 and name HN )) (( segid " " and resid 146 and name HA )) 1.800 0.000 1.800 peak 2568 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2569} (( segid " " and resid 146 and name HN )) ( segid " " and resid 146 and name HG2*) 1.800 0.000 3.200 peak 2569 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2570} (( segid " " and resid 147 and name HA )) (( segid " " and resid 148 and name HN )) 1.800 0.000 1.800 peak 2570 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2571} (( segid " " and resid 147 and name HB )) (( segid " " and resid 147 and name HA )) 1.800 0.000 1.800 peak 2571 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2572} ( segid " " and resid 147 and name HG2*) (( segid " " and resid 147 and name HA )) 1.800 0.000 3.200 peak 2572 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 2572} ( segid " " and resid 147 and name HG1*) (( segid " " and resid 147 and name HA )) ASSI { 2573} (( segid " " and resid 147 and name HN )) (( segid " " and resid 146 and name HA )) 1.800 0.000 1.800 peak 2573 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2574} (( segid " " and resid 147 and name HN )) (( segid " " and resid 147 and name HA )) 1.800 0.000 1.800 peak 2574 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2575} (( segid " " and resid 147 and name HN )) (( segid " " and resid 147 and name HB )) 1.800 0.000 0.900 peak 2575 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2576} (( segid " " and resid 147 and name HN )) ( segid " " and resid 147 and name HG1*) 1.800 0.000 0.900 peak 2576 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 2576} (( segid " " and resid 147 and name HN )) ( segid " " and resid 147 and name HG2*) ASSI { 2577} (( segid " " and resid 148 and name HN )) (( segid " " and resid 147 and name HN )) 1.800 0.000 3.200 peak 2577 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2578} (( segid " " and resid 149 and name HA )) (( segid " " and resid 149 and name HN )) 1.800 0.000 3.200 peak 2578 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2579} (( segid " " and resid 149 and name HA )) (( segid " " and resid 150 and name HN )) 1.800 0.000 0.900 peak 2579 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2580} (( segid " " and resid 149 and name HB* )) (( segid " " and resid 149 and name HA )) 1.800 0.000 1.800 peak 2580 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2581} (( segid " " and resid 149 and name HB* )) (( segid " " and resid 149 and name HN )) 1.800 0.000 3.200 peak 2581 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2582} (( segid " " and resid 150 and name HA* )) (( segid " " and resid 150 and name HN )) 1.800 0.000 0.900 peak 2582 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2583} (( segid " " and resid 150 and name HA* )) (( segid " " and resid 151 and name HN )) 1.800 0.000 0.900 peak 2583 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2584} (( segid " " and resid 150 and name HN )) (( segid " " and resid 151 and name HA )) 1.800 0.000 3.200 peak 2584 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2585} (( segid " " and resid 150 and name HN )) (( segid " " and resid 151 and name HB )) 1.800 0.000 3.200 peak 2585 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2586} (( segid " " and resid 151 and name HA )) (( segid " " and resid 151 and name HN )) 1.800 0.000 3.200 peak 2586 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2587} (( segid " " and resid 151 and name HB )) (( segid " " and resid 151 and name HN )) 1.800 0.000 1.800 peak 2587 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 2588} ( segid " " and resid 151 and name HG1*) (( segid " " and resid 151 and name HN )) 1.800 0.000 1.800 peak 2588 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 OR { 2588} ( segid " " and resid 151 and name HG2*) (( segid " " and resid 151 and name HN )) ASSI { 2589} (( segid " " and resid 151 and name HN )) (( segid " " and resid 150 and name HN )) 1.800 0.000 1.800 peak 2589 weight 0.10000E+01 volume 0.00000E+00 ppm1 -999.000 ppm2 -999.000 CV 1 ASSI { 1} ( segid " " and resid 138 and name HD1*) ( segid " " and resid 30 and name HD1*) 3.300 1.400 1.400 peak 1 weight 0.10000E+01 volume 0.91295E-03 ppm1 0.680 ppm2 0.081 CV 1 ASSI { 2} ( segid " " and resid 82 and name HG2*) ( segid " " and resid 30 and name HD1*) 2.000 0.500 0.500 peak 2 weight 0.10000E+01 volume 0.38900E-01 ppm1 0.687 ppm2 0.835 CV 1 ASSI { 6} (( segid " " and resid 30 and name HG1*)) ( segid " " and resid 30 and name HD1*) 2.500 0.800 0.800 peak 6 weight 0.10000E+01 volume 0.98395E-02 ppm1 0.683 ppm2 1.828 CV 1 ASSI { 30} (( segid " " and resid 138 and name HB )) ( segid " " and resid 142 and name HD1*) 4.100 2.100 1.900 peak 30 weight 0.10000E+01 volume 0.47018E-02 ppm1 0.736 ppm2 1.621 CV 1 ASSI { 32} ( segid " " and resid 145 and name HD1*) ( segid " " and resid 142 and name HD1*) 1.900 0.400 0.400 peak 32 weight 0.10000E+01 volume 0.63907E-01 ppm1 0.736 ppm2 0.860 CV 1 OR { 32} ( segid " " and resid 145 and name HG2*) ( segid " " and resid 142 and name HD1*) ASSI { 44} (( segid " " and resid 141 and name HB )) ( segid " " and resid 138 and name HD1*) 4.500 2.500 1.500 peak 44 weight 0.10000E+01 volume 0.20541E-02 ppm1 0.076 ppm2 2.005 CV 1 ASSI { 46} (( segid " " and resid 30 and name HG1*)) ( segid " " and resid 138 and name HD1*) 3.500 1.500 1.500 peak 46 weight 0.10000E+01 volume 0.25866E-02 ppm1 0.069 ppm2 1.809 CV 1 ASSI { 47} (( segid " " and resid 142 and name HG1*)) ( segid " " and resid 138 and name HD1*) 3.500 1.600 1.600 peak 47 weight 0.10000E+01 volume 0.73035E-02 ppm1 0.075 ppm2 1.177 CV 1 ASSI { 48} (( segid " " and resid 138 and name HG1*)) ( segid " " and resid 138 and name HD1*) 2.400 0.700 0.700 peak 48 weight 0.10000E+01 volume 0.19020E-01 ppm1 0.077 ppm2 0.888 CV 1 OR { 48} ( segid " " and resid 138 and name HG2*) ( segid " " and resid 138 and name HD1*) ASSI { 50} ( segid " " and resid 91 and name HG2*) ( segid " " and resid 138 and name HD1*) 3.600 1.600 1.600 peak 50 weight 0.10000E+01 volume 0.21860E-02 ppm1 0.071 ppm2 0.360 CV 1 ASSI { 52} ( segid " " and resid 25 and name HE* ) ( segid " " and resid 82 and name HD1*) 4.100 2.100 1.900 peak 52 weight 0.10000E+01 volume 0.87236E-03 ppm1 0.060 ppm2 6.579 CV 1 ASSI { 53} (( segid " " and resid 33 and name HA )) ( segid " " and resid 82 and name HD1*) 5.400 3.700 0.600 peak 53 weight 0.10000E+01 volume 0.77094E-03 ppm1 0.060 ppm2 4.801 CV 1 ASSI { 55} (( segid " " and resid 95 and name HB )) ( segid " " and resid 82 and name HD1*) 5.400 3.600 0.600 peak 55 weight 0.10000E+01 volume 0.42706E-03 ppm1 0.057 ppm2 2.224 CV 1 ASSI { 58} (( segid " " and resid 82 and name HG1*)) ( segid " " and resid 82 and name HD1*) 2.900 1.000 1.000 peak 58 weight 0.10000E+01 volume 0.42451E-02 ppm1 0.060 ppm2 1.458 CV 1 ASSI { 63} (( segid " " and resid 93 and name HB* )) ( segid " " and resid 82 and name HD1*) 5.900 4.400 0.100 peak 63 weight 0.10000E+01 volume 0.27540E-03 ppm1 0.062 ppm2 2.812 CV 1 ASSI { 76} ( segid " " and resid 118 and name HD* ) ( segid " " and resid 134 and name HD1*) 3.900 1.900 1.900 peak 76 weight 0.10000E+01 volume 0.15926E-02 ppm1 0.633 ppm2 7.208 CV 1 ASSI { 79} (( segid " " and resid 21 and name HG* )) ( segid " " and resid 134 and name HD1*) 4.800 2.800 1.200 peak 79 weight 0.10000E+01 volume 0.74558E-03 ppm1 0.631 ppm2 2.247 CV 1 ASSI { 82} (( segid " " and resid 71 and name HG1*)) ( segid " " and resid 134 and name HD1*) 3.900 1.900 1.900 peak 82 weight 0.10000E+01 volume 0.43416E-02 ppm1 0.628 ppm2 1.677 CV 1 ASSI { 84} ( segid " " and resid 18 and name HG2*) ( segid " " and resid 134 and name HD1*) 3.300 1.300 1.300 peak 84 weight 0.10000E+01 volume 0.86728E-02 ppm1 0.628 ppm2 1.018 CV 1 ASSI { 93} (( segid " " and resid 102 and name HB* )) ( segid " " and resid 104 and name HD1*) 4.100 2.100 1.900 peak 93 weight 0.10000E+01 volume 0.52748E-02 ppm1 0.307 ppm2 1.419 CV 1 ASSI { 109} (( segid " " and resid 136 and name HG )) ( segid " " and resid 141 and name HD1*) 3.600 1.600 1.600 peak 109 weight 0.10000E+01 volume 0.48031E-02 ppm1 0.904 ppm2 1.249 CV 1 ASSI { 119} (( segid " " and resid 73 and name HB* )) ( segid " " and resid 71 and name HD1*) 4.300 2.300 1.700 peak 119 weight 0.10000E+01 volume 0.40270E-03 ppm1 0.870 ppm2 2.984 CV 1 ASSI { 120} (( segid " " and resid 21 and name HG* )) ( segid " " and resid 71 and name HD1*) 3.200 1.300 1.300 peak 120 weight 0.10000E+01 volume 0.40523E-02 ppm1 0.874 ppm2 2.244 CV 1 ASSI { 122} (( segid " " and resid 18 and name HB )) ( segid " " and resid 71 and name HD1*) 3.600 1.600 1.600 peak 122 weight 0.10000E+01 volume 0.36568E-02 ppm1 0.872 ppm2 1.632 CV 1 ASSI { 131} (( segid " " and resid 142 and name HA )) ( segid " " and resid 145 and name HD1*) 3.000 1.100 1.100 peak 131 weight 0.10000E+01 volume 0.17092E-02 ppm1 0.857 ppm2 3.706 CV 1 ASSI { 133} (( segid " " and resid 141 and name HB )) ( segid " " and resid 145 and name HD1*) 4.500 2.500 1.500 peak 133 weight 0.10000E+01 volume 0.18665E-02 ppm1 0.855 ppm2 2.001 CV 1 ASSI { 135} (( segid " " and resid 145 and name HG1*)) ( segid " " and resid 145 and name HD1*) 2.800 0.900 0.900 peak 135 weight 0.10000E+01 volume 0.45647E-02 ppm1 0.857 ppm2 1.279 CV 1 ASSI { 143} (( segid " " and resid 121 and name HE* )) ( segid " " and resid 68 and name HD1*) 4.300 2.300 1.700 peak 143 weight 0.10000E+01 volume 0.86728E-03 ppm1 0.528 ppm2 3.051 CV 1 ASSI { 144} (( segid " " and resid 144 and name HB* )) ( segid " " and resid 68 and name HD1*) 3.700 1.700 1.700 peak 144 weight 0.10000E+01 volume 0.11107E-02 ppm1 0.542 ppm2 2.162 CV 1 ASSI { 151} (( segid " " and resid 68 and name HG1*)) ( segid " " and resid 68 and name HD1*) 2.500 0.800 0.800 peak 151 weight 0.10000E+01 volume 0.11868E-01 ppm1 0.540 ppm2 0.293 CV 1 ASSI { 154} (( segid " " and resid 86 and name HB )) ( segid " " and resid 138 and name HG2*) 3.900 2.000 2.000 peak 154 weight 0.10000E+01 volume 0.16940E-02 ppm1 0.887 ppm2 4.313 CV 1 ASSI { 157} (( segid " " and resid 29 and name HB* )) ( segid " " and resid 138 and name HG2*) 3.500 1.600 1.600 peak 157 weight 0.10000E+01 volume 0.13136E-02 ppm1 0.881 ppm2 2.373 CV 1 ASSI { 163} (( segid " " and resid 32 and name HA )) ( segid " " and resid 82 and name HG2*) 3.100 1.200 1.200 peak 163 weight 0.10000E+01 volume 0.59848E-02 ppm1 0.804 ppm2 4.691 CV 1 ASSI { 167} (( segid " " and resid 141 and name HA )) ( segid " " and resid 141 and name HG2*) 4.400 2.400 1.600 peak 167 weight 0.10000E+01 volume 0.10752E-02 ppm1 0.887 ppm2 3.586 CV 1 ASSI { 172} (( segid " " and resid 14 and name HG )) ( segid " " and resid 82 and name HG2*) 3.100 1.200 1.200 peak 172 weight 0.10000E+01 volume 0.41741E-02 ppm1 0.806 ppm2 1.426 CV 1 ASSI { 177} (( segid " " and resid 127 and name HA )) ( segid " " and resid 133 and name HG2*) 4.400 2.500 1.600 peak 177 weight 0.10000E+01 volume 0.14455E-02 ppm1 0.291 ppm2 4.961 CV 1 ASSI { 179} (( segid " " and resid 128 and name HB )) ( segid " " and resid 133 and name HG2*) 4.300 2.300 1.700 peak 179 weight 0.10000E+01 volume 0.16940E-02 ppm1 0.297 ppm2 4.046 CV 1 ASSI { 182} (( segid " " and resid 131 and name HG* )) ( segid " " and resid 133 and name HG2*) 4.000 2.000 2.000 peak 182 weight 0.10000E+01 volume 0.39917E-02 ppm1 0.296 ppm2 1.547 CV 1 ASSI { 208} (( segid " " and resid 90 and name HB* )) ( segid " " and resid 84 and name HB* ) 4.800 2.900 1.200 peak 208 weight 0.10000E+01 volume 0.83686E-03 ppm1 1.182 ppm2 1.998 CV 1 ASSI { 223} (( segid " " and resid 49 and name HA )) ( segid " " and resid 63 and name HG1*) 3.200 1.300 1.300 peak 223 weight 0.10000E+01 volume 0.23483E-02 ppm1 0.753 ppm2 4.185 CV 1 ASSI { 230} ( segid " " and resid 142 and name HG2*) ( segid " " and resid 138 and name HG2*) 2.900 1.000 1.000 peak 230 weight 0.10000E+01 volume 0.11970E-01 ppm1 0.891 ppm2 0.835 CV 1 ASSI { 267} (( segid " " and resid 16 and name HA )) ( segid " " and resid 95 and name HG1*) 4.900 3.100 1.100 peak 267 weight 0.10000E+01 volume 0.13390E-02 ppm1 0.455 ppm2 5.119 CV 1 ASSI { 272} ( segid " " and resid 24 and name HB* ) ( segid " " and resid 13 and name HG1*) 2.500 0.800 0.800 peak 272 weight 0.10000E+01 volume 0.14201E-01 ppm1 0.460 ppm2 0.873 CV 1 ASSI { 278} (( segid " " and resid 131 and name HB* )) ( segid " " and resid 133 and name HD1*) 3.400 1.400 1.400 peak 278 weight 0.10000E+01 volume 0.43619E-02 ppm1 0.507 ppm2 1.687 CV 1 ASSI { 281} (( segid " " and resid 128 and name HB )) ( segid " " and resid 133 and name HD1*) 3.800 1.800 1.800 peak 281 weight 0.10000E+01 volume 0.11767E-02 ppm1 0.502 ppm2 4.036 CV 1 ASSI { 283} ( segid " " and resid 13 and name HG2*) ( segid " " and resid 104 and name HG2*) 2.900 1.100 1.100 peak 283 weight 0.10000E+01 volume 0.13948E-01 ppm1 0.624 ppm2 0.516 CV 1 ASSI { 284} ( segid " " and resid 24 and name HB* ) ( segid " " and resid 104 and name HG2*) 2.800 1.000 1.000 peak 284 weight 0.10000E+01 volume 0.17346E-01 ppm1 0.628 ppm2 0.890 CV 1 ASSI { 285} (( segid " " and resid 102 and name HB* )) ( segid " " and resid 104 and name HG2*) 4.100 2.100 1.900 peak 285 weight 0.10000E+01 volume 0.66441E-02 ppm1 0.624 ppm2 1.416 CV 1 ASSI { 291} (( segid " " and resid 82 and name HN )) ( segid " " and resid 95 and name HG2*) 5.000 3.100 1.000 peak 291 weight 0.10000E+01 volume 0.44987E-03 ppm1 0.572 ppm2 8.921 CV 1 ASSI { 298} (( segid " " and resid 73 and name HA )) ( segid " " and resid 18 and name HD1*) 4.800 2.900 1.200 peak 298 weight 0.10000E+01 volume 0.11361E-02 ppm1 1.115 ppm2 4.887 CV 1 ASSI { 306} (( segid " " and resid 95 and name HB )) ( segid " " and resid 18 and name HD1*) 3.600 1.600 1.600 peak 306 weight 0.10000E+01 volume 0.19932E-02 ppm1 1.121 ppm2 2.234 CV 1 ASSI { 308} (( segid " " and resid 17 and name HB* )) ( segid " " and resid 18 and name HD1*) 3.900 1.900 1.900 peak 308 weight 0.10000E+01 volume 0.24345E-02 ppm1 1.114 ppm2 1.841 CV 1 ASSI { 312} ( segid " " and resid 23 and name HD1*) ( segid " " and resid 18 and name HD1*) 3.400 1.400 1.400 peak 312 weight 0.10000E+01 volume 0.31142E-02 ppm1 1.116 ppm2 0.610 CV 1 ASSI { 333} (( segid " " and resid 58 and name HA )) ( segid " " and resid 60 and name HG2*) 4.400 2.500 1.600 peak 333 weight 0.10000E+01 volume 0.71007E-03 ppm1 0.712 ppm2 4.583 CV 1 ASSI { 334} (( segid " " and resid 89 and name HA )) ( segid " " and resid 60 and name HG2*) 4.500 2.500 1.500 peak 334 weight 0.10000E+01 volume 0.14049E-02 ppm1 0.704 ppm2 4.358 CV 1 ASSI { 339} (( segid " " and resid 68 and name HG1*)) ( segid " " and resid 68 and name HG2*) 3.200 1.200 1.200 peak 339 weight 0.10000E+01 volume 0.20440E-02 ppm1 0.694 ppm2 