NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
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579470 |
2mny   |
19913 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
! 13C-noe, strong 4e+7; mid 1e+7 ! 15N-noe, strong 1e+8; mid 3e+7 ! A1 ! intra !assign (residue 1 and name HN) (residue 1 and name HA) 1.8 0.0 1.1 !assign (residue 1 and name HN) (residue 1 and name HB#) 1.8 0.0 4.2 ! intra !assign (residue 1 and name HN) (residue 2 and name HA) 1.8 0.0 1.7 !assign (residue 1 and name HN) (residue 2 and name HB#) 1.8 0.0 1.7 !assign (residue 1 and name HN) (residue 2 and name HG#) 1.8 0.0 1.1 assign (residue 1 and name HB#) (residue 2 and name HN) 1.8 0.0 4.2 !!! assign (residue 1 and name HN) (residue 25 and name HA) 1.8 0.0 4.2 ! V2 ! intra assign (residue 2 and name HN) (residue 2 and name HA) 1.8 0.0 1.7 assign (residue 2 and name HN) (residue 2 and name HB) 1.8 0.0 1.7 assign (residue 2 and name HN) (residue 2 and name HG#) 1.8 0.0 1.7 assign (residue 2 and name HA) (residue 2 and name HG#) 1.8 0.0 1.1 ! inter assign (residue 2 and name HN) (residue 1 and name HB#) 1.8 0.0 4.2 assign (residue 2 and name HN) (residue 3 and name HN) 1.8 0.0 4.2 !!! assign (residue 2 and name HN) (residue 18 and name HA) 1.8 0.0 4.2 !!! assign (residue 2 and name HN) (residue 25 and name HA) 1.8 0.0 4.2 !!! assign (residue 2 and name HA) (residue 5 and name HD#) 1.8 0.0 4.2 !!! assign (residue 2 and name HA) (residue 18 and name HN) 1.8 0.0 4.2 !!! assign (residue 2 and name HA) (residue 50 and (name HG2 or name HG1)) 1.8 0.0 4.2 ! assign (residue 2 and name HB#) (residue 1 and name HN) 1.8 0.0 1.7 ! D3 ! intra assign (residue 3 and name HN) (residue 3 and name HA) 1.8 0.0 1.7 assign (residue 3 and name HN) (residue 3 and name HB#) 1.8 0.0 1.7 ! inter assign (residue 3 and name HN) (residue 2 and name HA) 1.8 0.0 4.2 assign (residue 3 and name HN) (residue 2 and name HG#) 1.8 0.0 1.7 assign (residue 3 and name HN) (residue 2 and name HN) 1.8 0.0 1.7 assign (residue 3 and name HN) (residue 2 and name HB#) 1.8 0.0 4.2 !!! assign (residue 3 and name HN) (residue 8 and (name HB2 or name HB1)) 1.8 0.0 4.2 !!! assign (residue 3 and name HN) (residue 14 and name HA) 1.8 0.0 4.2 ! assign (residue 3 and name HA) (residue 4 and name HN) 1.8 0.0 1.1 ! repeated !!! assign (residue 3 and name HA) (residue 18 and name HN) 1.8 0.0 4.2 assign (residue 3 and name HA) (residue 4 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! assign (residue 3 and name HB#) (residue 4 and name HN) 1.8 0.0 1.7 ! repeated !!! assign (residue 3 and name HB#) (residue 18 and name HN) 1.8 0.0 4.2 ! L4 ! intra assign (residue 4 and name HN) (residue 4 and name HA) 1.8 0.0 1.1 ! assign (residue 4 and name HN) (residue 4 and (name HB1 or name HB2)) 1.8 0.0 1.1 assign (residue 4 and name HN) (residue 4 and name HG) 1.8 0.0 4.2 assign (residue 4 and name HN) (residue 4 and (name HD1# or name HD2#)) 1.8 0.0 4.2 assign (residue 4 and name HA) (residue 4 and (name HD1# or name HD2#)) 1.8 0.0 3.2 assign (residue 4 and name HB1) (residue 4 