0.302 CV 1 ASSI { 340} ( segid " " and resid 40 and name HG2*) ( segid " " and resid 39 and name HG2*) 4.100 2.100 1.900 peak 340 weight 0.10000E+01 volume 0.36364E-02 ppm1 0.660 ppm2 1.246 CV 1 ASSI { 354} (( segid " " and resid 39 and name HG1*)) ( segid " " and resid 39 and name HG2*) 2.400 0.700 0.700 peak 354 weight 0.10000E+01 volume 0.16686E-01 ppm1 0.658 ppm2 0.916 CV 1 ASSI { 392} (( segid " " and resid 87 and name HE* )) ( segid " " and resid 86 and name HG2*) 4.600 2.600 1.400 peak 392 weight 0.10000E+01 volume 0.12477E-03 ppm1 1.102 ppm2 3.007 CV 1 ASSI { 397} (( segid " " and resid 138 and name HG1*)) ( segid " " and resid 86 and name HG2*) 1.800 0.400 0.400 peak 397 weight 0.10000E+01 volume 0.55790E-01 ppm1 1.103 ppm2 0.891 CV 1 OR { 397} ( segid " " and resid 138 and name HG2*) ( segid " " and resid 86 and name HG2*) ASSI { 488} ( segid " " and resid 14 and name HD1*) ( segid " " and resid 30 and name HG2*) 2.000 0.500 0.500 peak 488 weight 0.10000E+01 volume 0.61876E-01 ppm1 0.769 ppm2 0.969 CV 1 ASSI { 493} (( segid " " and resid 59 and name HG1*)) ( segid " " and resid 59 and name HG2*) 2.800 1.000 1.000 peak 493 weight 0.10000E+01 volume 0.69991E-02 ppm1 0.751 ppm2 1.211 CV 1 ASSI { 516} (( segid " " and resid 23 and name HB* )) ( segid " " and resid 134 and name HG2*) 3.900 1.900 1.900 peak 516 weight 0.10000E+01 volume 0.39865E-02 ppm1 0.519 ppm2 1.420 CV 1 ASSI { 537} (( segid " " and resid 136 and name HN )) ( segid " " and resid 13 and name HG2*) 4.300 2.400 1.700 peak 537 weight 0.10000E+01 volume 0.17244E-03 ppm1 0.502 ppm2 8.988 CV 1 ASSI { 543} (( segid " " and resid 93 and name HB* )) ( segid " " and resid 81 and name HG2*) 4.900 2.900 1.100 peak 543 weight 0.10000E+01 volume 0.10854E-02 ppm1 0.524 ppm2 2.815 CV 1 ASSI { 545} (( segid " " and resid 34 and name HB )) ( segid " " and resid 81 and name HG2*) 3.500 1.500 1.500 peak 545 weight 0.10000E+01 volume 0.60357E-02 ppm1 0.517 ppm2 1.946 CV 1 ASSI { 546} (( segid " " and resid 81 and name HG1*)) ( segid " " and resid 81 and name HG2*) 3.000 1.100 1.100 peak 546 weight 0.10000E+01 volume 0.35910E-02 ppm1 0.529 ppm2 1.578 CV 1 ASSI { 552} (( segid " " and resid 69 and name HG )) ( segid " " and resid 18 and name HG2*) 3.800 1.800 1.800 peak 552 weight 0.10000E+01 volume 0.35554E-02 ppm1 1.017 ppm2 0.912 CV 1 ASSI { 573} (( segid " " and resid 134 and name HB )) ( segid " " and resid 65 and name HD2*) 4.200 2.200 1.800 peak 573 weight 0.10000E+01 volume 0.16534E-02 ppm1 0.668 ppm2 1.792 CV 1 ASSI { 587} (( segid " " and resid 23 and name HB* )) ( segid " " and resid 66 and name HB* ) 3.300 1.400 1.400 peak 587 weight 0.10000E+01 volume 0.13998E-01 ppm1 1.494 ppm2 1.410 CV 1 ASSI { 681} (( segid " " and resid 102 and name HB* )) ( segid " " and resid 13 and name HG1*) 3.400 1.400 1.400 peak 681 weight 0.10000E+01 volume 0.76586E-02 ppm1 0.470 ppm2 1.388 CV 1 ASSI { 684} ( segid " " and resid 138 and name HG2*) (( segid " " and resid 138 and name HB )) 3.300 1.400 1.400 peak 684 weight 0.10000E+01 volume 0.21302E-02 ppm1 1.611 ppm2 0.891 CV 1 OR { 684} (( segid " " and resid 138 and name HG1*)) (( segid " " and resid 138 and name HB )) ASSI { 688} (( segid " " and resid 97 and name HA )) ( segid " " and resid 98 and name HG1*) 4.000 2.000 2.000 peak 688 weight 0.10000E+01 volume 0.42502E-02 ppm1 0.939 ppm2 4.696 CV 1 ASSI { 689} (( segid " " and resid 97 and name HD* )) ( segid " " and resid 98 and name HG1*) 4.500 2.500 1.500 peak 689 weight 0.10000E+01 volume 0.10195E-02 ppm1 0.924 ppm2 3.154 CV 1 ASSI { 711} (( segid " " and resid 142 and name HA )) ( segid " " and resid 141 and name HG2*) 3.600 1.700 1.700 peak 711 weight 0.10000E+01 volume 0.24091E-02 ppm1 0.866 ppm2 3.711 CV 1 ASSI { 720} (( segid " " and resid 134 and name HA )) ( segid " " and resid 71 and name HG2*) 4.800 2.900 1.200 peak 720 weight 0.10000E+01 volume 0.11767E-02 ppm1 0.965 ppm2 4.098 CV 1 ASSI { 721} (( segid " " and resid 66 and name HA )) ( segid " " and resid 71 and name HG2*) 4.800 2.900 1.200 peak 721 weight 0.10000E+01 volume 0.11107E-02 ppm1 0.972 ppm2 3.824 CV 1 ASSI { 723} (( segid " " and resid 21 and name HG* )) ( segid " " and resid 71 and name HG2*) 3.100 1.200 1.200 peak 723 weight 0.10000E+01 volume 0.56804E-02 ppm1 0.970 ppm2 2.246 CV 1 ASSI { 724} (( segid " " and resid 71 and name HG1*)) ( segid " " and resid 71 and name HG2*) 3.000 1.100 1.100 peak 724 weight 0.10000E+01 volume 0.48233E-02 ppm1 0.972 ppm2 1.646 CV 1 ASSI { 737} (( segid " " and resid 86 and name HB )) ( segid " " and resid 89 and name HG2*) 3.500 1.500 1.500 peak 737 weight 0.10000E+01 volume 0.83686E-02 ppm1 0.787 ppm2 4.324 CV 1 ASSI { 739} (( segid " " and resid 142 and name HG1*)) ( segid " " and resid 89 and name HG2*) 2.800 1.000 1.000 peak 739 weight 0.10000E+01 volume 0.97381E-02 ppm1 0.786 ppm2 1.196 CV 1 ASSI { 758} (( segid " " and resid 104 and name HA )) ( segid " " and resid 13 and name HG1*) 4.100 2.100 1.900 peak 758 weight 0.10000E+01 volume 0.30280E-02 ppm1 0.464 ppm2 4.715 CV 1 ASSI { 761} (( segid " " and resid 147 and name HB )) ( segid " " and resid 147 and name HG2*) 2.200 0.600 0.600 peak 761 weight 0.10000E+01 volume 0.35606E-01 ppm1 0.992 ppm2 2.168 CV 1 OR { 761} (( segid " " and resid 147 and name HB )) ( segid " " and resid 147 and name HG1*) ASSI { 771} (( segid " " and resid 77 and name HE* )) (( segid " " and resid 77 and name HA )) 2.700 0.900 0.900 peak 771 weight 0.10000E+01 volume 0.10955E-01 ppm1 4.338 ppm2 3.033 CV 1 ASSI { 808} (( segid " " and resid 43 and name HA )) (( segid " " and resid 43 and name HB* )) 3.000 1.100 1.100 peak 808 weight 0.10000E+01 volume 0.94337E-02 ppm1 1.890 ppm2 4.389 CV 1 ASSI { 846} (( segid " " and resid 79 and name HA )) (( segid " " and resid 79 and name HD* )) 6.000 5.600 0.000 peak 846 weight 0.10000E+01 volume 0.20642E-03 ppm1 2.240 ppm2 4.667 CV 1 ASSI { 914} (( segid " " and resid 51 and name HA2 )) ( segid " " and resid 39 and name HD1*) 3.900 1.900 1.900 peak 914 weight 0.10000E+01 volume 0.17650E-02 ppm1 0.697 ppm2 4.113 CV 1 OR { 914} (( segid " " and resid 51 and name HA1 )) ( segid " " and resid 39 and name HD1*) ASSI { 917} (( segid " " and resid 34 and name HB )) ( segid " " and resid 39 and name HD1*) 3.600 1.600 1.600 peak 917 weight 0.10000E+01 volume 0.24852E-02 ppm1 0.709 ppm2 1.954 CV 1 ASSI { 919} (( segid " " and resid 53 and name HG1*)) ( segid " " and resid 39 and name HD1*) 3.100 1.200 1.200 peak 919 weight 0.10000E+01 volume 0.84194E-02 ppm1 0.700 ppm2 1.435 CV 1 ASSI { 921} (( segid " " and resid 39 and name HG1*)) ( segid " " and resid 39 and name HD1*) 2.000 0.500 0.500 peak 921 weight 0.10000E+01 volume 0.55790E-01 ppm1 0.700 ppm2 0.916 CV 1 ASSI { 1006} (( segid " " and resid 121 and name HG* )) (( segid " " and resid 68 and name HG1*)) 3.700 1.800 1.800 peak 1006 weight 0.10000E+01 volume 0.11716E-02 ppm1 0.286 ppm2 1.262 CV 1 ASSI { 1007} ( segid " " and resid 141 and name HG2*) (( segid " " and resid 68 and name HG1*)) 5.000 3.100 1.000 peak 1007 weight 0.10000E+01 volume 0.62385E-03 ppm1 0.304 ppm2 0.886 CV 1 ASSI { 1041} (( segid " " and resid 31 and name HB* )) (( segid " " and resid 31 and name HG* )) 2.600 0.900 0.900 peak 1041 weight 0.10000E+01 volume 0.22468E-01 ppm1 2.116 ppm2 1.869 CV 1 ASSI { 1090} (( segid " " and resid 81 and name HG1*)) ( segid " " and resid 81 and name HD1*) 3.400 1.500 1.500 peak 1090 weight 0.10000E+01 volume 0.19577E-02 ppm1 0.749 ppm2 1.572 CV 1 ASSI { 1091} (( segid " " and resid 81 and name HB )) ( segid " " and resid 81 and name HD1*) 3.700 1.700 1.700 peak 1091 weight 0.10000E+01 volume 0.12528E-02 ppm1 0.750 ppm2 1.715 CV 1 ASSI { 1099} (( segid " " and resid 136 and name HA )) ( segid " " and resid 136 and name HD2*) 4.000 2.000 2.000 peak 1099 weight 0.10000E+01 volume 0.10499E-02 ppm1 0.522 ppm2 4.710 CV 1 OR { 1099} (( segid " " and resid 136 and name HA )) ( segid " " and resid 136 and name HD1*) ASSI { 1104} (( segid " " and resid 14 and name HG )) ( segid " " and resid 13 and name HG2*) 4.000 2.000 2.000 peak 1104 weight 0.10000E+01 volume 0.25512E-02 ppm1 0.503 ppm2 1.438 CV 1 ASSI { 1107} (( segid " " and resid 136 and name HA )) ( segid " " and resid 134 and name HG2*) 3.400 1.500 1.500 peak 1107 weight 0.10000E+01 volume 0.22367E-02 ppm1 0.517 ppm2 4.716 CV 1 ASSI { 1159} (( segid " " and resid 33 and name HA )) ( segid " " and resid 98 and name HG1*) 3.800 1.800 1.800 peak 1159 weight 0.10000E+01 volume 0.43416E-02 ppm1 0.949 ppm2 4.792 CV 1 ASSI { 1160} (( segid " " and resid 148 and name HA )) ( segid " " and resid 147 and name HG1*) 2.500 0.800 0.800 peak 1160 weight 0.10000E+01 volume 0.15672E-01 ppm1 0.993 ppm2 4.051 CV 1 ASSI { 1161} (( segid " " and resid 23 and name HB* )) ( segid " " and resid 18 and name HG2*) 3.600 1.600 1.600 peak 1161 weight 0.10000E+01 volume 0.39409E-02 ppm1 1.009 ppm2 1.439 CV 1 ASSI { 1181} ( segid " " and resid 18 and name HG2*) ( segid " " and resid 95 and name HG2*) 4.500 2.500 1.500 peak 1181 weight 0.10000E+01 volume 0.57820E-02 ppm1 0.572 ppm2 1.001 CV 1 ASSI { 1182} (( segid " " and resid 102 and name HB* )) ( segid " " and resid 24 and name HB* ) 3.400 1.400 1.400 peak 1182 weight 0.10000E+01 volume 0.58326E-02 ppm1 0.888 ppm2 1.392 CV 1 ASSI { 1195} ( segid " " and resid 18 and name HG2*) ( segid " " and resid 18 and name HD1*) 1.700 0.400 0.500 peak 1195 weight 0.10000E+01 volume 0.61876E-01 ppm1 1.114 ppm2 1.000 CV 1 ASSI { 1215} (( segid " " and resid 65 and name HB* )) ( segid " " and resid 65 and name HD2*) 4.200 2.200 1.800 peak 1215 weight 0.10000E+01 volume 0.22113E-02 ppm1 0.665 ppm2 1.901 CV 1 ASSI { 1221} (( segid " " and resid 68 and name HB )) ( segid " " and resid 65 and name HD1*) 3.900 1.900 1.900 peak 1221 weight 0.10000E+01 volume 0.44177E-02 ppm1 0.770 ppm2 1.833 CV 1 ASSI { 1225} (( segid " " and resid 82 and name HB )) ( segid " " and resid 82 and name HG2*) 2.500 0.800 0.800 peak 1225 weight 0.10000E+01 volume 0.10651E-01 ppm1 0.808 ppm2 1.725 CV 1 ASSI { 1234} (( segid " " and resid 33 and name HB )) ( segid " " and resid 82 and name HG2*) 3.600 1.600 1.600 peak 1234 weight 0.10000E+01 volume 0.75572E-02 ppm1 0.805 ppm2 1.641 CV 1 ASSI { 1251} (( segid " " and resid 97 and name HB* )) ( segid " " and resid 95 and name HG2*) 3.700 1.800 1.800 peak 1251 weight 0.10000E+01 volume 0.27744E-02 ppm1 0.581 ppm2 2.124 CV 1 ASSI { 1268} (( segid " " and resid 30 and name HB )) (( segid " " and resid 14 and name HG )) 3.900 1.900 1.900 peak 1268 weight 0.10000E+01 volume 0.26931E-02 ppm1 1.419 ppm2 2.319 CV 1 ASSI { 1306} (( segid " " and resid 121 and name HA )) (( segid " " and resid 140 and name HB* )) 2.800 1.000 1.000 peak 1306 weight 0.10000E+01 volume 0.71513E-02 ppm1 1.730 ppm2 4.083 CV 1 ASSI { 1307} ( segid " " and resid 125 and name HD2*) (( segid " " and resid 125 and name HB* )) 4.100 2.100 1.900 peak 1307 weight 0.10000E+01 volume 0.18918E-02 ppm1 1.533 ppm2 0.889 CV 1 ASSI { 1321} (( segid " " and resid 97 and name HD* )) (( segid " " and resid 97 and name HG* )) 2.800 1.000 1.000 peak 1321 weight 0.10000E+01 volume 0.94845E-02 ppm1 1.550 ppm2 3.174 CV 1 ASSI { 1349} ( segid " " and resid 52 and name HG1*) (( segid " " and resid 61 and name HB* )) 3.100 1.200 1.200 peak 1349 weight 0.10000E+01 volume 0.14759E-01 ppm1 1.799 ppm2 0.724 CV 1 ASSI { 1359} (( segid " " and resid 44 and name HA )) (( segid " " and resid 44 and name HB* )) 2.400 0.700 0.700 peak 1359 weight 0.10000E+01 volume 0.16940E-01 ppm1 1.852 ppm2 4.227 CV 1 ASSI { 1464} (( segid " " and resid 78 and name HA )) (( segid " " and resid 96 and name HB* )) 2.600 0.900 0.900 peak 1464 weight 0.10000E+01 volume 0.12477E-01 ppm1 2.742 ppm2 4.687 CV 1 ASSI { 1571} (( segid " " and resid 125 and name HG )) ( segid " " and resid 125 and name HD2*) 2.000 0.500 0.500 peak 1571 weight 0.10000E+01 volume 0.59340E-01 ppm1 0.881 ppm2 1.640 CV 1 ASSI { 1582} (( segid " " and resid 82 and name HG1*)) ( segid " " and resid 33 and name HG1*) 2.400 0.700 0.700 peak 1582 weight 0.10000E+01 volume 0.10347E-01 ppm1 0.925 ppm2 1.460 CV 1 ASSI { 1613} ( segid " " and resid 142 and name HD1*) ( segid " " and resid 145 and name HD1*) 2.200 0.600 0.600 peak 1613 weight 0.10000E+01 volume 0.19628E-01 ppm1 0.860 ppm2 0.753 CV 1 ASSI { 1629} (( segid " " and resid 87 and name HG* )) ( segid " " and resid 89 and name HG2*) 3.500 1.500 1.500 peak 1629 weight 0.10000E+01 volume 0.47322E-02 ppm1 0.809 ppm2 1.430 CV 1 ASSI { 1633} (( segid " " and resid 18 and name HG1*)) ( segid " " and resid 18 and name HD1*) 2.800 1.000 1.000 peak 1633 weight 0.10000E+01 volume 0.35301E-02 ppm1 1.113 ppm2 0.718 CV 1 ASSI { 1639} (( segid " " and resid 4 and name HG )) (( segid " " and resid 2 and name HD* )) 3.000 1.100 1.100 peak 1639 weight 0.10000E+01 volume 0.49856E-02 ppm1 1.746 ppm2 0.754 CV 1 ASSI { 1647} (( segid " " and resid 81 and name HA )) ( segid " " and resid 95 and name HG1*) 3.500 1.500 1.500 peak 1647 weight 0.10000E+01 volume 0.45952E-02 ppm1 0.457 ppm2 4.854 CV 1 ASSI { 1657} (( segid " " and resid 145 and name HG1*)) ( segid " " and resid 68 and name HD1*) 2.700 0.900 0.900 peak 1657 weight 0.10000E+01 volume 0.12629E-01 ppm1 0.535 ppm2 1.287 CV 1 ASSI { 1678} (( segid " " and resid 93 and name HA )) ( segid " " and resid 63 and name HG1*) 3.600 1.700 1.700 peak 1678 weight 0.10000E+01 volume 0.49703E-03 ppm1 0.751 ppm2 5.244 CV 1 ASSI { 1680} (( segid " " and resid 83 and name HA )) ( segid " " and resid 83 and name HG1*) 2.700 0.900 0.900 peak 1680 weight 0.10000E+01 volume 0.93831E-02 ppm1 0.743 ppm2 4.536 CV 1 OR { 1680} (( segid " " and resid 83 and name HA )) ( segid " " and resid 83 and name HG2*) ASSI { 1713} (( segid " " and resid 144 and name HG* )) ( segid " " and resid 68 and name HD1*) 4.900 3.000 1.100 peak 1713 weight 0.10000E+01 volume 0.57312E-03 ppm1 0.536 ppm2 2.253 CV 1 ASSI { 1715} ( segid " " and resid 86 and name HG2*) ( segid " " and resid 145 and name HD1*) 4.300 2.300 1.700 peak 1715 weight 0.10000E+01 volume 0.35301E-02 ppm1 0.857 ppm2 1.118 CV 1 ASSI { 1731} (( segid " " and resid 33 and name HA )) ( segid " " and resid 33 and name HG2*) 3.400 1.500 1.500 peak 1731 weight 0.10000E+01 volume 0.48081E-02 ppm1 0.834 ppm2 4.816 CV 1 ASSI { 1754} (( segid " " and resid 82 and name HA )) ( segid " " and resid 98 and name HG1*) 4.600 2.600 1.400 peak 1754 weight 0.10000E+01 volume 0.15672E-02 ppm1 0.920 ppm2 4.325 CV 1 ASSI { 1759} (( segid " " and resid 132 and name HA )) ( segid " " and resid 125 and name HD1*) 3.900 1.900 1.900 peak 1759 weight 0.10000E+01 volume 0.13288E-02 ppm1 0.906 