and (name HD1# or name HD2#)) 1.8 0.0 1.7 assign (residue 4 and name HB2) (residue 4 and (name HD1# or name HD2#)) 1.8 0.0 1.7 assign (residue 4 and name HB1) (residue 4 and name HN) 1.8 0.0 1.7 assign (residue 4 and name HB2) (residue 4 and name HN) 1.8 0.0 4.2 ! inter assign (residue 4 and name HN) (residue 3 and name HA) 1.8 0.0 1.1 assign (residue 4 and name HN) (residue 3 and name HB#) 1.8 0.0 1.7 assign (residue 4 and name HN) (residue 5 and name HN) 1.8 0.0 1.1 !!! assign (residue 4 and name HN) (residue 7 and name HA) 1.8 0.0 4.2 !!! assign (residue 4 and name HN) (residue 7 and (name HB2 or name HB1)) 1.8 0.0 4.2 !!! assign (residue 4 and name HN) (residue 16 and (name HB2 or name HB1)) 1.8 0.0 4.2 !!! assign (residue 4 and name HN) (residue 22 and name HA) 1.8 0.0 4.2 ! assign (residue 4 and name HA) (residue 5 and name HN) 1.8 0.0 1.1 ! repeated !!! assign (residue 4 and (name HB1 or name HB2)) (residue 1 and name HN) 1.8 0.0 4.2 ! Y5 ! intra assign (residue 5 and name HN) (residue 5 and name HA) 1.8 0.0 1.1 assign (residue 5 and name HN) (residue 5 and name HB2) 1.8 0.0 3.2 assign (residue 5 and name HN) (residue 5 and name HB1) 1.8 0.0 3.2 assign (residue 5 and name HN) (residue 5 and name HD#) 1.8 0.0 1.7 assign (residue 5 and name HA) (residue 5 and name HD#) 1.8 0.0 1.7 ! inter assign (residue 5 and name HN) (residue 4 and name HA) 1.8 0.0 4.2 assign (residue 5 and name HN) (residue 4 and (name HB2 or name HB1)) 1.8 0.0 1.7 assign (residue 5 and name HN) (residue 6 and name HN) 1.8 0.0 1.7 !!! assign (residue 5 and name HN) (residue 16 and (name HG1 or name HG2)) 1.8 0.0 4.2 ! assign (residue 5 and name HA) (residue 6 and name HN) 1.8 0.0 1.1 ! repeated assign (residue 5 and (name HB2 or name HB1)) (residue 19 and (name HD2# or name HD1#)) 1.8 0.0 3.2 assign (residue 5 and name HB1) (residue 21 and (name HD1# or name HD2#)) 1.8 0.0 4.2 assign (residue 5 and name HB2) (residue 21 and (name HD1# or name HD2#)) 1.8 0.0 4.2 ! V6 ! intra assign (residue 6 and name HN) (residue 6 and name HA) 1.8 0.0 1.7 assign (residue 6 and name HN) (residue 6 and name HB) 1.8 0.0 3.2 assign (residue 6 and name HN) (residue 6 and name HG#) 1.8 0.0 1.1 assign (residue 6 and name HA) (residue 6 and name HG#) 1.8 0.0 1.1 ! inter ! assign (residue 6 and name HN) (residue 5 and name HN) 1.8 0.0 4.2 ! repeated assign (residue 6 and name HN) (residue 5 and name HA) 1.8 0.0 1.1 assign (residue 6 and name HN) (residue 5 and (name HB1 or name HB2)) 1.8 0.0 4.2 assign (residue 6 and name HN) (residue 5 and name HD#) 1.8 0.0 4.2 assign (residue 6 and name HN) (residue 28 and (name HB2 or name HB1)) 1.8 0.0 4.2 !!! assign (residue 6 and name HN) (residue 31 and name HA) 1.8 0.0 4.2 assign (residue 6 and name HA) (residue 5 and name HA) 1.8 0.0 4.2 assign (residue 6 and name HA) (residue 7 and name HA) 1.8 0.0 4.2 ! assign (residue 6 and name HA) (residue 7 and name HN) 1.8 0.0 1.1 ! repeated ! assign (residue 6 and name HB) (residue 7 and name HN) 1.8 0.0 1.1 ! repeated ! assign (residue 6 and name HG#) (residue 7 and