ppm2 4.907 CV 1 OR { 1759} (( segid " " and resid 132 and name HA )) ( segid " " and resid 125 and name HD2*) ASSI { 1760} (( segid " " and resid 26 and name HA )) ( segid " " and resid 24 and name HB* ) 4.300 2.300 1.700 peak 1760 weight 0.10000E+01 volume 0.14556E-02 ppm1 0.899 ppm2 4.951 CV 1 ASSI { 1768} (( segid " " and resid 111 and name HA )) ( segid " " and resid 8 and name HD1*) 4.400 2.400 1.600 peak 1768 weight 0.10000E+01 volume 0.16433E-03 ppm1 0.965 ppm2 4.635 CV 1 ASSI { 1769} (( segid " " and resid 117 and name HB* )) (( segid " " and resid 117 and name HG* )) 2.700 0.900 0.900 peak 1769 weight 0.10000E+01 volume 0.10550E-01 ppm1 0.965 ppm2 1.206 CV 1 ASSI { 1775} (( segid " " and resid 146 and name HA )) ( segid " " and resid 147 and name HG1*) 3.600 1.600 1.600 peak 1775 weight 0.10000E+01 volume 0.56804E-02 ppm1 0.991 ppm2 4.304 CV 1 OR { 1775} (( segid " " and resid 146 and name HA )) ( segid " " and resid 147 and name HG2*) ASSI { 1794} (( segid " " and resid 145 and name HB )) ( segid " " and resid 142 and name HD1*) 3.100 1.200 1.200 peak 1794 weight 0.10000E+01 volume 0.54270E-02 ppm1 0.732 ppm2 2.120 CV 1 ASSI { 1859} ( segid " " and resid 39 and name HG2*) ( segid " " and resid 81 and name HD1*) 3.900 1.900 1.900 peak 1859 weight 0.10000E+01 volume 0.24447E-02 ppm1 0.749 ppm2 0.647 CV 1 ASSI { 1941} ( segid " " and resid 18 and name HD1*) (( segid " " and resid 95 and name HA )) 3.400 1.500 1.500 peak 1941 weight 0.10000E+01 volume 0.29416E-02 ppm1 4.726 ppm2 1.123 CV 1 ASSI { 2030} (( segid " " and resid 85 and name HA )) (( segid " " and resid 85 and name HD* )) 4.800 2.800 1.200 peak 2030 weight 0.10000E+01 volume 0.11564E-02 ppm1 3.055 ppm2 5.454 CV 1 ASSI { 2059} (( segid " " and resid 102 and name HA )) ( segid " " and resid 24 and name HB* ) 4.400 2.400 1.600 peak 2059 weight 0.10000E+01 volume 0.24649E-02 ppm1 0.879 ppm2 4.748 CV 1 ASSI { 2107} (( segid " " and resid 142 and name HB )) ( segid " " and resid 68 and name HD1*) 4.500 2.500 1.500 peak 2107 weight 0.10000E+01 volume 0.13846E-02 ppm1 0.539 ppm2 2.078 CV 1 ASSI { 2138} (( segid " " and resid 131 and name HB* )) ( segid " " and resid 128 and name HG2*) 4.000 2.000 2.000 peak 2138 weight 0.10000E+01 volume 0.16129E-02 ppm1 0.964 ppm2 1.713 CV 1 ASSI { 2148} (( segid " " and resid 138 and name HB )) ( segid " " and resid 145 and name HD1*) 4.800 2.900 1.200 peak 2148 weight 0.10000E+01 volume 0.13136E-02 ppm1 0.853 ppm2 1.624 CV 1 ASSI { 2183} ( segid " " and resid 18 and name HD1*) ( segid " " and resid 95 and name HG2*) 5.000 3.100 1.000 peak 2183 weight 0.10000E+01 volume 0.11970E-02 ppm1 0.572 ppm2 1.114 CV 1 ASSI { 2201} ( segid " " and resid 65 and name HD1*) ( segid " " and resid 141 and name HD1*) 2.300 0.600 0.600 peak 2201 weight 0.10000E+01 volume 0.17194E-01 ppm1 0.907 ppm2 0.768 CV 1 ASSI { 2208} (( segid " " and resid 93 and name HB* )) ( segid " " and resid 95 and name HG2*) 6.000 5.200 0.000 peak 2208 weight 0.10000E+01 volume 0.20287E-03 ppm1 0.573 ppm2 2.829 CV 1 ASSI { 2220} (( segid " " and resid 132 and name HA )) (( segid " " and resid 132 and name HB* )) 4.000 2.000 2.000 peak 2220 weight 0.10000E+01 volume 0.12528E-02 ppm1 1.698 ppm2 4.912 CV 1 ASSI { 2239} (( segid " " and resid 98 and name HA )) (( segid " " and resid 98 and name HB )) 2.500 0.800 0.800 peak 2239 weight 0.10000E+01 volume 0.61371E-02 ppm1 2.178 ppm2 4.163 CV 1 ASSI { 2299} ( segid " " and resid 24 and name HB* ) (( segid " " and resid 135 and name HB* )) 5.300 3.500 0.700 peak 2299 weight 0.10000E+01 volume 0.18208E-03 ppm1 2.503 ppm2 0.888 CV 1 ASSI { 2351} ( segid " " and resid 69 and name HD2*) (( segid " " and resid 118 and name HB* )) 3.100 1.200 1.200 peak 2351 weight 0.10000E+01 volume 0.48184E-02 ppm1 2.877 ppm2 0.616 CV 1 ASSI { 2498} (( segid " " and resid 50 and name HG* )) (( segid " " and resid 50 and name HB* )) 2.500 0.800 0.800 peak 2498 weight 0.10000E+01 volume 0.16585E-01 ppm1 2.126 ppm2 1.500 CV 1 ASSI { 2544} (( segid " " and resid 131 and name HA )) (( segid " " and resid 131 and name HG* )) 3.200 1.300 1.300 peak 2544 weight 0.10000E+01 volume 0.56298E-02 ppm1 1.525 ppm2 4.566 CV 1 ASSI { 12} ( segid " " and resid 125 and name HD1*) (( segid " " and resid 125 and name HA )) 2.700 0.900 0.900 peak 12 weight 0.10000E+01 volume 0.10533E-01 ppm1 5.188 ppm2 0.885 CV 1 ASSI { 66} (( segid " " and resid 146 and name HN )) (( segid " " and resid 143 and name HA )) 3.200 1.300 1.300 peak 66 weight 0.10000E+01 volume 0.37770E-02 ppm1 4.004 ppm2 7.807 CV 1 ASSI { 67} (( segid " " and resid 143 and name HB* )) (( segid " " and resid 143 and name HA )) 2.300 0.700 0.700 peak 67 weight 0.10000E+01 volume 0.24023E-01 ppm1 3.998 ppm2 2.179 CV 1 ASSI { 93} (( segid " " and resid 93 and name HN )) (( segid " " and resid 92 and name HA* )) 3.200 1.300 1.300 peak 93 weight 0.10000E+01 volume 0.56468E-02 ppm1 2.825 ppm2 9.430 CV 1 ASSI { 94} (( segid " " and resid 92 and name HN )) (( segid " " and resid 92 and name HA* )) 2.800 0.900 0.900 peak 94 weight 0.10000E+01 volume 0.49954E-02 ppm1 2.833 ppm2 8.930 CV 1 ASSI { 95} (( segid " " and resid 92 and name HA1 )) (( segid " " and resid 92 and name HA2 )) 2.100 0.600 0.600 peak 95 weight 0.10000E+01 volume 0.97944E-02 ppm1 2.825 ppm2 5.172 CV 1 ASSI { 97} ( segid " " and resid 60 and name HD1*) (( segid " " and resid 92 and name HA* )) 2.900 1.100 1.100 peak 97 weight 0.10000E+01 volume 0.77654E-02 ppm1 2.825 ppm2 0.715 CV 1 ASSI { 99} (( segid " " and resid 93 and name HN )) (( segid " " and resid 92 and name HA* )) 2.700 0.900 0.900 peak 99 weight 0.10000E+01 volume 0.56027E-02 ppm1 5.177 ppm2 9.412 CV 1 ASSI { 157} (( segid " " and resid 10 and name HN )) (( segid " " and resid 10 and name HB* )) 2.500 0.800 0.800 peak 157 weight 0.10000E+01 volume 0.15230E-01 ppm1 1.825 ppm2 8.021 CV 1 ASSI { 158} (( segid " " and resid 10 and name HA )) (( segid " " and resid 10 and name HB* )) 2.600 0.800 0.800 peak 158 weight 0.10000E+01 volume 0.13591E-01 ppm1 1.825 ppm2 4.943 CV 1 ASSI { 173} (( segid " " and resid 65 and name HA )) (( segid " " and resid 68 and name HB )) 2.800 1.000 1.000 peak 173 weight 0.10000E+01 volume 0.51409E-02 ppm1 1.820 ppm2 4.042 CV 1 ASSI { 176} (( segid " " and resid 73 and name HB* )) (( segid " " and resid 73 and name HA )) 2.400 0.700 0.700 peak 176 weight 0.10000E+01 volume 0.74405E-02 ppm1 4.897 ppm2 2.991 CV 1 ASSI { 221} ( segid " " and resid 53 and name HG2*) (( segid " " and resid 39 and name HA )) 2.800 1.000 1.000 peak 221 weight 0.10000E+01 volume 0.15633E-01 ppm1 4.252 ppm2 0.830 CV 1 ASSI { 222} (( segid " " and resid 119 and name HN )) (( segid " " and resid 119 and name HA* )) 3.000 1.100 1.100 peak 222 weight 0.10000E+01 volume 0.83371E-02 ppm1 3.911 ppm2 8.178 CV 1 ASSI { 224} (( segid " " and resid 72 and name HB* )) (( segid " " and resid 20 and name HB* )) 3.200 1.300 1.300 peak 224 weight 0.10000E+01 volume 0.46584E-02 ppm1 2.242 ppm2 3.887 CV 1 ASSI { 249} (( segid " " and resid 31 and name HN )) (( segid " " and resid 31 and name HA )) 3.100 1.200 1.200 peak 249 weight 0.10000E+01 volume 0.40983E-02 ppm1 4.384 ppm2 9.393 CV 1 ASSI { 296} (( segid " " and resid 16 and name HA )) (( segid " " and resid 98 and name HA )) 2.100 0.500 0.500 peak 296 weight 0.10000E+01 volume 0.60117E-02 ppm1 4.181 ppm2 5.114 CV 1 ASSI { 297} (( segid " " and resid 145 and name HN )) (( segid " " and resid 145 and name HA )) 2.700 0.900 0.900 peak 297 weight 0.10000E+01 volume 0.82283E-02 ppm1 4.205 ppm2 7.730 CV 1 ASSI { 299} (( segid " " and resid 97 and name HN )) (( segid " " and resid 98 and name HA )) 3.700 1.700 1.700 peak 299 weight 0.10000E+01 volume 0.42384E-02 ppm1 4.189 ppm2 7.315 CV 1 ASSI { 301} (( segid " " and resid 99 and name HN )) (( segid " " and resid 99 and name HA )) 3.000 1.100 1.100 peak 301 weight 0.10000E+01 volume 0.45186E-02 ppm1 4.469 ppm2 8.942 CV 1 ASSI { 322} (( segid " " and resid 82 and name HN )) (( segid " " and resid 81 and name HB )) 3.200 1.300 1.300 peak 322 weight 0.10000E+01 volume 0.81462E-02 ppm1 1.727 ppm2 8.948 CV 1 ASSI { 357} ( segid " " and resid 14 and name HD1*) (( segid " " and resid 100 and name HA* )) 3.400 1.400 1.400 peak 357 weight 0.10000E+01 volume 0.68954E-02 ppm1 3.887 ppm2 0.995 CV 1 OR { 357} ( segid " " and resid 14 and name HD2*) (( segid " " and resid 100 and name HA* )) ASSI { 358} (( segid " " and resid 100 and name HA2 )) (( segid " " and resid 100 and name HA1 )) 2.000 0.500 0.500 peak 358 weight 0.10000E+01 volume 0.30592E-01 ppm1 3.885 ppm2 4.604 CV 1 ASSI { 375} (( segid " " and resid 130 and name HA1 )) (( segid " " and resid 130 and name HA2 )) 1.900 0.400 0.400 peak 375 weight 0.10000E+01 volume 0.46832E-01 ppm1 3.755 ppm2 4.044 CV 1 ASSI { 377} (( segid " " and resid 15 and name HB* )) (( segid " " and resid 15 and name HA )) 2.500 0.800 0.800 peak 377 weight 0.10000E+01 volume 0.95906E-02 ppm1 5.593 ppm2 3.713 CV 1 ASSI { 385} (( segid " " and resid 31 and name HN )) (( segid " " and resid 32 and name HN )) 2.400 0.700 0.700 peak 385 weight 0.10000E+01 volume 0.13461E-01 ppm1 7.717 ppm2 9.402 CV 1 ASSI { 458} (( segid " " and resid 40 and name HN )) (( segid " " and resid 40 and name HB )) 2.300 0.700 0.700 peak 458 weight 0.10000E+01 volume 0.11314E-01 ppm1 4.071 ppm2 8.901 CV 1 ASSI { 527} ( segid " " and resid 63 and name HG2*) (( segid " " and resid 50 and name HG* )) 3.300 1.400 1.400 peak 527 weight 0.10000E+01 volume 0.57292E-02 ppm1 1.478 ppm2 0.768 CV 1 ASSI { 533} (( segid " " and resid 68 and name HG1*)) (( segid " " and resid 68 and name HA )) 3.200 1.300 1.300 peak 533 weight 0.10000E+01 volume 0.57581E-02 ppm1 3.445 ppm2 0.293 CV 1 ASSI { 551} (( segid " " and resid 85 and name HN )) ( segid " " and resid 84 and name HB* ) 2.700 0.900 0.900 peak 551 weight 0.10000E+01 volume 0.12301E-01 ppm1 1.185 ppm2 8.760 CV 1 ASSI { 618} ( segid " " and resid 141 and name HG2*) (( segid " " and resid 141 and name HB )) 2.400 0.700 0.700 peak 618 weight 0.10000E+01 volume 0.13896E-01 ppm1 2.024 ppm2 0.899 CV 1 OR { 618} ( segid " " and resid 141 and name HD1*) (( segid " " and resid 141 and name HB )) ASSI { 652} (( segid " " and resid 105 and name HN )) (( segid " " and resid 104 and name HB )) 3.300 1.300 1.300 peak 652 weight 0.10000E+01 volume 0.65754E-02 ppm1 1.454 ppm2 8.128 CV 1 ASSI { 670} (( segid " " and resid 31 and name HN )) ( segid " " and resid 30 and name HG2*) 2.700 0.900 0.900 peak 670 weight 0.10000E+01 volume 0.69942E-02 ppm1 0.772 ppm2 9.401 CV 1 ASSI { 691} (( segid " " and resid 85 and name HA )) (( segid " " and resid 85 and name HG* )) 3.400 1.400 1.400 peak 691 weight 0.10000E+01 volume 0.59028E-02 ppm1 1.434 ppm2 5.437 CV 1 ASSI { 704} (( segid " " and resid 131 and name HD* )) ( segid " " and resid 22 and name HB* ) 3.000 1.100 1.100 peak 704 weight 0.10000E+01 volume 0.47023E-02 ppm1 1.273 ppm2 3.061 CV 1 ASSI { 740} (( segid " " and resid 100 and name HN )) ( segid " " and resid 98 and name HG1*) 2.600 0.900 0.900 peak 740 weight 0.10000E+01 volume 0.86524E-02 ppm1 1.092 ppm2 7.274 CV 1 ASSI { 741} (( segid " " and resid 98 and name HA )) ( segid " " and resid 98 and name HG1*) 2.400 0.700 0.700 peak 741 weight 0.10000E+01 volume 0.87448E-02 ppm1 1.093 ppm2 4.185 CV 1 ASSI { 743} ( segid " " and resid 82 and name HD1*) ( segid " " and resid 98 and name HG1*) 3.100 1.200 1.200 peak 743 weight 0.10000E+01 volume 0.45281E-02 ppm1 1.090 ppm2 0.069 CV 1 ASSI { 756} ( segid " " and resid 125 and name HD2*) (( segid " " and resid 124 and name HA* )) 3.500 1.500 1.500 peak 756 weight 0.10000E+01 volume 0.64183E-02 ppm1 3.902 ppm2 0.912 CV 1 OR { 756} ( segid " " and resid 125 and name HD1*) (( segid " " and resid 124 and name HA* )) ASSI { 759} (( segid " " and resid 124 and name HN )) (( segid " " and resid 124 and name HA1 )) 3.400 1.500 1.500 peak 759 weight 0.10000E+01 volume 0.39920E-02 ppm1 4.481 ppm2 7.853 CV 1 ASSI { 786} (( segid " " and resid 38 and name HN )) (( segid " " and resid 38 and name HB* )) 2.800 1.000 1.000 peak 786 weight 0.10000E+01 volume 0.91205E-02 ppm1 2.596 ppm2 8.242 CV 1 ASSI { 826} (( segid " " and resid 87 and name HN )) (( segid " " and resid 85 and name HB* )) 3.300 1.300 1.300 peak 826 weight 0.10000E+01 volume 0.46907E-02 ppm1 1.700 ppm2 8.786 CV 1 ASSI { 839} (( segid " " and resid 99 and name HN )) ( segid " " and resid 14 and name HD2*) 3.400 1.400 1.400 peak 839 weight 0.10000E+01 volume 0.95998E-02 ppm1 0.974 ppm2 8.923 CV 1 ASSI { 864} (( segid " " and resid 102 and name HB* )) (( segid " " and resid 15 and name HB* )) 3.400 1.400 1.400 peak 864 weight 0.10000E+01 volume 0.52438E-02 ppm1 3.730 ppm2 1.383 CV 1 ASSI { 875} (( segid " " and resid 74 and name HA )) (( segid " " and resid 74 and name HB* )) 3.000 1.100 1.100 peak 875 weight 0.10000E+01 volume 0.61407E-02 ppm1 2.531 ppm2 4.728 CV 1 ASSI { 886} (( segid " " and resid 110 and name HA )) (( segid " " and resid 110 and name HB* )) 3.000 1.100 1.100 peak 886 weight 0.10000E+01 volume 0.56930E-02 ppm1 2.556 ppm2 4.925 CV 1 ASSI { 932} (( segid " " and resid 33 and name HA )) (( segid " " and resid 82 and name HA )) 2.600 0.800 0.800 peak 932 weight 0.10000E+01 volume 0.57658E-02 ppm1 4.330 ppm2 4.816 CV 1 ASSI { 940} ( segid " " and resid 18 and name HD1*) (( segid " " and resid 18 and name HA )) 2.500 0.800 0.800 peak 940 weight 0.10000E+01 volume 0.99002E-02 ppm1 4.048 ppm2 1.148 CV 1 ASSI { 953} (( segid " " and resid 104 and name HA )) (( segid " " and resid 102 and name HB* )) 3.900 1.900 1.900 peak 953 weight 0.10000E+01 volume 0.72215E-02 ppm1 1.388 ppm2 4.705 CV 1 ASSI { 966} (( segid " " and resid 106 and name HN )) (( segid " " and resid 105 and name HA )) 2.400 0.700 0.700 peak 966 weight 0.10000E+01 volume 0.17997E-01 ppm1 5.117 ppm2 8.801 CV 1 ASSI { 994} ( segid " " and resid 109 and name HD1*) (( segid " " and resid 106 and name HB* )) 2.900 1.100 1.100 peak 994 weight 0.10000E+01 volume 0.54647E-02 ppm1 2.265 ppm2 0.917 CV 1 ASSI { 997} (( segid " " and resid 119 and name HN )) (( segid " " and resid 119 and name HA* )) 2.800 1.000 1.000 peak 997 weight 0.10000E+01 volume 0.83506E-02 ppm1 3.985 ppm2 8.173 CV 1 ASSI { 1000} (( segid " " and resid 128 and name HA )) (( segid " " and resid 128 and name HB )) 2.700 0.900 0.900 peak 1000 weight 0.10000E+01 volume 0.13236E-01 ppm1 4.028 ppm2 4.647 CV 1 ASSI { 1008} (( segid " " and resid 113 and name HN )) (( segid " " and resid 112 and name HA )) 2.600 0.800 0.800 peak 1008 weight 0.10000E+01 volume 0.16860E-01 ppm1 4.239 ppm2 8.394 CV 1 ASSI { 1054} ( segid " " and resid 135 and name HD* ) (( segid " " and resid 136 and name HN )) 3.100 1.200 1.200 peak 1054 weight 0.10000E+01 volume 0.43689E-02 ppm1 8.980 ppm2 6.731 CV 1 ASSI { 1058} (( segid " " and resid 136 and name HG )) (( segid " " and resid 136 and name HN )) 3.300 1.400 1.400 peak 1058 weight 0.10000E+01 volume 0.42482E-02 ppm1 8.976 ppm2 1.250 CV 1 ASSI { 1059} ( segid " " and resid 24 and name HB* ) (( segid " " and resid 136 and name HN )) 3.600 1.600 1.600 peak 1059 weight 0.10000E+01 volume 0.54564E-02 ppm1 8.984 ppm2 0.889 CV 1 ASSI { 1073} ( segid " " and resid 59 and name HG2*) (( segid " " and resid 60 and name HN )) 2.600 0.800 0.800 peak 1073 weight 0.10000E+01 volume 0.13678E-01 ppm1 8.950 ppm2 0.735 CV 1 ASSI { 1077} (( segid " " and resid 55 and name HA )) (( segid " " and resid 57 and name HN )) 3.400 1.400 1.400 peak 1077 weight 0.10000E+01 volume 0.47172E-02 ppm1 8.190 ppm2 4.629 CV 1 ASSI { 1078} (( segid " " and resid 58 and name HN )) (( segid " " and resid 57 and name HN )) 2.700 0.900 0.900 peak 1078 weight 0.10000E+01 volume 0.11258E-01 ppm1 8.190 ppm2 7.818 CV 1 ASSI { 1085} (( segid " " and resid 79 and name HG* )) (( segid " " and resid 79 and name HN )) 2.900 1.000 1.000 peak 1085 weight 0.10000E+01 volume 0.58811E-02 ppm1 7.827 ppm2 1.471 CV 1 ASSI { 1086} ( segid " " and resid 59 and name HD1*) (( segid " " and resid 59 and name HN )) 2.700 0.900 0.900 peak 1086 weight 0.10000E+01 volume 0.11223E-01 ppm1 8.331 ppm2 0.714 CV 1 ASSI { 1089} (( segid " " and resid 59 and name HA )) (( segid " " and resid 60 and name HN )) 2.100 0.600 0.600 peak 1089 weight 0.10000E+01 volume 0.23094E-01 ppm1 8.943 ppm2 4.697 CV 1 ASSI { 1092} (( segid " " and resid 10 and name HG* )) (( segid " " and resid 11 and name HN )) 3.100 1.200 1.200 peak 1092 weight 0.10000E+01 volume 0.59637E-02 ppm1 8.938 ppm2 2.068 CV 1 ASSI { 1094} (( segid " " and resid 60 and name HG1*)) (( segid " " and resid 60 and name HN )) 3.700 1.700 1.700 peak 1094 weight 0.10000E+01 volume 0.67006E-02 ppm1 8.943 ppm2 1.359 CV 1 ASSI { 1125} ( segid " " and resid 86 and name HG2*) (( segid " " and resid 87 and name HN )) 3.900 1.900 1.900 peak 1125 weight 0.10000E+01 volume 0.44703E-02 ppm1 8.794 ppm2 1.133 CV 1 ASSI { 1147} (( segid " " and resid 65 and name HA )) (( segid " " and resid 68 and name HN )) 2.700 0.900 0.900 peak 1147 weight 0.10000E+01 volume 0.56130E-02 ppm1 7.077 ppm2 4.026 CV 1 ASSI { 1164} (( segid " " and resid 59 and name HA )) (( segid " " and resid 53 and name HN )) 3.100 1.200 1.200 peak 1164 weight 0.10000E+01 volume 0.79733E-02 ppm1 8.548 ppm2 4.685 CV 1 ASSI { 1165} (( segid " " and resid 54 and name HN )) (( segid " " and resid 53 and name HN )) 3.400 1.500 1.500 peak 1165 weight 0.10000E+01 volume 0.58847E-02 ppm1 8.552 ppm2 8.337 CV 1 ASSI { 1170} (( segid " " and resid 52 and name HB )) (( segid " " and resid 53 and name HN )) 2.600 0.800 0.800 peak 1170 weight 0.10000E+01 volume 0.11307E-01 ppm1 8.544 ppm2 1.976 CV 1 ASSI { 1183} (( segid " " and resid 15 and name HB2 )) (( segid " " and resid 16 and name HN )) 2.800 1.000 1.000 peak 1183 weight 0.10000E+01 volume 0.94641E-02 ppm1 9.038 ppm2 3.708 CV 1 ASSI { 1188} ( segid " " and resid 63 and name HG1*) (( segid " " and resid 64 and name HN )) 2.500 0.800 0.800 peak 1188 weight 0.10000E+01 volume 0.13029E-01 ppm1 9.042 ppm2 0.923 CV 1 ASSI { 1199} (( segid " " and resid 24 and name HA )) (( segid " " and resid 25 and name HN )) 2.400 0.700 0.700 peak 1199 weight 0.10000E+01 volume 0.12709E-01 ppm1 8.194 ppm2 5.315 CV 1 ASSI { 1200} (( segid " " and resid 15 and name HA )) (( segid " " and resid 25 and name HN )) 3.400 1.400 1.400 peak 1200 weight 0.10000E+01 volume 0.63074E-02 ppm1 8.193 ppm2 5.590 CV 1 ASSI { 1205} ( segid " " and resid 24 and name HB* ) (( segid " " and resid 25 and name HN )) 2.600 0.900 0.900 peak 1205 weight 0.10000E+01 volume 0.13640E-01 ppm1 8.187 ppm2 0.886 CV 1 ASSI { 1209} (( segid " " and resid 21 and name HG* )) (( segid " " and resid 21 and name HA )) 3.300 1.300 1.300 peak 1209 weight 0.10000E+01 volume 0.74720E-02 ppm1 4.458 ppm2 2.266 CV 1 ASSI { 1214} (( segid " " and resid 40 and name HN )) (( segid " " and resid 39 and name HN )) 3.400 1.400 1.400 peak 1214 weight 0.10000E+01 volume 0.40160E-02 ppm1 8.245 ppm2 8.899 CV 1 ASSI { 1215} ( segid " " and resid 39 and name HD1*) (( segid " " and resid 39 and name HN )) 3.000 1.100 1.100 peak 1215 weight 0.10000E+01 volume 0.13303E-01 ppm1 8.242 ppm2 0.676 CV 1 OR { 1215} ( segid " " and resid 39 and name HG2*) (( segid " " and resid 39 and name HN )) ASSI { 1216} (( segid " " and resid 39 and name HG1*)) (( segid " " and resid 39 and name HN )) 3.200 1.300 1.300 peak 1216 weight 0.10000E+01 volume 0.87071E-02 ppm1 8.242 ppm2 0.893 CV 1 ASSI { 1256} (( segid " " and resid 85 and name HG* )) (( segid " " and resid 85 and name HN )) 3.300 1.400 1.400 peak 1256 weight 0.10000E+01 volume 0.41478E-02 ppm1 8.778 ppm2 1.424 CV 1 ASSI { 1275} (( segid " " and resid 65 and name HB* )) (( segid " " and resid 67 and name HN )) 3.600 1.600 1.600 peak 1275 weight 0.10000E+01 volume 0.64998E-02 ppm1 7.154 ppm2 1.927 CV 1 ASSI { 1310} (( segid " " and resid 71 and name HA )) (( segid " " and resid 71 and name HN )) 3.000 1.200 1.200 peak 1310 weight 0.10000E+01 volume 0.50070E-02 ppm1 7.844 ppm2 4.805 CV 1 ASSI { 1337} (( segid " " and resid 72 and name HB* )) (( segid " " and resid 72 and name HN )) 2.100 0.600 0.600 peak 1337 weight 0.10000E+01 volume 0.22415E-01 ppm1 8.176 ppm2 3.877 CV 1 ASSI { 1338} (( segid " " and resid 72 and name HA )) (( segid " " and resid 72 and name HN )) 2.700 0.900 0.900 peak 1338 weight 0.10000E+01 volume 0.82138E-02 ppm1 8.182 ppm2 4.302 CV 1 ASSI { 1340} (( segid " " and resid 71 and name HB )) (( segid " " and resid 72 and name HN )) 2.000 0.500 0.500 peak 1340 weight 0.10000E+01 volume 0.16018E-01 ppm1 8.182 ppm2 2.289 CV 1 ASSI { 1365} (( segid " " and resid 78 and name HN )) (( segid " " and resid 77 and name HN )) 2.300 0.700 0.700 peak 1365 weight 0.10000E+01 volume 0.14827E-01 ppm1 7.639 ppm2 7.233 CV 1 ASSI { 1376} (( segid " " and resid 78 and name HA )) (( segid " " and resid 78 and name HN )) 2.700 0.900 0.900 peak 1376 weight 0.10000E+01 volume 0.54688E-02 ppm1 7.236 ppm2 4.689 CV 1 ASSI { 1380} (( segid " " and resid 78 and name HB* )) (( segid " " and resid 78 and name HN )) 3.000 1.100 1.100 peak 1380 weight 0.10000E+01 volume 0.37105E-02 ppm1 7.228 ppm2 2.610 CV 1 ASSI { 1391} (( segid " " and resid 4 and name HG )) (( segid " " and resid 3 and name HN )) 3.400 1.400 1.400 peak 1391 weight 0.10000E+01 volume 0.45900E-02 ppm1 8.342 ppm2 0.757 CV 1 ASSI { 1394} (( segid " " and resid 81 and name HG1*)) (( segid " " and resid 81 and name HN )) 3.400 1.400 1.400 peak 1394 weight 0.10000E+01 volume 0.94750E-02 ppm1 9.018 ppm2 1.595 CV 1 ASSI { 1407} (( segid " " and resid 33 and name HA )) (( segid " " and resid 83 and name HN )) 3.300 1.300 1.300 peak 1407 weight 0.10000E+01 volume 0.52727E-02 ppm1 9.211 ppm2 4.789 CV 1 ASSI { 1410} ( segid " " and resid 83 and name HG1*) (( segid " " and resid 84 and name HN )) 2.600 0.900 0.900 peak 1410 weight 0.10000E+01 volume 0.15097E-01 ppm1 9.385 ppm2 0.747 CV 1 ASSI { 1436} (( segid " " and resid 88 and name HB* )) (( segid " " and resid 88 and name HN )) 3.000 1.100 1.100 peak 1436 weight 0.10000E+01 volume 0.65925E-02 ppm1 8.250 ppm2 2.642 CV 1 ASSI { 1447} ( segid " " and resid 89 and name HG1*) (( segid " " and resid 90 and name HN )) 2.600 0.900 0.900 peak 1447 weight 0.10000E+01 volume 0.13391E-01 ppm1 7.673 ppm2 0.806 CV 1 ASSI { 1449} (( segid " " and resid 90 and name HB* )) (( segid " " and resid 90 and name HN )) 2.600 0.800 0.800 peak 1449 weight 0.10000E+01 volume 0.10142E-01 ppm1 7.671 ppm2 1.967 CV 1 ASSI { 1467} (( segid " " and resid 11 and name HB* )) (( segid " " and resid 11 and name HN )) 3.500 1.600 1.600 peak 1467 weight 0.10000E+01 volume 0.41408E-02 ppm1 8.938 ppm2 2.934 CV 1 ASSI { 1492} (( segid " " and resid 82 and name HN )) (( segid " " and resid 93 and name HN )) 2.700 0.900 0.900 peak 1492 weight 0.10000E+01 volume 0.87043E-02 ppm1 9.444 ppm2 8.954 CV 1 ASSI { 1499} (( segid " " and resid 81 and name HB )) (( segid " " and resid 93 and name HN )) 4.000 2.000 2.000 peak 1499 weight 0.10000E+01 volume 0.40970E-02 ppm1 9.436 ppm2 1.733 CV 1 ASSI { 1509} (( segid " " and resid 81 and name HA )) (( segid " " and resid 95 and name HN )) 2.300 0.700 0.700 peak 1509 weight 0.10000E+01 volume 0.26444E-01 ppm1 8.855 ppm2 4.841 CV 1 ASSI { 1510} (( segid " " and resid 101 and name HA )) (( segid " " and resid 13 and name HN )) 3.300 1.300 1.300 peak 1510 weight 0.10000E+01 volume 0.77073E-02 ppm1 8.911 ppm2 4.891 CV 1 ASSI { 1513} (( segid " " and resid 82 and name HG1*)) (( segid " " and resid 95 and name HN )) 4.000 2.000 2.000 peak 1513 weight 0.10000E+01 volume 0.65473E-02 ppm1 8.848 ppm2 1.459 CV 1 ASSI { 1516} ( segid " " and resid 94 and name HD1*) (( segid " " and resid 95 and name HN )) 3.100 1.200 1.200 peak 1516 weight 0.10000E+01 volume 0.86965E-02 ppm1 8.848 ppm2 0.765 CV 1 ASSI { 1517} ( segid " " and resid 136 and name HD2*) (( segid " " and resid 123 and name HN )) 3.400 1.400 1.400 peak 1517 weight 0.10000E+01 volume 0.46287E-02 ppm1 8.852 ppm2 0.539 CV 1 OR { 1517} ( segid " " and resid 136 and name HD1*) (( segid " " and resid 123 and name HN )) ASSI { 1519} (( segid " " and resid 12 and name HB* )) (( segid " " and resid 13 and name HN )) 3.400 1.500 1.500 peak 1519 weight 0.10000E+01 volume 0.69219E-02 ppm1 8.905 ppm2 1.939 CV 1 ASSI { 1571} (( segid " " and resid 99 and name HG )) (( segid " " and resid 100 and name HN )) 3.400 1.500 1.500 peak 1571 weight 0.10000E+01 volume 0.68009E-02 ppm1 7.281 ppm2 1.394 CV 1 ASSI { 1572} (( segid " " and resid 99 and name HB* )) (( segid " " and resid 100 and name HN )) 2.800 1.000 1.000 peak 1572 weight 0.10000E+01 volume 0.69459E-02 ppm1 7.278 ppm2 1.839 CV 1 ASSI { 1588} ( segid " " and resid 53 and name HG2*) (( segid " " and resid 54 and name HN )) 3.300 1.400 1.400 peak 1588 weight 0.10000E+01 volume 0.10959E-01 ppm1 8.358 ppm2 0.814 CV 1 ASSI { 1637} (( segid " " and resid 108 and name HA )) (( segid " " and resid 108 and name HN )) 2.700 0.900 0.900 peak 1637 weight 0.10000E+01 volume 0.98016E-02 ppm1 7.948 ppm2 4.395 CV 1 ASSI { 1640} (( segid " " and resid 107 and name HN )) (( segid " " and resid 108 and name HN )) 2.500 0.800 0.800 peak 1640 weight 0.10000E+01 volume 0.12648E-01 ppm1 7.948 ppm2 8.150 CV 1 ASSI { 1641} (( segid " " and resid 106 and name HN )) (( segid " " and resid 108 and name HN )) 3.400 1.500 1.500 peak 1641 weight 0.10000E+01 volume 0.32321E-02 ppm1 7.955 ppm2 8.772 CV 1 ASSI { 1644} (( segid " " and resid 106 and name HB* )) (( segid " " and resid 108 and name HN )) 3.000 1.100 1.100 peak 1644 weight 0.10000E+01 volume 0.18100E-01 ppm1 7.950 ppm2 2.276 CV 1 ASSI { 1645} (( segid " " and resid 108 and name HG2 )) (( segid " " and resid 108 and name HN )) 2.400 0.700 0.700 peak 1645 weight 0.10000E+01 volume 0.15001E-01 ppm1 7.955 ppm2 2.438 CV 1 ASSI { 1646} (( segid " " and resid 107 and name HB* )) (( segid " " and resid 108 and name HN )) 3.200 1.200 1.200 peak 1646 weight 0.10000E+01 volume 0.43669E-02 ppm1 7.950 ppm2 2.864 CV 1 ASSI { 1664} (( segid " " and resid 110 and name HB* )) (( segid " " and resid 110 and name HN )) 3.000 1.100 1.100 peak 1664 weight 0.10000E+01 volume 0.87074E-02 ppm1 9.116 ppm2 2.553 CV 1 ASSI { 1670} (( segid " " and resid 34 and name HB )) (( segid " " and resid 34 and name HN )) 3.100 1.200 1.200 peak 1670 weight 0.10000E+01 volume 0.81970E-02 ppm1 9.130 ppm2 1.932 CV 1 ASSI { 1703} ( segid " " and resid 5 and name HB* ) (( segid " " and resid 5 and name HN )) 2.600 0.800 0.800 peak 1703 weight 0.10000E+01 volume 0.19219E-01 ppm1 8.206 ppm2 1.404 CV 1 ASSI { 1705} (( segid " " and resid 2 and name HB* )) (( segid " " and resid 5 and name HN )) 2.500 0.800 0.800 peak 1705 weight 0.10000E+01 volume 0.20344E-01 ppm1 8.206 ppm2 1.838 CV 1 ASSI { 1739} ( segid " " and resid 24 and name HB* ) (( segid " " and resid 24 and name HN )) 2.600 0.800 0.800 peak 1739 weight 0.10000E+01 volume 0.11984E-01 ppm1 7.805 ppm2 0.879 CV 1 ASSI { 1741} ( segid " " and resid 23 and name HD2*) (( segid " " and resid 24 and name HN )) 3.600 1.600 1.600 peak 1741 weight 0.10000E+01 volume 0.68293E-02 ppm1 7.798 ppm2 0.268 CV 1 ASSI { 1753} (( segid " " and resid 29 and name HA )) (( segid " " and resid 30 and name HN )) 3.400 1.500 1.500 peak 1753 weight 0.10000E+01 volume 0.42507E-02 ppm1 7.831 ppm2 4.937 CV 1 ASSI { 1768} ( segid " " and resid 84 and name HB* ) (( segid " " and resid 30 and name HN )) 3.000 1.100 1.100 peak 1768 weight 0.10000E+01 volume 0.12467E-01 ppm1 7.834 ppm2 1.194 CV 1 ASSI { 1775} ( segid " " and resid 33 and name HG2*) (( segid " " and resid 33 and name HN )) 2.700 0.900 0.900 peak 1775 weight 0.10000E+01 volume 0.13730E-01 ppm1 8.478 ppm2 0.905 CV 1 ASSI { 1776} (( segid " " and resid 32 and name HB* )) (( segid " " and resid 33 and name HN )) 2.800 1.000 1.000 peak 1776 weight 0.10000E+01 volume 0.24819E-01 ppm1 8.478 ppm2 1.953 CV 1 ASSI { 1780} (( segid " " and resid 35 and name HA )) (( segid " " and resid 35 and name HN )) 2.700 0.900 0.900 peak 1780 weight 0.10000E+01 volume 0.97232E-02 ppm1 8.634 ppm2 4.500 CV 1 ASSI { 1782} (( segid " " and resid 35 and name HG* )) (( segid " " and resid 35 and name HN )) 2.500 0.800 0.800 peak 1782 weight 0.10000E+01 volume 0.18626E-01 ppm1 8.633 ppm2 1.992 CV 1 ASSI { 1805} (( segid " " and resid 38 and name HA )) (( segid " " and resid 39 and name HN )) 2.100 0.600 0.600 peak 1805 weight 0.10000E+01 volume 0.45684E-01 ppm1 8.257 ppm2 4.669 CV 1 ASSI { 1855} (( segid " " and resid 124 and name HA* )) (( segid " " and resid 125 and name HN )) 2.300 0.700 0.700 peak 1855 weight 0.10000E+01 volume 0.15900E-01 ppm1 8.436 ppm2 4.477 CV 1 ASSI { 1901} (( segid " " and resid 121 and name HG* )) (( segid " " and resid 121 and name HN )) 3.600 1.600 1.600 peak 1901 weight 0.10000E+01 volume 0.62607E-02 ppm1 7.821 ppm2 1.239 CV 1 ASSI { 1912} (( segid " " and resid 137 and name HN )) (( segid " " and resid 124 and name HN )) 3.500 1.600 1.600 peak 1912 weight 0.10000E+01 volume 0.37241E-02 ppm1 7.839 ppm2 8.412 CV 1 ASSI { 1926} ( segid " " and resid 126 and name HG1*) (( segid " " and resid 126 and name HN )) 2.600 0.800 0.800 peak 1926 weight 0.10000E+01 volume 0.73737E-02 ppm1 9.280 ppm2 0.622 CV 1 ASSI { 1953} (( segid " " and resid 5 and name HA )) (( segid " " and resid 4 and name HN )) 3.600 1.600 1.600 peak 1953 weight 0.10000E+01 volume 