name HN) 1.8 0.0 1.1 assign (residue 6 and name HB) (residue 11 and (name HA1 or name HA2)) 1.8 0.0 4.2 ! C7 ! intra assign (residue 7 and name HN) (residue 7 and name HA) 1.8 0.0 1.1 assign (residue 7 and name HB1) (residue 7 and name HN) 1.8 0.0 4.2 assign (residue 7 and name HB2) (residue 7 and name HN) 1.8 0.0 1.7 ! inter assign (residue 7 and name HN) (residue 6 and name HN) 1.8 0.0 4.2 assign (residue 7 and name HN) (residue 6 and name HA) 1.8 0.0 1.1 assign (residue 7 and name HN) (residue 6 and name HB) 1.8 0.0 4.2 assign (residue 7 and name HN) (residue 6 and name HG#) 1.8 0.0 4.2 assign (residue 7 and name HN) (residue 8 and name HN) 1.8 0.0 4.2 assign (residue 7 and name HN) (residue 9 and name HN) 1.8 0.0 4.2 ! assign (residue 7 and name HN) (residue 9 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! confirmed assign (residue 7 and name HN) (residue 19 and (name HD1# or name HD2#)) 1.8 0.0 1.7 assign (residue 7 and name HN) (residue 29 and name HA) 1.8 0.0 4.2 assign (residue 7 and name HN) (residue 30 and name HN) 1.8 0.0 4.2 ! assign (residue 7 and name HN) (residue 32 and name HA) 1.8 0.0 4.2 ! confirmed assign (residue 7 and name HA) (residue 8 and (name HD1# or name HD2#)) 1.8 0.0 4.2 ! assign (residue 7 and name HA) (residue 8 and name HN) 1.8 0.0 1.1 ! repeated assign (residue 7 and name HA) (residue 9 and (name HB1 or name HB2)) 1.8 0.0 4.2 assign (residue 7 and name HA) (residue 29 and name HA) 1.8 0.0 1.7 assign (residue 7 and (name HB1 or name HB2)) (residue 9 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! assign (residue 7 and name HA) (residue 6 and name HA) 1.8 0.0 1.7 ! repeated ! assign (residue 7 and name HA) (residue 15 and name HN) 1.8 0.0 4.2 ! confirmed assign (residue 7 and name HB1) (residue 9 and name HN) 1.8 0.0 4.2 assign (residue 7 and name HB2) (residue 9 and name HN) 1.8 0.0 4.2 ! L8 ! intra assign (residue 8 and name HN) (residue 8 and name HA) 1.8 0.0 1.7 assign (residue 8 and name HN) (residue 8 and name HB1) 1.8 0.0 1.7 assign (residue 8 and name HN) (residue 8 and name HB2) 1.8 0.0 1.7 assign (residue 8 and name HN) (residue 8 and (name HD2# or name HD1#)) 1.8 0.0 3.2 assign (residue 8 and (name HB1 or name HB2)) (residue 8 and (name HD2# or name HD1#)) 1.8 0.0 1.1 assign (residue 8 and (name HD2# or name HD1#)) (residue 8 and name HA) 1.8 0.0 1.7 ! inter ! assign (residue 8 and name HN) (residue 5 and name HN) 1.8 0.0 4.2 ! confirmed ! assign (residue 8 and name HN) (residue 7 and name HN) 1.8 0.0 4.2 ! repeated assign (residue 8 and name HN) (residue 7 and name HA) 1.8 0.0 1.7 assign (residue 8 and name HN) (residue 7 and (name HB1 or name Hb2)) 1.8 0.0 4.2 assign (residue 8 and name HN) (residue 9 and name HN) 1.8 0.0 1.7 assign (residue 8 and name HN) (residue 9 and name HA) 1.8 0.0 4.2 ! assign (residue 8 and name HN) (residue 10 and name HA) 1.8 0.0 4.2 ! confirmed ! assign (residue 8 and name HN) (residue 25 and name HA) 1.8 0.0 4.2 ! confirmed assign (residue 8 and name HN) (residue 29 and name HA) 1.8 0.0 3.2 assign (residue 8 and