0.76743E-02 ppm1 8.370 ppm2 4.268 CV 1 ASSI { 1955} (( segid " " and resid 4 and name HB* )) (( segid " " and resid 4 and name HN )) 2.000 0.500 0.500 peak 1955 weight 0.10000E+01 volume 0.47134E-01 ppm1 8.358 ppm2 1.666 CV 1 ASSI { 1967} (( segid " " and resid 124 and name HN )) (( segid " " and resid 135 and name HN )) 3.600 1.600 1.600 peak 1967 weight 0.10000E+01 volume 0.28469E-02 ppm1 8.552 ppm2 7.848 CV 1 ASSI { 1978} (( segid " " and resid 140 and name HA )) (( segid " " and resid 140 and name HN )) 2.700 0.900 0.900 peak 1978 weight 0.10000E+01 volume 0.11352E-01 ppm1 7.590 ppm2 4.100 CV 1 ASSI { 1979} (( segid " " and resid 139 and name HA )) (( segid " " and resid 140 and name HN )) 3.300 1.300 1.300 peak 1979 weight 0.10000E+01 volume 0.41106E-02 ppm1 7.590 ppm2 4.342 CV 1 ASSI { 1980} (( segid " " and resid 141 and name HN )) (( segid " " and resid 140 and name HN )) 2.200 0.600 0.600 peak 1980 weight 0.10000E+01 volume 0.22916E-01 ppm1 7.590 ppm2 7.774 CV 1 ASSI { 2015} ( segid " " and resid 83 and name HG2*) (( segid " " and resid 83 and name HN )) 2.500 0.800 0.800 peak 2015 weight 0.10000E+01 volume 0.18977E-01 ppm1 9.212 ppm2 0.751 CV 1 ASSI { 2023} (( segid " " and resid 133 and name HG1*)) (( segid " " and resid 133 and name HN )) 3.300 1.400 1.400 peak 2023 weight 0.10000E+01 volume 0.41444E-02 ppm1 9.022 ppm2 1.332 CV 1 ASSI { 2025} ( segid " " and resid 126 and name HG1*) (( segid " " and resid 133 and name HN )) 3.200 1.300 1.300 peak 2025 weight 0.10000E+01 volume 0.52753E-02 ppm1 9.022 ppm2 0.613 CV 1 OR { 2025} ( segid " " and resid 126 and name HG2*) (( segid " " and resid 133 and name HN )) ASSI { 2034} (( segid " " and resid 43 and name HG* )) (( segid " " and resid 43 and name HA )) 3.600 1.600 1.600 peak 2034 weight 0.10000E+01 volume 0.75641E-02 ppm1 4.379 ppm2 2.062 CV 1 ASSI { 2044} (( segid " " and resid 5 and name HN )) (( segid " " and resid 4 and name HA )) 2.700 0.900 0.900 peak 2044 weight 0.10000E+01 volume 0.13765E-01 ppm1 4.350 ppm2 8.222 CV 1 ASSI { 2047} (( segid " " and resid 129 and name HB* )) (( segid " " and resid 129 and name HA )) 3.200 1.200 1.200 peak 2047 weight 0.10000E+01 volume 0.58512E-02 ppm1 4.366 ppm2 2.569 CV 1 ASSI { 2048} (( segid " " and resid 4 and name HB* )) (( segid " " and resid 4 and name HA )) 2.400 0.700 0.700 peak 2048 weight 0.10000E+01 volume 0.28103E-01 ppm1 4.350 ppm2 1.657 CV 1 ASSI { 2112} ( segid " " and resid 136 and name HD1*) (( segid " " and resid 122 and name HB* )) 2.800 1.000 1.000 peak 2112 weight 0.10000E+01 volume 0.83369E-02 ppm1 3.561 ppm2 0.515 CV 1 OR { 2112} ( segid " " and resid 136 and name HD2*) (( segid " " and resid 122 and name HB* )) ASSI { 2121} (( segid " " and resid 90 and name HA )) (( segid " " and resid 85 and name HA )) 2.500 0.800 0.800 peak 2121 weight 0.10000E+01 volume 0.11807E-01 ppm1 5.450 ppm2 5.294 CV 1 ASSI { 2156} (( segid " " and resid 148 and name HD* )) (( segid " " and resid 145 and name HA )) 3.400 1.500 1.500 peak 2156 weight 0.10000E+01 volume 0.61123E-02 ppm1 4.181 ppm2 1.696 CV 1 ASSI { 2165} (( segid " " and resid 67 and name HG* )) (( segid " " and resid 67 and name HA )) 2.800 1.000 1.000 peak 2165 weight 0.10000E+01 volume 0.12641E-01 ppm1 4.189 ppm2 1.539 CV 1 ASSI { 2166} (( segid " " and resid 67 and name HD* )) (( segid " " and resid 67 and name HA )) 2.900 1.000 1.000 peak 2166 weight 0.10000E+01 volume 0.10640E-01 ppm1 4.182 ppm2 1.730 CV 1 ASSI { 2169} (( segid " " and resid 70 and name HA* )) (( segid " " and resid 67 and name HA )) 3.800 1.800 1.800 peak 2169 weight 0.10000E+01 volume 0.75120E-02 ppm1 4.195 ppm2 3.986 CV 1 ASSI { 2196} (( segid " " and resid 106 and name HA )) (( segid " " and resid 106 and name HG* )) 2.900 1.100 1.100 peak 2196 weight 0.10000E+01 volume 0.11593E-01 ppm1 2.501 ppm2 4.138 CV 1 ASSI { 2202} (( segid " " and resid 106 and name HB* )) (( segid " " and resid 106 and name HA )) 2.300 0.700 0.700 peak 2202 weight 0.10000E+01 volume 0.24195E-01 ppm1 4.118 ppm2 2.267 CV 1 ASSI { 2208} (( segid " " and resid 106 and name HN )) (( segid " " and resid 106 and name HA )) 2.700 0.900 0.900 peak 2208 weight 0.10000E+01 volume 0.10322E-01 ppm1 4.115 ppm2 8.800 CV 1 ASSI { 2209} (( segid " " and resid 106 and name HG* )) (( segid " " and resid 106 and name HB* )) 2.000 0.500 0.500 peak 2209 weight 0.10000E+01 volume 0.83338E-01 ppm1 2.250 ppm2 2.482 CV 1 ASSI { 2216} (( segid " " and resid 17 and name HN )) (( segid " " and resid 16 and name HA )) 2.400 0.700 0.700 peak 2216 weight 0.10000E+01 volume 0.11386E-01 ppm1 5.117 ppm2 8.901 CV 1 ASSI { 2218} (( segid " " and resid 99 and name HG )) (( segid " " and resid 16 and name HA )) 2.800 1.000 1.000 peak 2218 weight 0.10000E+01 volume 0.68247E-02 ppm1 5.123 ppm2 1.405 CV 1 ASSI { 2240} (( segid " " and resid 11 and name HA )) (( segid " " and resid 11 and name HB* )) 2.700 0.900 0.900 peak 2240 weight 0.10000E+01 volume 0.79612E-02 ppm1 2.920 ppm2 4.937 CV 1 ASSI { 2253} (( segid " " and resid 12 and name HG* )) ( segid " " and resid 13 and name HG1*) 3.100 1.200 1.200 peak 2253 weight 0.10000E+01 volume 0.73657E-02 ppm1 0.510 ppm2 2.059 CV 1 ASSI { 2269} (( segid " " and resid 104 and name HB )) ( segid " " and resid 13 and name HG2*) 2.600 0.900 0.900 peak 2269 weight 0.10000E+01 volume 0.12643E-01 ppm1 0.456 ppm2 1.464 CV 1 ASSI { 2271} ( segid " " and resid 24 and name HB* ) (( segid " " and resid 13 and name HB )) 2.900 1.100 1.100 peak 2271 weight 0.10000E+01 volume 0.81485E-02 ppm1 1.895 ppm2 0.886 CV 1 ASSI { 2309} ( segid " " and resid 104 and name HD1*) (( segid " " and resid 104 and name HG1*)) 2.200 0.600 0.600 peak 2309 weight 0.10000E+01 volume 0.17819E-01 ppm1 0.743 ppm2 0.305 CV 1 ASSI { 2379} (( segid " " and resid 29 and name HB* )) (( segid " " and resid 29 and name HA )) 2.900 1.100 1.100 peak 2379 weight 0.10000E+01 volume 0.58659E-02 ppm1 4.952 ppm2 2.386 CV 1 ASSI { 2398} (( segid " " and resid 77 and name HA )) (( segid " " and resid 96 and name HB* )) 3.400 1.400 1.400 peak 2398 weight 0.10000E+01 volume 0.81676E-02 ppm1 2.749 ppm2 4.338 CV 1 ASSI { 2410} (( segid " " and resid 143 and name HN )) (( segid " " and resid 144 and name HB* )) 3.400 1.400 1.400 peak 2410 weight 0.10000E+01 volume 0.81511E-02 ppm1 2.158 ppm2 8.054 CV 1 ASSI { 2445} (( segid " " and resid 77 and name HB* )) (( segid " " and resid 77 and name HA )) 2.400 0.700 0.700 peak 2445 weight 0.10000E+01 volume 0.21193E-01 ppm1 4.317 ppm2 1.997 CV 1 ASSI { 2447} ( segid " " and resid 83 and name HG2*) (( segid " " and resid 82 and name HA )) 3.200 1.300 1.300 peak 2447 weight 0.10000E+01 volume 0.10703E-01 ppm1 4.321 ppm2 0.740 CV 1 ASSI { 2457} (( segid " " and resid 98 and name HN )) (( segid " " and resid 97 and name HB* )) 3.400 1.400 1.400 peak 2457 weight 0.10000E+01 volume 0.11186E-01 ppm1 2.121 ppm2 9.050 CV 1 ASSI { 2469} (( segid " " and resid 99 and name HG )) (( segid " " and resid 99 and name HB* )) 2.300 0.700 0.700 peak 2469 weight 0.10000E+01 volume 0.15897E-01 ppm1 1.846 ppm2 1.394 CV 1 ASSI { 2480} (( segid " " and resid 144 and name HB* )) (( segid " " and resid 141 and name HA )) 3.000 1.100 1.100 peak 2480 weight 0.10000E+01 volume 0.55354E-02 ppm1 3.560 ppm2 2.164 CV 1 ASSI { 2490} (( segid " " and resid 140 and name HA )) (( segid " " and resid 140 and name HB* )) 2.900 1.100 1.100 peak 2490 weight 0.10000E+01 volume 0.65406E-02 ppm1 1.737 ppm2 4.102 CV 1 ASSI { 2496} ( segid " " and resid 99 and name HD2*) (( segid " " and resid 99 and name HA )) 2.300 0.700 0.700 peak 2496 weight 0.10000E+01 volume 0.21274E-01 ppm1 4.462 ppm2 0.736 CV 1 ASSI { 2497} (( segid " " and resid 99 and name HG )) (( segid " " and resid 99 and name HA )) 3.000 1.100 1.100 peak 2497 weight 0.10000E+01 volume 0.15539E-01 ppm1 4.476 ppm2 1.399 CV 1 ASSI { 2503} ( segid " " and resid 125 and name HD2*) (( segid " " and resid 125 and name HB* )) 2.800 1.000 1.000 peak 2503 weight 0.10000E+01 volume 0.10594E-01 ppm1 1.522 ppm2 0.907 CV 1 OR { 2503} ( segid " " and resid 125 and name HD1*) (( segid " " and resid 125 and name HB* )) ASSI { 2531} (( segid " " and resid 14 and name HG )) ( segid " " and resid 30 and name HD1*) 2.800 0.900 0.900 peak 2531 weight 0.10000E+01 volume 0.12190E-01 ppm1 0.683 ppm2 1.432 CV 1 ASSI { 2532} (( segid " " and resid 30 and name HG1*)) ( segid " " and resid 30 and name HD1*) 2.600 0.800 0.800 peak 2532 weight 0.10000E+01 volume 0.10188E-01 ppm1 0.680 ppm2 1.839 CV 1 ASSI { 2533} (( segid " " and resid 29 and name HB* )) ( segid " " and resid 30 and name HD1*) 3.700 1.700 1.700 peak 2533 weight 0.10000E+01 volume 0.79702E-02 ppm1 0.689 ppm2 2.365 CV 1 ASSI { 2534} (( segid " " and resid 25 and name HB* )) ( segid " " and resid 30 and name HD1*) 2.800 1.000 1.000 peak 2534 weight 0.10000E+01 volume 0.54794E-02 ppm1 0.683 ppm2 2.807 CV 1 ASSI { 2540} (( segid " " and resid 31 and name HN )) ( segid " " and resid 30 and name HD1*) 3.600 1.600 1.600 peak 2540 weight 0.10000E+01 volume 0.39009E-02 ppm1 0.680 ppm2 9.392 CV 1 ASSI { 2544} (( segid " " and resid 85 and name HG* )) (( segid " " and resid 85 and name HB* )) 2.200 0.600 0.600 peak 2544 weight 0.10000E+01 volume 0.33603E-01 ppm1 1.698 ppm2 1.432 CV 1 ASSI { 2545} (( segid " " and resid 90 and name HG* )) (( segid " " and resid 85 and name HB* )) 3.000 1.200 1.200 peak 2545 weight 0.10000E+01 volume 0.53739E-02 ppm1 1.696 ppm2 2.179 CV 1 ASSI { 2548} (( segid " " and resid 44 and name HG* )) (( segid " " and resid 44 and name HA )) 2.900 1.000 1.000 peak 2548 weight 0.10000E+01 volume 0.10327E-01 ppm1 4.214 ppm2 1.430 CV 1 ASSI { 2585} ( segid " " and resid 125 and name HD1*) (( segid " " and resid 125 and name HN )) 3.200 1.300 1.300 peak 2585 weight 0.10000E+01 volume 0.11292E-01 ppm1 8.434 ppm2 0.907 CV 1 OR { 2585} ( segid " " and resid 125 and name HD2*) (( segid " " and resid 125 and name HN )) ASSI { 2600} (( segid " " and resid 91 and name HB )) ( segid " " and resid 142 and name HD1*) 3.600 1.600 1.600 peak 2600 weight 0.10000E+01 volume 0.55408E-02 ppm1 0.745 ppm2 1.609 CV 1 ASSI { 2625} (( segid " " and resid 28 and name HB* )) (( segid " " and resid 28 and name HA )) 2.500 0.800 0.800 peak 2625 weight 0.10000E+01 volume 0.22541E-01 ppm1 4.445 ppm2 2.667 CV 1 ASSI { 2627} ( segid " " and resid 27 and name HG2*) (( segid " " and resid 28 and name HA )) 3.100 1.200 1.200 peak 2627 weight 0.10000E+01 volume 0.76493E-02 ppm1 4.438 ppm2 1.044 CV 1 ASSI { 2628} (( segid " " and resid 85 and name HG* )) (( segid " " and resid 29 and name HA )) 3.400 1.400 1.400 peak 2628 weight 0.10000E+01 volume 0.60610E-02 ppm1 4.944 ppm2 1.459 CV 1 ASSI { 2652} (( segid " " and resid 5 and name HA )) ( segid " " and resid 5 and name HB* ) 2.600 0.900 0.900 peak 2652 weight 0.10000E+01 volume 0.14018E-01 ppm1 1.375 ppm2 4.265 CV 1 ASSI { 2665} (( segid " " and resid 11 and name HN )) (( segid " " and resid 10 and name HA )) 2.200 0.600 0.600 peak 2665 weight 0.10000E+01 volume 0.23593E-01 ppm1 4.949 ppm2 8.934 CV 1 ASSI { 2666} (( segid " " and resid 10 and name HN )) (( segid " " and resid 10 and name HA )) 2.600 0.800 0.800 peak 2666 weight 0.10000E+01 volume 0.11352E-01 ppm1 4.956 ppm2 8.019 CV 1 ASSI { 2692} (( segid " " and resid 142 and name HG1*)) ( segid " " and resid 89 and name HG1*) 2.900 1.100 1.100 peak 2692 weight 0.10000E+01 volume 0.11943E-01 ppm1 0.788 ppm2 1.182 CV 1 ASSI { 2703} (( segid " " and resid 62 and name HA )) (( segid " " and resid 63 and name HN )) 2.100 0.500 0.500 peak 2703 weight 0.10000E+01 volume 0.32251E-01 ppm1 9.051 ppm2 4.648 CV 1 ASSI { 2711} (( segid " " and resid 33 and name HB )) ( segid " " and resid 98 and name HG1*) 3.200 1.300 1.300 peak 2711 weight 0.10000E+01 volume 0.92250E-02 ppm1 1.095 ppm2 1.632 CV 1 ASSI { 2754} ( segid " " and resid 94 and name HD1*) (( segid " " and resid 94 and name HB* )) 2.700 0.900 0.900 peak 2754 weight 0.10000E+01 volume 0.88960E-02 ppm1 1.472 ppm2 0.762 CV 1 ASSI { 2942} ( segid " " and resid 83 and name HG1*) ( segid " " and resid 84 and name HB* ) 2.800 1.000 1.000 peak 2942 weight 0.10000E+01 volume 0.22664E-01 ppm1 1.187 ppm2 0.726 CV 1 OR { 2942} ( segid " " and resid 83 and name HG2*) ( segid " " and resid 84 and name HB* ) ASSI { 2956} (( segid " " and resid 9 and name HA )) (( segid " " and resid 9 and name HG* )) 3.400 1.400 1.400 peak 2956 weight 0.10000E+01 volume 0.89786E-02 ppm1 1.397 ppm2 4.251 CV 1 ASSI { 3004} (( segid " " and resid 9 and name HD* )) (( segid " " and resid 9 and name HB* )) 2.100 0.500 0.500 peak 3004 weight 0.10000E+01 volume 0.46455E-01 ppm1 1.772 ppm2 1.464 CV 1 ASSI { 3011} ( segid " " and resid 99 and name HD2*) (( segid " " and resid 99 and name HB* )) 3.100 1.200 1.200 peak 3011 weight 0.10000E+01 volume 0.87667E-02 ppm1 1.842 ppm2 0.743 CV 1 ASSI { 3036} ( segid " " and resid 89 and name HG2*) (( segid " " and resid 89 and name HB )) 2.300 0.700 0.700 peak 3036 weight 0.10000E+01 volume 0.24006E-01 ppm1 2.056 ppm2 0.871 CV 1 ASSI { 3090} ( segid " " and resid 65 and name HD1*) (( segid " " and resid 65 and name HA )) 3.000 1.100 1.100 peak 3090 weight 0.10000E+01 volume 0.17703E-01 ppm1 4.041 ppm2 0.781 CV 1 ASSI { 3140} ( segid " " and resid 98 and name HG2*) (( segid " " and resid 100 and name HN )) 3.100 1.200 1.200 peak 3140 weight 0.10000E+01 volume 0.83382E-02 ppm1 7.278 ppm2 0.942 CV 1 ASSI { 3150} (( segid " " and resid 139 and name HB* )) (( segid " " and resid 140 and name HN )) 3.700 1.700 1.700 peak 3150 weight 0.10000E+01 volume 0.74460E-02 ppm1 7.584 ppm2 2.636 CV 1 ASSI { 3184} ( segid " " and resid 7 and name HB* ) (( segid " " and resid 7 and name HN )) 2.600 0.800 0.800 peak 3184 weight 0.10000E+01 volume 0.24714E-01 ppm1 8.019 ppm2 1.417 CV 1 ASSI { 3185} (( segid " " and resid 6 and name HB* )) (( segid " " and resid 7 and name HN )) 3.500 1.500 1.500 peak 3185 weight 0.10000E+01 volume 0.56505E-02 ppm1 8.016 ppm2 2.700 CV 1 ASSI { 3192} (( segid " " and resid 44 and name HB* )) (( segid " " and resid 45 and name HN )) 2.900 1.100 1.100 peak 3192 weight 0.10000E+01 volume 0.59923E-02 ppm1 8.052 ppm2 1.846 CV 1 ASSI { 3221} (( segid " " and resid 141 and name HN )) (( segid " " and resid 138 and name HN )) 3.500 1.600 1.600 peak 3221 weight 0.10000E+01 volume 0.61213E-02 ppm1 8.318 ppm2 7.763 CV 1 ASSI { 3227} (( segid " " and resid 54 and name HB* )) (( segid " " and resid 54 and name HN )) 3.000 1.100 1.100 peak 3227 weight 0.10000E+01 volume 0.11220E-01 ppm1 8.357 ppm2 2.398 CV 1 ASSI { 3245} (( segid " " and resid 125 and name HB* )) (( segid " " and resid 125 and name HN )) 2.900 1.100 1.100 peak 3245 weight 0.10000E+01 volume 0.66557E-02 ppm1 8.450 ppm2 1.529 CV 1 ASSI { 3255} (( segid " " and resid 126 and name HB )) (( segid " " and resid 127 and name HN )) 4.100 2.100 1.900 peak 3255 weight 0.10000E+01 volume 0.43527E-02 ppm1 8.656 ppm2 1.839 CV 1 ASSI { 3269} ( segid " " and resid 39 and name HD1*) (( segid " " and resid 40 and name HN )) 3.900 1.900 1.900 peak 3269 weight 0.10000E+01 volume 0.42301E-02 ppm1 8.873 ppm2 0.690 CV 1 ASSI { 3275} (( segid " " and resid 102 and name HB* )) (( segid " " and resid 13 and name HN )) 3.700 1.700 1.700 peak 3275 weight 0.10000E+01 volume 0.41233E-02 ppm1 8.904 ppm2 1.382 CV 1 ASSI { 3284} (( segid " " and resid 10 and name HB* )) (( segid " " and resid 11 and name HN )) 3.100 1.200 1.200 peak 3284 weight 0.10000E+01 volume 0.13704E-01 ppm1 8.933 ppm2 1.838 CV 1 ASSI { 3329} (( segid " " and resid 144 and name HN )) (( segid " " and resid 144 and name HG* )) 2.800 1.000 1.000 peak 3329 weight 0.10000E+01 volume 0.62454E-02 ppm1 2.269 ppm2 7.544 CV 1 ASSI { 7} (( segid " " and resid 75 and name HB* )) ( segid " " and resid 73 and name HE* ) 3.600 1.600 1.600 peak 7 weight 0.10000E+01 volume 0.41958E-02 ppm1 6.975 ppm2 2.258 CV 1 ASSI { 8} (( segid " " and resid 75 and name HG* )) ( segid " " and resid 73 and name HE* ) 3.900 1.900 1.900 peak 8 weight 0.10000E+01 volume 0.32259E-02 ppm1 6.980 ppm2 2.527 CV 1 ASSI { 12} (( segid " " and resid 135 and name HB* )) ( segid " " and resid 135 and name HD* ) 3.100 1.200 1.200 peak 12 weight 0.10000E+01 volume 0.79277E-02 ppm1 6.737 ppm2 2.526 CV 1 ASSI { 17} ( segid " " and resid 24 and name HB* ) ( segid " " and resid 135 and name HD* ) 2.300 0.700 0.700 peak 17 weight 0.10000E+01 volume 0.25933E-01 ppm1 6.740 ppm2 0.895 CV 1 ASSI { 20} ( segid " " and resid 13 and name HG1*) ( segid " " and resid 135 and name HD* ) 3.000 1.100 1.100 peak 20 weight 0.10000E+01 volume 0.13388E-01 ppm1 6.740 ppm2 0.541 CV 1 ASSI { 26} ( segid " " and resid 84 and name HB* ) ( segid " " and resid 25 and name HE* ) 3.800 1.800 1.800 peak 26 weight 0.10000E+01 volume 0.24457E-02 ppm1 6.596 ppm2 1.197 CV 1 ASSI { 34} ( segid " " and resid 13 and name HG1*) ( segid " " and resid 135 and name HE* ) 2.600 0.900 0.900 peak 34 weight 0.10000E+01 volume 0.22981E-01 ppm1 6.531 ppm2 0.531 CV 1 ASSI { 38} ( segid " " and resid 27 and name HG1*) ( segid " " and resid 135 and name HE* ) 2.300 2.300 3.700 peak 38 weight 0.10000E+01 volume 0.13072E-01 ppm1 6.526 ppm2 1.048 CV 1 OR { 38} ( segid " " and resid 27 and name HG2*) ( segid " " and resid 135 and name HE* ) ASSI { 44} ( segid " " and resid 11 and name HD* ) ( segid " " and resid 135 and name HE* ) 3.700 1.700 1.700 peak 44 weight 0.10000E+01 volume 0.84125E-02 ppm1 6.534 ppm2 7.023 CV 1 ASSI { 46} (( segid " " and resid 26 and name HA )) ( segid " " and resid 135 and name HE* ) 3.700 1.700 1.700 peak 46 weight 0.10000E+01 volume 0.20135E-02 ppm1 6.528 ppm2 4.974 CV 1 ASSI { 47} (( segid " " and resid 47 and name HB* )) (( segid " " and resid 47 and name HE1 )) 3.400 3.400 2.600 peak 47 weight 0.10000E+01 volume 0.10669E-01 ppm1 7.114 ppm2 3.134 CV 1 ASSI { 48} (( segid " " and resid 47 and name HA )) (( segid " " and resid 47 and name HE1 )) 3.800 1.800 1.800 peak 48 weight 0.10000E+01 volume 0.55661E-02 ppm1 7.114 ppm2 4.344 CV 1 ASSI { 67} ( segid " " and resid 13 and name HG1*) ( segid " " and resid 11 and name HD* ) 2.700 0.900 0.900 peak 67 weight 0.10000E+01 volume 0.23403E-01 ppm1 7.047 ppm2 0.518 CV 1 ASSI { 68} (( segid " " and resid 102 and name HG )) ( segid " " and resid 11 and name HD* ) 3.400 3.400 2.600 peak 68 weight 0.10000E+01 volume 0.30572E-01 ppm1 7.047 ppm2 0.672 CV 1 ASSI { 69} (( segid " " and resid 104 and name HG1*)) ( segid " " and resid 11 and name HD* ) 2.900 1.100 1.100 peak 69 weight 0.10000E+01 volume 0.35631E-01 ppm1 7.047 ppm2 0.761 CV 1 ASSI { 72} (( segid " " and resid 104 and name HB )) ( segid " " and resid 11 and name HD* ) 2.600 0.800 0.800 peak 72 weight 0.10000E+01 volume 0.12882E-01 ppm1 7.050 ppm2 1.466 CV 1 ASSI { 73} (( segid " " and resid 102 and name HB* )) ( segid " " and resid 11 and name HD* ) 4.100 2.100 1.900 peak 73 weight 0.10000E+01 volume 0.59879E-02 ppm1 7.050 ppm2 1.400 CV 1 ASSI { 74} (( segid " " and resid 109 and name HG )) ( segid " " and resid 11 and name HD* ) 2.300 2.300 3.700 peak 74 weight 0.10000E+01 volume 0.14316E-01 ppm1 7.047 ppm2 1.727 CV 1 ASSI { 77} (( segid " " and resid 11 and name HB* )) ( segid " " and resid 11 and name HD* ) 2.500 0.800 0.800 peak 77 weight 0.10000E+01 volume 0.27197E-01 ppm1 7.047 ppm2 2.900 CV 1 ASSI { 82} ( segid " " and resid 11 and name HE* ) ( segid " " and resid 11 and name HD* ) 2.200 0.600 0.600 peak 82 weight 0.10000E+01 volume 0.45330E-01 ppm1 7.047 ppm2 6.821 CV 1 ASSI { 83} (( segid " " and resid 106 and name HB* )) ( segid " " and resid 11 and name HD* ) 2.900 2.900 3.100 peak 83 weight 0.10000E+01 volume 0.30992E-02 ppm1 7.030 ppm2 2.285 CV 1 ASSI { 84} (( segid " " and resid 135 and name HB* )) ( segid " " and resid 11 and name HD* ) 4.500 2.600 1.500 peak 84 weight 0.10000E+01 volume 0.10310E-02 ppm1 7.050 ppm2 2.549 CV 1 ASSI { 87} ( segid " " and resid 16 and name HE* ) ( segid " " and resid 16 and name HD* ) 2.500 0.800 0.800 peak 87 weight 0.10000E+01 volume 0.12714E-01 ppm1 6.763 ppm2 6.560 CV 1 ASSI { 88} ( segid " " and resid 93 and name HE* ) ( segid " " and resid 93 and name HD* ) 1.700 0.400 0.500 peak 88 weight 0.10000E+01 volume 0.12798E+00 ppm1 7.237 ppm2 7.384 CV 1 ASSI { 89} (( segid " " and resid 73 and name HA )) ( segid " " and resid 73 and name HD* ) 3.400 1.500 1.500 peak 89 weight 0.10000E+01 volume 0.40270E-02 ppm1 7.248 ppm2 4.896 CV 1 ASSI { 90} (( segid " " and resid 74 and name HA )) ( segid " " and resid 73 and name HD* ) 3.800 1.900 1.900 peak 90 weight 0.10000E+01 volume 0.27197E-02 ppm1 7.243 ppm2 4.739 CV 1 ASSI { 93} (( segid " " and resid 73 and name HB* )) ( segid " " and resid 73 and name HD* ) 2.700 0.900 0.900 peak 93 weight 0.10000E+01 volume 0.12735E-01 ppm1 7.237 ppm2 2.973 CV 1 ASSI { 94} (( segid " " and resid 74 and name HB* )) ( segid " " and resid 73 and name HD* ) 4.200 2.200 1.800 peak 94 weight 0.10000E+01 volume 0.45542E-02 ppm1 7.237 ppm2 2.575 CV 1 ASSI { 99} (( segid " " and resid 118 and name HA )) ( segid " " and resid 118 and name HE* ) 3.900 1.900 1.900 peak 99 weight 0.10000E+01 volume 0.55661E-02 ppm1 7.258 ppm2 4.753 CV 1 ASSI { 102} ( segid " " and resid 25 and name HE* ) ( segid " " and resid 25 and name HD* ) 2.400 0.700 0.700 peak 102 weight 0.10000E+01 volume 0.20683E-01 ppm1 7.199 ppm2 6.599 CV 1 ASSI { 111} (( segid " " and resid 118 and name HB* )) ( segid " " and resid 118 and name HE* ) 4.100 2.100 1.900 peak 111 weight 0.10000E+01 volume 0.59036E-02 ppm1 7.254 ppm2 2.859 CV 1 ASSI { 115} (( segid " " and resid 69 and name HB* )) ( segid " " and resid 118 and name HE* ) 3.500 1.500 1.500 peak 115 weight 0.10000E+01 volume 0.82861E-02 ppm1 7.260 ppm2 1.706 CV 1 ASSI { 117} (( segid " " and resid 69 and name HG )) ( segid " " and resid 118 and name HE* ) 2.800 1.000 1.000 peak 117 weight 0.10000E+01 volume 0.25722E-01 ppm1 7.252 ppm2 0.929 CV 1 ASSI { 119} ( segid " " and resid 69 and name HD1*) ( segid " " and resid 118 and name HE* ) 2.500 0.800 0.800 peak 119 weight 0.10000E+01 volume 0.23614E-01 ppm1 7.255 ppm2 0.605 CV 1 ASSI { 123} ( segid " " and resid 63 and name HG1*) ( segid " " and resid 48 and name HD* ) 2.600 0.800 0.800 peak 123 weight 0.10000E+01 volume 0.24457E-01 ppm1 7.098 ppm2 0.893 CV 1 ASSI { 124} (( segid " " and resid 148 and name HD* )) ( segid " " and resid 48 and name HD* ) 2.800 1.000 1.000 peak 124 weight 0.10000E+01 volume 0.12608E-01 ppm1 7.098 ppm2 1.719 CV 1 ASSI { 125} (( segid " " and resid 148 and name HG* )) ( segid " " and resid 48 and name HD* ) 3.300 1.400 1.400 peak 125 weight 0.10000E+01 volume 0.54817E-02 ppm1 7.094 ppm2 1.262 CV 1 ASSI { 126} (( segid " " and resid 47 and name HB* )) ( segid " " and resid 48 and name HD* ) 4.000 2.000 2.000 peak 126 weight 0.10000E+01 volume 0.10985E-01 ppm1 7.101 ppm2 3.135 CV 1 ASSI { 130} ( segid " " and resid 48 and name HE* ) ( segid " " and resid 48 and name HD* ) 2.000 0.500 0.500 peak 130 weight 0.10000E+01 volume 0.84757E-01 ppm1 7.099 ppm2 7.330 CV 1 ASSI { 132} (( segid " " and resid 68 and name HB )) ( segid " " and resid 48 and name HD* ) 3.300 1.400 1.400 peak 132 weight 0.10000E+01 volume 0.55661E-02 ppm1 7.087 ppm2 1.835 CV 1 ASSI { 135} ( segid " " and resid 63 and name HG2*) ( segid " " and resid 48 and name HD* ) 2.900 1.100 1.100 peak 135 weight 0.10000E+01 volume 0.22981E-01 ppm1 7.101 ppm2 0.767 CV 1 ASSI { 151} ( segid " " and resid 13 and name HG1*) ( segid " " and resid 11 and name HE* ) 2.800 1.000 1.000 peak 151 weight 0.10000E+01 volume 0.12756E-01 ppm1 6.806 ppm2 0.552 CV 1 ASSI { 152} (( segid " " and resid 104 and name HG1*)) ( segid " " and resid 11 and name HE* ) 2.900 1.100 1.100 peak 152 weight 0.10000E+01 volume 0.30783E-01 ppm1 6.806 ppm2 0.779 CV 1 ASSI { 153} ( segid " " and resid 24 and name HB* ) ( segid " " and resid 11 and name HE* ) 2.700 2.700 3.300 peak 153 weight 0.10000E+01 volume 0.33523E-01 ppm1 6.803 ppm2 0.893 CV 1 ASSI { 156} (( segid " " and resid 108 and name HG* )) ( segid " " and resid 135 and name HD* ) 3.100 1.200 1.200 peak 156 weight 0.10000E+01 volume 0.70210E-02 ppm1 6.743 ppm2 2.470 CV 1 ASSI { 157} ( segid " " and resid 25 and name HD* ) ( segid " " and resid 135 and name HD* ) 4.000 2.000 2.000 peak 157 weight 0.10000E+01 volume 0.37530E-02 ppm1 6.740 ppm2 7.213 CV 1 ASSI { 161} ( segid " " and resid 126 and name HG1*) ( segid " " and resid 135 and name HD* ) 3.600 1.600 1.600 peak 161 weight 0.10000E+01 volume 0.98039E-02 ppm1 6.735 ppm2 0.652 CV 1 OR { 161} ( segid " " and resid 126 and name HG2*) ( segid " " and resid 135 and name HD* ) ASSI { 162} (( segid " " and resid 104 and name HB )) ( segid " " and resid 135 and name HD* ) 3.900 1.900 1.900 peak 162 weight 0.10000E+01 volume 0.33312E-02 ppm1 6.737 ppm2 1.442 CV 1 ASSI { 165} ( segid " " and resid 23 and name HD2*) ( segid " " and resid 16 and name HE* ) 2.400 0.700 0.700 peak 165 weight 0.10000E+01 volume 0.16762E-01 ppm1 6.548 ppm2 0.602 CV 1 ASSI { 166} (( segid " " and resid 82 and name HG1*)) ( segid " " and resid 25 and name HE* ) 4.300 2.300 1.700 peak 166 weight 0.10000E+01 volume 0.26356E-02 ppm1 6.600 ppm2 1.462 CV 1 ASSI { 167} ( segid " " and resid 65 and name HD1*) ( segid " " and resid 25 and name HE* ) 2.300 0.700 0.700 peak 167 weight 0.10000E+01 volume 0.22981E-01 ppm1 6.600 ppm2 0.746 CV 1 ASSI { 169} ( segid " " and resid 135 and name HE* ) ( segid " " and resid 11 and name HE* ) 2.900 1.100 1.100 peak 169 weight 0.10000E+01 volume 0.87500E-02 ppm1 6.809 ppm2 6.542 CV 1 ASSI { 172} ( segid " " and resid 16 and name HD* ) ( segid " " and resid 25 and name HE* ) 2.900 2.900 3.100 peak 172 weight 0.10000E+01 volume 0.27197E-01 ppm1 6.597 ppm2 6.737 CV 1 ASSI { 187} ( segid " " and resid 95 and name HG2*) ( segid " " and resid 16 and name HD* ) 2.800 1.000 1.000 peak 187 weight 0.10000E+01 volume 0.67891E-02 ppm1 6.770 ppm2 0.466 CV 1 ASSI { 189} ( segid " " and resid 138 and name HD1*) ( segid " " and resid 25 and name HD* ) 3.700 1.700 1.700 peak 189 weight 0.10000E+01 volume 0.22349E-02 ppm1 7.192 ppm2 0.109 CV 1 ASSI { 193} (( segid " " and resid 109 and name HG )) ( segid " " and resid 135 and name HE* ) 3.600 1.600 1.600 peak 193 weight 0.10000E+01 volume 0.10563E-02 ppm1 6.535 ppm2 1.681 CV 1 OR { 193} (( segid " " and resid 109 and name HB* )) ( segid " " and resid 135 and name HE* ) ASSI { 196} ( segid " " and resid 141 and name HD1*) ( segid " " and resid 25 and name HE* ) 2.300 0.600 0.600 peak 196 weight 0.10000E+01 volume 0.36896E-01 ppm1 6.594 ppm2 0.909 CV 1 OR { 196} ( segid " " and resid 141 and name HG2*) ( segid " " and resid 25 and name HE* ) ASSI { 207} (( segid " " and resid 117 and name HB* )) ( segid " " and resid 135 and name HD* ) 3.400 3.400 2.600 peak 207 weight 0.10000E+01 volume 0.49337E-02 ppm1 6.762 ppm2 1.207 CV 1 !Ambiguos restraints ASSI { 26} (( segid " " and resid 86 and name HB )) ( segid " " and resid 142 and name HD1%) 4.600 2.700 1.400 peak 26 weight 0.10000E+01 volume 0.13339E-02 ppm1 0.735 ppm2 4.321 CV 1 OR { 26} (( segid " " and resid 139 and name HA )) ( segid " " and resid 142 and name HD1%) ASSI { 33} ( segid " " and resid 68 and name HD1%) ( segid " " and resid 142 and name HD1%) 3.800 1.800 1.800 peak 33 weight 0.10000E+01 volume 0.56804E-02 ppm1 0.737 ppm2 0.535 CV 1 OR { 33} ( segid " " and resid 136 and name HD2%) ( segid " " and resid 142 and name HD1%) ASSI { 49} ( segid " " and resid 142 and name HD1%) ( segid " " and resid 138 and name HD1%) 2.600 0.900 0.900 peak 49 weight 0.10000E+01 volume 0.13491E-01 ppm1 0.072 ppm2 0.765 CV 1 OR { 49} ( segid " " and resid 65 and name HD1%) ( segid " " and resid 138 and name HD1%) ASSI { 88} (( segid " " and resid 103 and name HA )) ( segid " " and resid 104 and name HD1%) 6.000 6.000 0.000 peak 88 weight 0.10000E+01 volume 0.13086E-03 ppm1 0.297 ppm2 4.923 CV 1 OR { 88} (( segid " " and resid 132 and name HA )) ( segid " " and resid 104 and name HD1%) ASSI { 103} (( segid " " and resid 140 and name HA )) ( segid " " and resid 141 and name HD1%) 5.000 3.100 1.000 peak 103 weight 0.10000E+01 volume 0.95859E-03 ppm1 0.900 ppm2 4.112 CV 1 OR { 103} (( segid " " and resid 69 and name HA )) ( segid " " and resid 141 and name HD1%) ASSI { 114} (( segid " " and resid 144 and name HB* )) ( segid " " and resid 141 and name HD1%) 4.200 2.200 1.800 peak 114 weight 0.10000E+01 volume 0.17650E-02 ppm1 0.913 ppm2 2.153 CV 1 OR { 114} (( segid " " and resid 143 and name HB* )) ( segid " " and resid 141 and name HD1%) ASSI { 115} ( segid " " and resid 93 and name HD% ) ( segid " " and resid 71 and name HD1%) 5.200 3.400 0.800 peak 115 weight 0.10000E+01 volume 0.10093E-02 ppm1 0.875 ppm2 7.205 CV 1 OR { 115} ( segid " " and resid 118 and name HD% ) ( segid " " and resid 71 and name HD1%) ASSI { 126} ( segid " " and resid 23 and name HD1%) ( segid " " and resid 71 and name HD1%) 2.800 1.000 1.000 peak 126 weight 0.10000E+01 volume 0.14861E-01 ppm1 0.873 ppm2 0.608 CV 1 OR { 126} ( segid " " and resid 69 and name HD2%) ( segid " " and resid 71 and name HD1%) ASSI { 134} (( segid " " and resid 61 and name HG* )) ( segid " " and resid 145 and name HD1%) 3.700 1.700 1.700 peak 134 weight 0.10000E+01 volume 0.37278E-02 ppm1 0.856 ppm2 1.731 CV 1 OR { 134} (( segid " " and resid 140 and name HB* )) ( segid " " and resid 145 and