name HN) (residue 29 and (name HB1 or name HB2)) 1.8 0.0 4.2 assign (residue 8 and name HN) (residue 29 and name HD#) 1.8 0.0 4.2 !!! assign (residue 8 and name HN) (residue 58 and (name HB2 or name HB1)) 1.8 0.0 4.2 !!! assign (residue 8 and name HN) (residue 63 and name HB#) 1.8 0.0 4.2 ! assign (residue 8 and (name HD2# or name HD1#)) (residue 5 and name HE#) 1.8 0.0 1.1 ! confirmed ! assign (residue 8 and (name HD2# or name HD1#)) (residue 10 and (name HB2 or name HB1)) 1.8 0.0 4.2 ! confirmed ! L9 ! intra assign (residue 9 and name HN) (residue 9 and name HA) 1.8 0.0 1.1 assign (residue 9 and name HN) (residue 9 and name HB1) 1.8 0.0 1.7 assign (residue 9 and name HN) (residue 9 and name HB2) 1.8 0.0 1.7 assign (residue 9 and name HN) (residue 9 and name HD2#) 1.8 0.0 4.2 assign (residue 9 and name HD1#) (residue 9 and name HN) 1.8 0.0 4.2 assign (residue 9 and name HA) (residue 9 and name HD1#) 1.8 0.0 3.2 assign (residue 9 and name HD2#) (residue 9 and name HA) 1.8 0.0 3.2 assign (residue 9 and name HB1) (residue 9 and name HD2#) 1.8 0.0 1.1 assign (residue 9 and name HD1#) (residue 9 and name HB1) 1.8 0.0 1.1 assign (residue 9 and name HB2) (residue 9 and (name HD2# or name HD1#)) 1.8 0.0 1.1 assign (residue 9 and name HG) (residue 9 and name HA) 1.8 0.0 1.7 assign (residue 9 and name HG) (residue 9 and name HN) 1.8 0.0 4.2 ! inter assign (residue 9 and name HN) (residue 8 and name HA) 1.8 0.0 4.2 assign (residue 9 and name HN) (residue 10 and name HN) 1.8 0.0 1.1 assign (residue 9 and name HN) (residue 10 and name HA) 1.8 0.0 4.2 assign (residue 9 and name HN) (residue 10 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! assign (residue 9 and name HN) (residue 28 and name HA) 1.8 0.0 4.2 ! confirmed assign (residue 9 and name HN) (residue 29 and name HA) 1.8 0.0 4.2 assign (residue 9 and name HN) (residue 29 and (name HB1 or name HB2)) 1.8 0.0 4.2 assign (residue 9 and name HN) (residue 29 and name HD#) 1.8 0.0 4.2 ! assign (residue 9 and name HN) (residue 34 and name HN) 1.8 0.0 4.2 ! confirmed assign (residue 9 and name HA) (residue 7 and (name HB2 or name HB1)) 1.8 0.0 4.2 ! assign (residue 9 and name HA) (residue 10 and name HN) 1.8 0.0 1.7 ! repeated !assign (residue 9 and (name HB2 or name HB1)) (residue 19 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! confirmed assign (residue 9 and (name HB1 or name HB2)) (residue 29 and name HD#) 1.8 0.0 4.2 assign (residue 9 and name HB1) (residue 10 and name HN) 1.8 0.0 1.7 assign (residue 9 and name HB2) (residue 10 and name HN) 1.8 0.0 1.7 assign (residue 9 and name HB1) (residue 29 and (name HB1 or name HB2)) 1.8 0.0 4.2 assign (residue 9 and name HB2) (residue 29 and (name HB1 or name HB2)) 1.8 0.0 4.2 assign (residue 9 and (name HB1 or name HB2)) (residue 33 and (name HB2 or name HB1)) 1.8 0.0 4.2 ! assign (residue 9 and name HG) (residue 28 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! confirmed ! assign (residue 9 and name HG) (residue 5 and (name HD1 or name HD2)) 1.8 0.0 4.2 ! confirmed ? ! assign (residue 9 and