name HD1%) OR { 134} (( segid " " and resid 60 and name HB )) ( segid " " and resid 145 and name HD1%) ASSI { 138} ( segid " " and resid 48 and name HD% ) ( segid " " and resid 68 and name HD1%) 6.000 6.000 0.000 peak 138 weight 0.10000E+01 volume 0.33170E-04 ppm1 0.538 ppm2 7.078 CV 1 OR { 138} (( segid " " and resid 68 and name HN )) ( segid " " and resid 68 and name HD1%) ASSI { 147} (( segid " " and resid 148 and name HD* )) ( segid " " and resid 68 and name HD1%) 3.000 1.200 1.200 peak 147 weight 0.10000E+01 volume 0.54776E-02 ppm1 0.535 ppm2 1.708 CV 1 OR { 147} (( segid " " and resid 69 and name HB* )) ( segid " " and resid 68 and name HD1%) ASSI { 149} ( segid " " and resid 141 and name HG2%) ( segid " " and resid 68 and name HD1%) 2.800 1.000 1.000 peak 149 weight 0.10000E+01 volume 0.31496E-01 ppm1 0.535 ppm2 0.874 CV 1 OR { 149} ( segid " " and resid 145 and name HG2%) ( segid " " and resid 68 and name HD1%) ASSI { 293} ( segid " " and resid 16 and name HE% ) ( segid " " and resid 95 and name HG2%) 4.500 2.600 1.500 peak 293 weight 0.10000E+01 volume 0.10093E-02 ppm1 0.571 ppm2 6.574 CV 1 OR { 293} ( segid " " and resid 25 and name HE% ) ( segid " " and resid 95 and name HG2%) ASSI { 326} ( segid " " and resid 145 and name HG2%) ( segid " " and resid 91 and name HG1%) 2.700 0.900 0.900 peak 326 weight 0.10000E+01 volume 0.29111E-01 ppm1 0.500 ppm2 0.872 CV 1 OR { 326} ( segid " " and resid 141 and name HG2%) ( segid " " and resid 91 and name HG1%) ASSI { 327} ( segid " " and resid 142 and name HD1%) ( segid " " and resid 91 and name HG1%) 2.800 1.000 1.000 peak 327 weight 0.10000E+01 volume 0.23128E-01 ppm1 0.500 ppm2 0.757 CV 1 OR { 327} ( segid " " and resid 65 and name HD1%) ( segid " " and resid 91 and name HG1%) ASSI { 362} (( segid " " and resid 99 and name HB* )) ( segid " " and resid 22 and name HB% ) 4.000 2.000 2.000 peak 362 weight 0.10000E+01 volume 0.14759E-02 ppm1 1.268 ppm2 1.855 CV 1 OR { 362} (( segid " " and resid 17 and name HB* )) ( segid " " and resid 22 and name HB% ) ASSI { 393} (( segid " " and resid 142 and name HB )) ( segid " " and resid 86 and name HG2%) 2.700 0.900 0.900 peak 393 weight 0.10000E+01 volume 0.11919E-01 ppm1 1.103 ppm2 2.042 CV 1 OR { 393} (( segid " " and resid 89 and name HB )) ( segid " " and resid 86 and name HG2%) ASSI { 399} ( segid " " and resid 91 and name HG1%) ( segid " " and resid 86 and name HG2%) 4.300 2.400 1.700 peak 399 weight 0.10000E+01 volume 0.22063E-02 ppm1 1.106 ppm2 0.520 CV 1 OR { 399} ( segid " " and resid 136 and name HD2%) ( segid " " and resid 86 and name HG2%) ASSI { 551} ( segid " " and resid 23 and name HD1%) ( segid " " and resid 18 and name HG2%) 3.200 1.300 1.300 peak 551 weight 0.10000E+01 volume 0.14353E-01 ppm1 1.016 ppm2 0.610 CV 1 OR { 551} ( segid " " and resid 69 and name HD2%) ( segid " " and resid 18 and name HG2%) ASSI { 558} (( segid " " and resid 95 and name HB )) ( segid " " and resid 18 and name HG2%) 3.800 1.800 1.800 peak 558 weight 0.10000E+01 volume 0.11970E-02 ppm1 1.016 ppm2 2.238 CV 1 OR { 558} (( segid " " and resid 20 and name HB* )) ( segid " " and resid 18 and name HG2%) ASSI { 594} (( segid " " and resid 70 and name HA* )) ( segid " " and resid 66 and name HB% ) 4.800 2.900 1.200 peak 594 weight 0.10000E+01 volume 0.79628E-03 ppm1 1.499 ppm2 4.134 CV 1 OR { 594} (( segid " " and resid 69 and name HA )) ( segid " " and resid 66 and name HB% ) ASSI { 744} ( segid " " and resid 81 and name HG2%) ( segid " " and resid 83 and name HG2%) 2.300 0.700 0.700 peak 744 weight 0.10000E+01 volume 0.25258E-01 ppm1 0.754 ppm2 0.527 CV 1 OR { 744} ( segid " " and resid 81 and name HG2%) ( segid " " and resid 83 and name HG1%) OR { 744} ( segid " " and resid 91 and name HG1%) ( segid " " and resid 83 and name HG1%) ASSI { 906} ( segid " " and resid 24 and name HB% ) (( segid " " and resid 134 and name HA )) 4.700 2.800 1.300 peak 906 weight 0.10000E+01 volume 0.91801E-03 ppm1 4.104 ppm2 0.876 CV 1 OR { 906} ( segid " " and resid 71 and name HD1%) (( segid " " and resid 134 and name HA )) ASSI { 1057} (( segid " " and resid 103 and name HA )) ( segid " " and resid 13 and name HG1%) 4.000 2.000 2.000 peak 1057 weight 0.10000E+01 volume 0.20592E-02 ppm1 0.468 ppm2 4.926 CV 1 OR { 1057} (( segid " " and resid 101 and name HA )) ( segid " " and resid 13 and name HG1%) ASSI { 1261} ( segid " " and resid 8 and name HD2%) ( segid " " and resid 7 and name HB% ) 3.400 1.500 1.500 peak 1261 weight 0.10000E+01 volume 0.73035E-03 ppm1 1.408 ppm2 0.923 CV 1 OR { 1261} ( segid " " and resid 4 and name HD1%) ( segid " " and resid 5 and name HB% ) ASSI { 1337} ( segid " " and resid 23 and name HD1%) (( segid " " and resid 134 and name HB )) 3.200 1.300 1.300 peak 1337 weight 0.10000E+01 volume 0.10296E-01 ppm1 1.777 ppm2 0.607 CV 1 OR { 1337} ( segid " " and resid 69 and name HD2%) (( segid " " and resid 134 and name HB )) ASSI { 1407} (( segid " " and resid 78 and name HA )) (( segid " " and resid 97 and name HB* )) 4.500 2.600 1.500 peak 1407 weight 0.10000E+01 volume 0.13948E-02 ppm1 2.125 ppm2 4.656 CV 1 OR { 1407} (( segid " " and resid 79 and name HA )) (( segid " " and resid 97 and name HB* )) ASSI { 1559} (( segid " " and resid 79 and name HB* )) ( segid " " and resid 95 and name HG2%) 4.100 2.100 1.900 peak 1559 weight 0.10000E+01 volume 0.23736E-02 ppm1 0.574 ppm2 1.992 CV 1 OR { 1559} (( segid " " and resid 77 and name HB* )) ( segid " " and resid 95 and name HG2%) ASSI { 1564} ( segid " " and resid 126 and name HG1%) (( segid " " and resid 134 and name HA )) 3.500 1.500 1.500 peak 1564 weight 0.10000E+01 volume 0.53254E-02 ppm1 4.088 ppm2 0.605 CV 1 OR { 1564} ( segid " " and resid 69 and name HD2%) (( segid " " and resid 134 and name HA )) ASSI { 1635} ( segid " " and resid 81 and name HD1%) (( segid " " and resid 50 and name HG* )) 5.400 3.700 0.600 peak 1635 weight 0.10000E+01 volume 0.35502E-03 ppm1 1.493 ppm2 0.724 CV 1 OR { 1635} ( segid " " and resid 52 and name HG1%) (( segid " " and resid 50 and name HG* )) ASSI { 1649} (( segid " " and resid 14 and name HG )) ( segid " " and resid 95 and name HG2%) 4.300 2.300 1.700 peak 1649 weight 0.10000E+01 volume 0.26678E-02 ppm1 0.574 ppm2 1.432 CV 1 OR { 1649} (( segid " " and resid 23 and name HB* )) ( segid " " and resid 95 and name HG2%) ASSI { 1898} (( segid " " and resid 99 and name HG )) ( segid " " and resid 133 and name HD1%) 3.400 1.500 1.500 peak 1898 weight 0.10000E+01 volume 0.25765E-02 ppm1 0.505 ppm2 1.427 CV 1 OR { 1898} (( segid " " and resid 23 and name HB* )) ( segid " " and resid 133 and name HD1%) ASSI { 2151} (( segid " " and resid 94 and name HB* )) ( segid " " and resid 95 and name HG2%) 4.300 2.400 1.700 peak 2151 weight 0.10000E+01 volume 0.28959E-02 ppm1 0.578 ppm2 1.494 CV 1 OR { 2151} ( segid " " and resid 66 and name HB% ) ( segid " " and resid 95 and name HG2%) ASSI { 151} (( segid " " and resid 139 and name HN )) (( segid " " and resid 140 and name HB* )) 3.700 1.800 1.800 peak 151 weight 0.10000E+01 volume 0.38348E-02 ppm1 1.734 ppm2 7.802 CV 1 OR { 151} (( segid " " and resid 121 and name HN )) (( segid " " and resid 140 and name HB* )) ASSI { 345} (( segid " " and resid 89 and name HA )) (( segid " " and resid 89 and name HB )) 2.900 1.100 1.100 peak 345 weight 0.10000E+01 volume 0.93233E-02 ppm1 2.065 ppm2 4.348 CV 1 OR { 345} (( segid " " and resid 86 and name HB )) (( segid " " and resid 89 and name HB )) ASSI { 461} ( segid " " and resid 52 and name HG2%) (( segid " " and resid 40 and name HB )) 2.400 0.700 0.700 peak 461 weight 0.10000E+01 volume 0.17043E-01 ppm1 4.079 ppm2 0.662 CV 1 OR { 461} ( segid " " and resid 39 and name HG2%) (( segid " " and resid 40 and name HB )) ASSI { 552} (( segid " " and resid 84 and name HN )) ( segid " " and resid 84 and name HB% ) 2.600 0.900 0.900 peak 552 weight 0.10000E+01 volume 0.16128E-01 ppm1 1.185 ppm2 9.382 CV 1 OR { 552} (( segid " " and resid 31 and name HN )) ( segid " " and resid 84 and name HB% ) ASSI { 900} ( segid " " and resid 23 and name HD1%) (( segid " " and resid 66 and name HA )) 3.400 1.500 1.500 peak 900 weight 0.10000E+01 volume 0.39107E-02 ppm1 3.827 ppm2 0.615 CV 1 OR { 900} ( segid " " and resid 69 and name HD1%) (( segid " " and resid 66 and name HA )) ASSI { 1107} (( segid " " and resid 53 and name HA )) ( segid " " and resid 52 and name HG2%) 3.200 1.200 1.200 peak 1107 weight 0.10000E+01 volume 0.62777E-02 ppm1 0.657 ppm2 4.710 CV 1 OR { 1107} (( segid " " and resid 40 and name HA )) ( segid " " and resid 52 and name HG2%) ASSI { 1153} (( segid " " and resid 67 and name HG* )) (( segid " " and resid 68 and name HN )) 3.500 1.500 1.500 peak 1153 weight 0.10000E+01 volume 0.49009E-02 ppm1 7.082 ppm2 1.525 CV 1 OR { 1153} (( segid " " and resid 65 and name HG )) (( segid " " and resid 68 and name HN )) OR { 1153} ( segid " " and resid 66 and name HB% ) (( segid " " and resid 68 and name HN )) ASSI { 1159} (( segid " " and resid 65 and name HG )) (( segid " " and resid 69 and name HN )) 3.300 1.300 1.300 peak 1159 weight 0.10000E+01 volume 0.87629E-02 ppm1 7.648 ppm2 1.514 CV 1 OR { 1159} ( segid " " and resid 69 and name HD2%) (( segid " " and resid 69 and name HN )) ASSI { 1166} ( segid " " and resid 59 and name HG2%) (( segid " " and resid 53 and name HN )) 2.800 1.000 1.000 peak 1166 weight 0.10000E+01 volume 0.18524E-01 ppm1 8.545 ppm2 0.728 CV 1 OR { 1166} ( segid " " and resid 52 and name HG1%) (( segid " " and resid 53 and name HN )) ASSI { 1306} (( segid " " and resid 65 and name HG )) (( segid " " and resid 70 and name HN )) 3.700 1.700 1.700 peak 1306 weight 0.10000E+01 volume 0.52211E-02 ppm1 7.978 ppm2 1.538 CV 1 OR { 1306} (( segid " " and resid 67 and name HG* )) (( segid " " and resid 70 and name HN )) ASSI { 1375} (( segid " " and resid 75 and name HA )) (( segid " " and resid 78 and name HN )) 3.300 1.300 1.300 peak 1375 weight 0.10000E+01 volume 0.37613E-02 ppm1 7.234 ppm2 4.187 CV 1 OR { 1375} (( segid " " and resid 76 and name HA )) (( segid " " and resid 78 and name HN )) ASSI { 1426} (( segid " " and resid 87 and name HD* )) (( segid " " and resid 87 and name HN )) 3.200 1.300 1.300 peak 1426 weight 0.10000E+01 volume 0.80564E-02 ppm1 8.768 ppm2 1.691 CV 1 OR { 1426} (( segid " " and resid 85 and name HB* )) (( segid " " and resid 87 and name HN )) ASSI { 1469} (( segid " " and resid 10 and name HA )) (( segid " " and resid 11 and name HN )) 2.000 0.500 0.500 peak 1469 weight 0.10000E+01 volume 0.43302E-01 ppm1 8.929 ppm2 4.952 CV 1 OR { 1469} (( segid " " and resid 11 and name HA )) (( segid " " and resid 11 and name HN )) ASSI { 1616} ( segid " " and resid 52 and name HG1%) (( segid " " and resid 62 and name HN )) 2.800 1.000 1.000 peak 1616 weight 0.10000E+01 volume 0.16473E-01 ppm1 8.787 ppm2 0.742 CV 1 OR { 1616} ( segid " " and resid 63 and name HG2%) (( segid " " and resid 62 and name HN )) ASSI { 1721} (( segid " " and resid 102 and name HB* )) (( segid " " and resid 15 and name HN )) 3.000 1.100 1.100 peak 1721 weight 0.10000E+01 volume 0.63117E-02 ppm1 8.925 ppm2 1.413 CV 1 OR { 1721} (( segid " " and resid 14 and name HG )) (( segid " " and resid 15 and name HN )) ASSI { 1859} (( segid " " and resid 78 and name HA )) (( segid " " and resid 79 and name HN )) 2.300 0.600 0.600 peak 1859 weight 0.10000E+01 volume 0.18010E-01 ppm1 7.842 ppm2 4.680 CV 1 OR { 1859} (( segid " " and resid 79 and name HA )) (( segid " " and resid 79 and name HN )) ASSI { 1894} (( segid " " and resid 120 and name HA )) (( segid " " and resid 121 and name HN )) 3.100 1.200 1.200 peak 1894 weight 0.10000E+01 volume 0.56886E-02 ppm1 7.821 ppm2 4.382 CV 1 OR { 1894} (( segid " " and resid 123 and name HA )) (( segid " " and resid 118 and name HN )) ASSI { 1920} ( segid " " and resid 69 and name HD1%) (( segid " " and resid 124 and name HN )) 3.900 1.900 1.900 peak 1920 weight 0.10000E+01 volume 0.28606E-02 ppm1 7.846 ppm2 0.602 CV 1 OR { 1920} ( segid " " and resid 126 and name HG1%) (( segid " " and resid 124 and name HN )) OR { 1920} ( segid " " and resid 23 and name HD1%) (( segid " " and resid 124 and name HN )) ASSI { 1972} ( segid " " and resid 24 and name HB% ) (( segid " " and resid 135 and name HN )) 3.500 1.500 1.500 peak 1972 weight 0.10000E+01 volume 0.64408E-02 ppm1 8.555 ppm2 0.901 CV 1 OR { 1972} ( segid " " and resid 125 and name HD2%) (( segid " " and resid 135 and name HN )) OR { 1972} ( segid " " and resid 125 and name HD1%) (( segid " " and resid 135 and name HN )) ASSI { 1983} ( segid " " and resid 138 and name HG2%) (( segid " " and resid 140 and name HN )) 4.000 2.000 2.000 peak 1983 weight 0.10000E+01 volume 0.54786E-02 ppm1 7.587 ppm2 0.908 CV 1 OR { 1983} ( segid " " and resid 141 and name HD1%) (( segid " " and resid 140 and name HN )) ASSI { 1993} (( segid " " and resid 143 and name HB* )) (( segid " " and resid 144 and name HN )) 2.200 0.600 0.600 peak 1993 weight 0.10000E+01 volume 0.38774E-01 ppm1 7.542 ppm2 2.172 CV 1 OR { 1993} (( segid " " and resid 144 and name HB* )) (( segid " " and resid 144 and name HN )) ASSI { 2257} ( segid " " and resid 89 and name HG1%) (( segid " " and resid 91 and name HB )) 3.400 1.400 1.400 peak 2257 weight 0.10000E+01 volume 0.79997E-02 ppm1 1.601 ppm2 0.781 CV 1 OR { 2257} ( segid " " and resid 65 and name HD1%) (( segid " " and resid 91 and name HB )) ASSI { 2527} ( segid " " and resid 82 and name HD1%) ( segid " " and resid 30 and name HD1%) 2.400 0.700 0.700 peak 2527 weight 0.10000E+01 volume 0.72638E-02 ppm1 0.683 ppm2 0.065 CV 1 OR { 2527} ( segid " " and resid 138 and name HD1%) ( segid " " and resid 30 and name HD1%) ASSI { 2807} (( segid " " and resid 128 and name HB )) ( segid " " and resid 133 and name HD1%) 3.100 1.200 1.200 peak 2807 weight 0.10000E+01 volume 0.84501E-02 ppm1 0.520 ppm2 4.051 CV 1 OR { 2807} (( segid " " and resid 133 and name HA )) ( segid " " and resid 133 and name HD1%) ASSI { 3047} (( segid " " and resid 117 and name HN )) (( segid " " and resid 116 and name HB* )) 3.200 1.300 1.300 peak 3047 weight 0.10000E+01 volume 0.80458E-02 ppm1 2.697 ppm2 7.864 CV 1 OR { 3047} (( segid " " and resid 29 and name HN )) (( segid " " and resid 28 and name HB* )) ASSI { 3268} ( segid " " and resid 52 and name HG2%) (( segid " " and resid 52 and name HN )) 2.600 0.900 0.900 peak 3268 weight 0.10000E+01 volume 0.22036E-01 ppm1 8.875 ppm2 0.668 CV 1 OR { 3268} ( segid " " and resid 39 and name HG2%) (( segid " " and resid 52 and name HN )) ASSI { 3} ( segid " " and resid 65 and name HD2%) ( segid " " and resid 73 and name HE% ) 3.600 1.600 1.600 peak 3 weight 0.10000E+01 volume 0.86024E-02 