name HG) (residue 20 and (name HD1# or name HD2#)) 1.8 0.0 4.2 ! confirmed assign (residue 9 and name HG) (residue 29 and (name HB1 or name HB2)) 1.8 0.0 4.2 assign (residue 9 and name HG) (residue 29 and name HE#) 1.8 0.0 4.2 ! assign (residue 9 and name HG) (residue 48 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! confirmed ! assign (residue 9 and (name HD2# or name HD1#)) (residue 5 and (name HB2 or name HB1)) 1.8 0.0 4.2 ! confirmed ? ! assign (residue 9 and (name HD2# or name HD1#)) (residue 5 and name HD#) 1.8 0.0 4.2 ! confirmed ? check assign (residue 9 and (name HD2# or name HD1#)) (residue 10 and (name HB1 or name HB2)) 1.8 0.0 4.2 assign (residue 9 and (name HD2# or name HD1#)) (residue 29 and name HE#) 1.8 0.0 4.2 assign (residue 9 and (name HD2# or name HD1#)) (residue 34 and name HA) 1.8 0.0 1.1 ! assign (residue 9 and (name HD2# or name HD1#)) (residue 32 and name HN) 1.8 0.0 4.2 ! confirmed !!! assign (residue 9 and (name HD2# or name HD1#)) (residue 55 and (name HG1 or name HG2)) 1.8 0.0 4.2 ! C10 ! intra assign (residue 10 and name HN) (residue 10 and name HA) 1.8 0.0 1.7 assign (residue 10 and name HN) (residue 10 and name HB2) 1.8 0.0 3.2 assign (residue 10 and name HN) (residue 10 and name HB1) 1.8 0.0 4.2 ! inter assign (residue 10 and name HN) (residue 8 and name HN) 1.8 0.0 4.2 ! assign (residue 10 and name HN) (residue 9 and name HN) 1.8 0.0 1.1 ! repeated assign (residue 10 and name HN) (residue 9 and name HA) 1.8 0.0 1.7 ! assign (residue 10 and name HN) (residue 9 and name HB1) 1.8 0.0 1.1 ! repeated assign (residue 10 and name HN) (residue 9 and (name HD2# or name HD1#)) 1.8 0.0 4.2 assign (residue 10 and name HN) (residue 11 and (name HA1 or name HA2)) 1.8 0.0 4.2 assign (residue 10 and name HN) (residue 29 and name HA) 1.8 0.0 4.2 ! assign (residue 10 and name HN) (residue 34 and name HN) 1.8 0.0 4.2 ! confirmed !!! assign (residue 10 and (name HB1 or name HB2)) (residue 56 and name HN) 1.8 0.0 4.2 ! G11 ! intra assign (residue 11 and name HN) (residue 11 and name HA1) 1.8 0.0 1.1 assign (residue 11 and name HN) (residue 11 and name HA2) 1.8 0.0 1.1 ! inter assign (residue 11 and name HN) (residue 6 and name HB) 1.8 0.0 4.2 assign (residue 11 and name HN) (residue 6 and name HG#) 1.8 0.0 4.2 assign (residue 11 and name HN) (residue 7 and name HN) 1.8 0.0 4.2 assign (residue 11 and name HN) (residue 7 and name HB#) 1.8 0.0 3.2 !! assign (residue 11 and name HN) (residue 9 and name HA) 1.8 0.0 4.2 assign (residue 11 and name HN) (residue 9 and (name HB1 or name HB2)) 1.8 0.0 4.2 assign (residue 11 and name HN) (residue 9 and (name HD1# or name HD2#)) 1.8 0.0 4.2 ! little shorter assign (residue 11 and name HN) (residue 10 and name HA) 1.8 0.0 1.7 assign (residue 11 and name HN) (residue 12 and name HN) 1.8 0.0 1.1 ! assign (residue 11 and name HN) (residue 19 and (name HD1# or name HD2#)) 1.8 0.0 4.2 ! confirmed assign (residue 11 and name HA1) (residue 6 and name HG#) 1.8 0.0 1.7 assign (residue 11 and name HA2) (residue 6 and name HG#) 1.8 0.0 4.2 assign (residue 11 and name HA1) (residue 12 and name HN) 1.8 0.0 1.7 assign (residue 11 and name HA2) (residue 12 and name HN) 1.8 0.0 1.7 ! S12 ! intra assign (residue 12 and name HN) (residue 12 and name HA) 1.8 0.0 1.1 assign (residue 12 and name HN) (residue 12 and name HB1) 1.8 0.0 1.7 assign (residue 12 and name HN) (residue 12 and name HB2) 1.8 0.0 1.7 ! inter ! assign (residue 12 and name HN) (residue 5 and name HA) 1.8 0.0 4.2 ! confirmed assign (residue 12 and name HN) (residue 6 and name HB) 1.8 0.0 4.2 assign (residue 12 and name HN) (residue 6 and name HG#) 1.8 0.0 4.2 assign (residue 12 and name HN) (residue 7 and name HN) 1.8 0.0 1.7 assign (residue 12 and name HN) (residue 7 and name HB#) 1.8 0.0 1.7 assign (residue 12 and name HN) (residue 9 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! ~6.4A, measured ! assign (residue 12 and name HN) (residue 11 and name HN) 1.8 0.0 1.1 ! repeated assign (residue 12 and name HN) (residue 13 and name HN) 1.8 0.0 4.2 assign (residue 12 and name HN) (residue 19 and (name HD1# or name HD2#)) 1.8 0.0 4.2 ! ~6.4A, measured assign (residue 12 and name HB2) (residue 7 and name HN) 1.8 0.0 4.2 assign (residue 12 and name HB1) (residue 7 and name HN) 1.8 0.0 4.2 assign (residue 12 and (name HB1 or name HB2)) (residue 10 and name HN) 1.8 0.0 4.2 ! assign (residue 12 and name HB1) (residue 13 and name HN) 1.8 0.0 1.7 ! repeated ! G13 ! intra assign (residue 13 and name HN) (residue 13 and (name HA1 or name HA2)) 1.8 0.0 1.1 ! inter assign (residue 13 and name HN) (residue 6 and name HB) 1.8 0.0 3.2 assign (residue 13 and name HN) (residue 6 and name HG#) 1.8 0.0 3.2 assign (residue 13 and name HN) (residue 7 and name HN) 1.8 0.0 3.2 ! assign (residue 13 and name HN) (residue 12 and name HN) 1.8 0.0 4.2 ! repeated assign (residue 13 and name HN) (residue 12 and name HA) 1.8 0.0 1.7 assign (residue 13 and name HN) (residue 12 and name HB2) 1.8 0.0 4.2 assign (residue 13 and name HN) (residue 12 and name HB1) 1.8 0.0 4.2 assign (residue 13 and name HN) (residue 14 and name HN) 1.8 0.0 1.1 assign (residue 13 and name HN) (residue 14 and (name HB2 or name HB1)) 1.8 0.0 4.2 assign (residue 13 and name HN) (residue 19 and (name HD1# or name HD2#)) 1.8 0.0 4.2 !! assign (residue 13 and (name HA1 or name HA2)) (residue 32 and name HA) 1.8 0.0 4.2 assign (residue 13 and (name HA1 or name HA2)) (residue 6 and name HG#) 1.8 0.0 4.2 ! N14 ! intra assign (residue 14 and name HN) (residue 14 and name HA) 1.8 0.0 1.1 assign (residue 14 and name HN) (residue 14 and name HB2) 1.8 0.0 3.2 assign (residue 14 and name HN) (residue 14 and name HB1) 1.8 0.0 3.2 assign (residue 14 and name HN) (residue 14 and (name HD21 or name HD22)) 1.8 0.0 4.2 assign (residue 14 and name HD21) (residue 14 and name HA) 1.8 0.0 4.2 assign (residue 14 and name HD22) (residue 14 and name HA) 1.8 0.0 4.2 assign (residue 14 and name HD21) (residue 14 and name HB1) 1.8 0.0 4.2 assign (residue 14 and name HD21) (residue 14 and name HB2) 1.8 0.0 4.2 assign (residue 14 and name HB1) (residue 14 and name HD22) 