ppm1 6.981 ppm2 0.629 CV 1 OR { 3} ( segid " " and resid 23 and name HD2%) ( segid " " and resid 73 and name HE% ) ASSI { 4} ( segid " " and resid 94 and name HD2%) ( segid " " and resid 73 and name HE% ) 3.000 1.100 1.100 peak 4 weight 0.10000E+01 volume 0.92348E-02 ppm1 6.981 ppm2 0.741 CV 1 OR { 4} ( segid " " and resid 63 and name HG2%) ( segid " " and resid 73 and name HE% ) OR { 4} ( segid " " and resid 65 and name HD1%) ( segid " " and resid 73 and name HE% ) ASSI { 5} ( segid " " and resid 71 and name HD1%) ( segid " " and resid 73 and name HE% ) 3.100 1.200 1.200 peak 5 weight 0.10000E+01 volume 0.90872E-02 ppm1 6.983 ppm2 0.892 CV 1 OR { 5} ( segid " " and resid 63 and name HG1%) ( segid " " and resid 73 and name HE% ) ASSI { 6} (( segid " " and resid 67 and name HD* )) ( segid " " and resid 73 and name HE% ) 2.800 2.800 3.200 peak 6 weight 0.10000E+01 volume 0.82017E-02 ppm1 6.981 ppm2 1.734 CV 1 OR { 6} (( segid " " and resid 69 and name HB* )) ( segid " " and resid 73 and name HE% ) ASSI { 11} (( segid " " and resid 70 and name HA1 )) ( segid " " and resid 73 and name HE% ) 3.800 3.800 2.200 peak 11 weight 0.10000E+01 volume 0.43011E-02 ppm1 6.984 ppm2 4.109 CV 1 OR { 11} (( segid " " and resid 69 and name HA )) ( segid " " and resid 73 and name HE% ) ASSI { 18} (( segid " " and resid 104 and name HG1*)) ( segid " " and resid 135 and name HD% ) 2.900 1.100 1.100 peak 18 weight 0.10000E+01 volume 0.29096E-01 ppm1 6.740 ppm2 0.760 CV 1 OR { 18} (( segid " " and resid 23 and name HG )) ( segid " " and resid 135 and name HD% ) ASSI { 19} ( segid " " and resid 104 and name HG2%) ( segid " " and resid 135 and name HD% ) 3.200 1.300 1.300 peak 19 weight 0.10000E+01 volume 0.12714E-01 ppm1 6.740 ppm2 0.638 CV 1 OR { 19} ( segid " " and resid 126 and name HG1%) ( segid " " and resid 135 and name HD% ) ASSI { 21} ( segid " " and resid 104 and name HD1%) ( segid " " and resid 135 and name HD% ) 4.300 2.300 1.700 peak 21 weight 0.10000E+01 volume 0.31836E-02 ppm1 6.745 ppm2 0.315 CV 1 OR { 21} ( segid " " and resid 133 and name HG2%) ( segid " " and resid 135 and name HD% ) ASSI { 27} ( segid " " and resid 82 and name HD1%) ( segid " " and resid 16 and name HE% ) 3.300 1.400 1.400 peak 27 weight 0.10000E+01 volume 0.39427E-02 ppm1 6.596 ppm2 0.095 CV 1 OR { 27} ( segid " " and resid 138 and name HD1%) ( segid " " and resid 25 and name HE% ) ASSI { 33} ( segid " " and resid 104 and name HD1%) ( segid " " and resid 135 and name HE% ) 4.400 2.500 1.600 peak 33 weight 0.10000E+01 volume 0.29517E-02 ppm1 6.517 ppm2 0.321 CV 1 OR { 33} ( segid " " and resid 133 and name HG2%) ( segid " " and resid 135 and name HE% ) ASSI { 35} ( segid " " and resid 104 and name HG2%) ( segid " " and resid 135 and name HE% ) 3.300 1.400 1.400 peak 35 weight 0.10000E+01 volume 0.99938E-02 ppm1 6.531 ppm2 0.629 CV 1 OR { 35} ( segid " " and resid 126 and name HG1%) ( segid " " and resid 135 and name HE% ) ASSI { 36} ( segid " " and resid 109 and name HD1%) ( segid " " and resid 135 and name HE% ) 2.600 2.600 3.400 peak 36 weight 0.10000E+01 volume 0.15560E-01 ppm1 6.534 ppm2 0.760 CV 1 OR { 36} (( segid " " and resid 104 and name HG1*)) ( segid " " and resid 135 and name HE% ) ASSI { 39} (( segid " " and resid 106 and name HG2 )) ( segid " " and resid 135 and name HE% ) 2.700 2.700 3.300 peak 39 weight 0.10000E+01 volume 0.52921E-02 ppm1 6.526 ppm2 2.461 CV 1 OR { 39} (( segid " " and resid 108 and name HG* )) ( segid " " and resid 135 and name HE% ) ASSI { 42} (( segid " " and resid 135 and name HA )) ( segid " " and resid 135 and name HE% ) 3.900 1.900 1.900 peak 42 weight 0.10000E+01 volume 0.55240E-02 ppm1 6.523 ppm2 4.734 CV 1 OR { 42} (( segid " " and resid 136 and name HA )) ( segid " " and resid 135 and name HE% ) ASSI { 70} ( segid " " and resid 24 and name HB% ) ( segid " " and resid 11 and name HD% ) 2.300 2.300 3.700 peak 70 weight 0.10000E+01 volume 0.47229E-01 ppm1 7.050 ppm2 0.894 CV 1 OR { 70} ( segid " " and resid 109 and name HD2%) ( segid " " and resid 11 and name HD% ) ASSI { 71} ( segid " " and resid 105 and name HG2%) ( segid " " and resid 11 and name HD% ) 2.500 2.500 3.500 peak 71 weight 0.10000E+01 volume 0.10352E-01 ppm1 7.055 ppm2 1.205 CV 1 OR { 71} (( segid " " and resid 117 and name HB* )) ( segid " " and resid 11 and name HD% ) ASSI { 76} (( segid " " and resid 10 and name HB* )) ( segid " " and resid 11 and name HD% ) 3.400 3.400 2.600 peak 76 weight 0.10000E+01 volume 0.10816E-01 ppm1 7.052 ppm2 1.839 CV 1 OR { 76} (( segid " " and resid 126 and name HB )) ( segid " " and resid 11 and name HD% ) ASSI { 85} ( segid " " and resid 95 and name HG1%) ( segid " " and resid 16 and name HD% ) 3.200 1.300 1.300 peak 85 weight 0.10000E+01 volume 0.15033E-01 ppm1 6.775 ppm2 0.606 CV 1 OR { 85} ( segid " " and resid 23 and name HD2%) ( segid " " and resid 16 and name HD% ) ASSI { 86} ( segid " " and resid 14 and name HD2%) ( segid " " and resid 16 and name HD% ) 3.000 1.100 1.100 peak 86 weight 0.10000E+01 volume 0.12440E-01 ppm1 6.764 ppm2 0.957 CV 1 OR { 86} ( segid " " and resid 98 and name HG1%) ( segid " " and resid 16 and name HD% ) ASSI { 91} (( segid " " and resid 67 and name HA )) ( segid " " and resid 73 and name HD% ) 3.700 1.700 1.700 peak 91 weight 0.10000E+01 volume 0.30783E-02 ppm1 7.243 ppm2 4.193 CV 1 OR { 91} (( segid " " and resid 75 and name HA )) ( segid " " and resid 73 and name HD% ) ASSI { 92} (( segid " " and resid 16 and name HB* )) ( segid " " and resid 93 and name HD% ) 3.100 3.100 2.900 peak 92 weight 0.10000E+01 volume 0.13409E-01 ppm1 7.248 ppm2 3.126 CV 1 OR { 92} (( segid " " and resid 16 and name HB* )) ( segid " " and resid 73 and name HD% ) ASSI { 95} (( segid " " and resid 75 and name HB* )) ( segid " " and resid 73 and name HD% ) 4.100 2.100 1.900 peak 95 weight 0.10000E+01 volume 0.42802E-02 ppm1 7.232 ppm2 2.256 CV 1 OR { 95} (( segid " " and resid 95 and name HB )) ( segid " " and resid 93 and name HD% ) OR { 95} (( segid " " and resid 71 and name HB )) ( segid " " and resid 73 and name HD% ) ASSI { 96} (( segid " " and resid 63 and name HB )) ( segid " " and resid 93 and name HD% ) 3.600 1.600 1.600 peak 96 weight 0.10000E+01 volume 0.55872E-02 ppm1 7.237 ppm2 2.000 CV 1 OR { 96} (( segid " " and resid 77 and name HB* )) ( segid " " and resid 73 and name HD% ) ASSI { 97} ( segid " " and resid 66 and name HB% ) ( segid " " and resid 73 and name HD% ) 2.600 0.900 0.900 peak 97 weight 0.10000E+01 volume 0.16551E-01 ppm1 7.237 ppm2 1.511 CV 1 OR { 97} (( segid " " and resid 94 and name HB* )) ( segid " " and resid 93 and name HD% ) OR { 97} ( segid " " and resid 66 and name HB% ) ( segid " " and resid 93 and name HD% ) ASSI { 98} ( segid " " and resid 18 and name HD1%) ( segid " " and resid 73 and name HD% ) 3.800 1.800 1.800 peak 98 weight 0.10000E+01 volume 0.49758E-02 ppm1 7.248 ppm2 1.130 CV 1 OR { 98} ( segid " " and resid 18 and name HD1%) ( segid " " and resid 93 and name HD% ) ASSI { 104} (( segid " " and resid 134 and name HA )) ( segid " " and resid 118 and name HD% ) 3.900 1.900 1.900 peak 104 weight 0.10000E+01 volume 0.32680E-02 ppm1 7.191 ppm2 4.076 CV 1 OR { 104} (( segid " " and resid 121 and name HA )) ( segid " " and resid 118 and name HD% ) OR { 104} (( segid " " and resid 117 and name HA )) ( segid " " and resid 118 and name HD% ) ASSI { 105} (( segid " " and resid 134 and name HA )) ( segid " " and resid 118 and name HE% ) 3.800 1.800 1.800 peak 105 weight 0.10000E+01 volume 0.45542E-02 ppm1 7.258 ppm2 4.073 CV 1 OR { 105} (( segid " " and resid 121 and name HA )) ( segid " " and resid 118 and name HE% ) ASSI { 110} (( segid " " and resid 25 and name HB* )) ( segid " " and resid 25 and name HD% ) 2.800 1.000 1.000 peak 110 weight 0.10000E+01 volume 0.11934E-01 ppm1 7.183 ppm2 2.858 CV 1 OR { 110} (( segid " " and resid 118 and name HB* )) ( segid " " and resid 118 and name HD% ) ASSI { 112} (( segid " " and resid 14 and name HG )) ( segid " " and resid 25 and name HD% ) 3.600 1.600 1.600 peak 112 weight 0.10000E+01 volume 0.99515E-02 ppm1 7.193 ppm2 1.443 CV 1 OR { 112} (( segid " " and resid 23 and name HB* )) ( segid " " and resid 25 and name HD% ) ASSI { 114} (( segid " " and resid 69 and name HB* )) ( segid " " and resid 118 and name HD% ) 3.000 3.000 3.000 peak 114 weight 0.10000E+01 volume 0.16045E-01 ppm1 7.193 ppm2 1.676 CV 1 OR { 114} (( segid " " and resid 82 and name HB )) ( segid " " and resid 25 and name HD% ) OR { 114} (( segid " " and resid 18 and name HB )) ( segid " " and resid 25 and name HD% ) ASSI { 116} ( segid " " and resid 141 and name HD1%) ( segid " " and resid 25 and name HD% ) 2.500 0.800 0.800 peak 116 weight 0.10000E+01 volume 0.30783E-01 ppm1 7.191 ppm2 0.930 CV 1 OR { 116} (( segid " " and resid 69 and name HG )) ( segid " " and resid 118 and name HD% ) OR { 116} ( segid " " and resid 125 and name HD1%) ( segid " " and resid 118 and name HD% ) ASSI { 118} ( segid " " and resid 23 and name HD2%) ( segid " " and resid 25 and name HD% ) 2.900 1.000 1.000 peak 118 weight 0.10000E+01 volume 0.31627E-01 ppm1 7.191 ppm2 0.602 CV 1 OR { 118} ( segid " " and resid 69 and name HD1%) ( segid " " and resid 118 and name HD% ) ASSI { 120} ( segid " " and resid 84 and name HB% ) ( segid " " and resid 25 and name HD% ) 3.200 1.300 1.300 peak 120 weight 0.10000E+01 volume 0.12102E-01 ppm1 7.190 ppm2 1.205 CV 1 OR { 120} (( segid " " and resid 117 and name HB* )) ( segid " " and resid 118 and name HD% ) ASSI { 121} (( segid " " and resid 141 and name HG1*)) ( segid " " and resid 25 and name HD% ) 4.400 2.400 1.600 peak 121 weight 0.10000E+01 volume 0.34999E-02 ppm1 7.189 ppm2 1.904 CV 1 OR { 121} (( segid " " and resid 65 and name HB* )) ( segid " " and resid 25 and name HD% ) ASSI { 129} (( segid " " and resid 145 and name HA )) ( segid " " and resid 48 and name HD% ) 3.900 1.900 1.900 peak 129 weight 0.10000E+01 volume 0.41114E-02 ppm1 7.094 ppm2 4.175 CV 1 OR { 129} (( segid " " and resid 49 and name HA )) ( segid " " and resid 48 and name HD% ) ASSI { 131} (( segid " " and resid 67 and name HG* )) ( segid " " and resid 48 and name HD% ) 4.000 2.000 2.000 peak 131 weight 0.10000E+01 volume 0.40482E-02 ppm1 7.092 ppm2 1.508 CV 1 OR { 131} (( segid " " and resid 50 and name HG* )) ( segid " " and resid 48 and name HD% ) ASSI { 133} (( segid " " and resid 65 and name HB* )) ( segid " " and resid 48 and name HD% ) 3.500 3.500 2.500 peak 133 weight 0.10000E+01 volume 0.67468E-02 ppm1 7.092 ppm2 1.943 CV 1 OR { 133} (( segid " " and resid 141 and name HG1*)) ( segid " " and resid 48 and name HD% ) ASSI { 136} (( segid " " and resid 121 and name HG* )) ( segid " " and resid 118 and name HE% ) 3.800 1.800 1.800 peak 136 weight 0.10000E+01 volume 0.36264E-02 ppm1 7.258 ppm2 1.222 CV 1 OR { 136} (( segid " " and resid 117 and name HB* )) ( segid " " and resid 118 and name HE% ) ASSI { 158} ( segid " " and resid 27 and name HG1%) ( segid " " and resid 135 and name HD% ) 2.600 2.600 3.400 peak 158 weight 0.10000E+01 volume 0.99095E-02 ppm1 6.743 ppm2 1.036 CV 1 OR { 158} ( segid " " and resid 27 and name HG2%) ( segid " " and resid 135 and name HD% ) OR { 158} ( segid " " and resid 18 and name HG2%) ( segid " " and resid 135 and name HD% ) ASSI { 160} (( segid " " and resid 109 and name HG )) ( segid " " and resid 135 and name HD% ) 2.900 2.900 3.100 peak 160 weight 0.10000E+01 volume 0.50601E-02 ppm1 6.743 ppm2 1.705 CV 1 OR { 160} (( segid " " and resid 109 and name HB* )) ( segid " " and resid 135 and name HD% ) OR { 160} (( segid " " and resid 69 and name HB* )) ( segid " " and resid 135 and name HD% ) OR { 160} (( segid " " and resid 132 and name HB* )) ( segid " " and resid 135 and name HD% ) OR { 160} (( segid " " and resid 131 and name HB* )) ( segid " " and resid 135 and name HD% ) ASSI { 164} ( segid " " and resid 141 and name HD1%) ( segid " " and resid 25 and name HE% ) 2.800 1.000 1.000 peak 164 weight 0.10000E+01 volume 0.11153E-01 ppm1 6.553 ppm2 0.894 CV 1 OR { 164} ( segid " " and resid 141 and name HG2%) ( segid " " and resid 25 and name HE% ) OR { 164} ( segid " " and resid 71 and name HD1%) ( segid " " and resid 16 and name HE% ) ASSI { 171} ( segid " " and resid 25 and name HD% ) ( segid " " and resid 25 and name HE% ) 2.500 0.800 0.800 peak 171 weight 0.10000E+01 volume 0.17015E-01 ppm1 6.599 ppm2 7.191 CV 1 OR { 171} ( segid " " and resid 93 and name HD% ) ( segid " " and resid 25 and name HE% ) ASSI { 175} (( segid " " and resid 15 and name HA )) ( segid " " and resid 16 and name HE% ) 4.300 2.300 1.700 peak 175 weight 0.10000E+01 volume 0.12060E-02 ppm1 6.593 ppm2 5.621 CV 1 OR { 175} (( segid " " and resid 25 and name HA )) ( segid " " and resid 25 and name HE% ) OR { 175} (( segid " " and resid 25 and name HA )) ( segid " " and resid 16 and name HE% ) ASSI { 181} (( segid " " and resid 82 and name HB )) ( segid " " and resid 25 and name HE% ) 4.100 2.100 1.900 peak 181 weight 0.10000E+01 volume 0.38795E-02 ppm1 6.589 ppm2 1.674 CV 1 OR { 181} (( segid " " and resid 82 and name HB )) ( segid " " and resid 16 and name HE% ) OR { 181} (( segid " " and resid 18 and name HB )) ( segid " " and resid 16 and name HE% ) OR { 181} (( segid " " and resid 69 and name HB* )) ( segid " " and resid 25 and name HE% ) ASSI { 182} (( segid " " and resid 13 and name HB )) ( segid " " and resid 16 and name HE% ) 3.500 3.500 2.500 peak 182 weight 0.10000E+01 volume 0.54608E-02 ppm1 6.580 ppm2 1.860 CV 1 OR { 182} (( segid " " and resid 17 and name HB* )) ( segid " " and resid 16 and name HE% ) OR { 182} (( segid " " and resid 99 and name HB* )) ( segid " " and resid 16 and name HE% ) OR { 182} (( segid " " and resid 13 and name HB )) ( segid " " and resid 25 and name HE% ) ASSI { 184} (( segid " " and resid 13 and name HB )) ( segid " " and resid 135 and name HD% ) 4.400 2.400 1.600 peak 184 weight 0.10000E+01 volume 0.16762E-02 ppm1 6.730 ppm2 1.842 CV 1 OR { 184} (( segid " " and resid 126 and name HB )) ( segid " " and resid 135 and name HD% ) ASSI { 185} (( segid " " and resid 136 and name HG )) ( segid " " and resid 135 and name HD% ) 3.800 1.800 1.800 peak 185 weight 0.10000E+01 volume 0.17268E-02 ppm1 6.724 ppm2 1.227 CV 1 OR { 185} (( segid " " and resid 117 and name HB* )) ( segid " " and resid 135 and name HD% ) ASSI { 197} ( segid " " and resid 30 and name HD1%) ( segid " " and resid 25 and name HE% ) 2.900 1.000 1.000 peak 197 weight 0.10000E+01 volume 0.24246E-01 ppm1 6.602 ppm2 0.703 CV 1 OR { 197} ( segid " " and resid 68 and name HG2%) ( segid " " and resid 25 and name HE% )
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