1.8 0.0 4.2 assign (residue 14 and name HB2) (residue 14 and name HD22) 1.8 0.0 4.2 ! inter assign (residue 14 and name HN) (residue 12 and (name HB2 or name HB1)) 1.8 0.0 1.7 ! assign (residue 14 and name HN) (residue 13 and name HN) 1.8 0.0 1.1 ! repeated assign (residue 14 and name HN) (residue 13 and (name HA1 or name HA2)) 1.8 0.0 1.7 assign (residue 14 and name HN) (residue 19 and (name HD1# or name HD2#)) 1.8 0.0 4.2 assign (residue 14 and (name HB2 or name HB1)) (residue 13 and name HN) 1.8 0.0 4.2 !assign (residue 14 and name HB1) (residue 15 and name HN) 1.8 0.0 1.1 ! repeated ! D15 ! intra assign (residue 15 and name HN) (residue 15 and name HA) 1.8 0.0 1.1 assign (residue 15 and name HB1) (residue 15 and name HN) 1.8 0.0 1.7 assign (residue 15 and name HB2) (residue 15 and name HN) 1.8 0.0 1.7 ! inter ! assign (residue 15 and name HN) (residue 12 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! confirmed assign (residue 15 and name HN) (residue 14 and name HN) 1.8 0.0 4.2 assign (residue 15 and name HN) (residue 14 and name HA) 1.8 0.0 3.2 assign (residue 15 and name HN) (residue 14 and (name HB1 or name HB2)) 1.8 0.0 3.2 assign (residue 15 and name HN) (residue 16 and name HN) 1.8 0.0 1.7 assign (residue 15 and name HN) (residue 16 and (name HB2 or name HB1)) 1.8 0.0 4.2 ! assign (residue 15 and name HN) (residue 19 and (name HB2 or name HB1)) 1.8 0.0 4.2 ! confirmed, >6.5A !! assign (residue 15 and name HN) (residue 19 and (name HD1# or name HD2#)) 1.8 0.0 4.2 ! ~6.2A ! assign (residue 15 and name HA) (residue 14 and (name HD22 or name HD21)) 1.8 0.0 1.7 ! confirmed, 7A ! assign (residue 15 and name HA) (residue 16 and name HN) 1.8 0.0 1.1 ! repeated assign (residue 15 and name HA) (residue 17 and name HN) 1.8 0.0 3.2 !!! assign (residue 15 and name HA) (residue 30 and name HD) 1.8 0.0 1.7 ! ??? ! assign (residue 15 and name HB1) (residue 14 and (name HD21 or name HD22)) 1.8 0.0 1.7 ! confirmed, >6.5A ! assign (residue 15 and name HB2) (residue 14 and (name HD21 or name HD22)) 1.8 0.0 4.2 ! confirmed, >6.5A !! assign (residue 15 and name HB1) (residue 18 and name HB#) 1.8 0.0 4.2 !! assign (residue 15 and name HB2) (residue 18 and name HB#) 1.8 0.0 4.2 !! assign (residue 15 and name HB#) (residue 30 and name HD2) 1.8 0.0 4.2 ! only one less than 6A ! assign (residue 15 and name HB2) (residue 30 and name HD2) 1.8 0.0 1.7 ! E16 ! intra assign (residue 16 and name HN) (residue 16 and name HA) 1.8 0.0 1.1 assign (residue 16 and name HB1) (residue 16 and name HN) 1.8 0.0 1.7 assign (residue 16 and name HB2) (residue 16 and name HN) 1.8 0.0 1.7 assign (residue 16 and name HG1) (residue 16 and name HA) 1.8 0.0 1.7 assign (residue 16 and name HG2) (residue 16 and name HA) 1.8 0.0 1.7 assign (residue 16 and name HG1) (residue 16 and name HN) 1.8 0.0 4.2 assign (residue 16 and name HG2) (residue 16 and name HN) 1.8 0.0 4.2 ! inter ! assign (residue 16 and name HN) (residue 4 and (name HD1# or name HD2#)) 1.8 0.0 4.2 ! confirmed, 15A assign (residue 16 and name HN) (residue 14 and name HA) 1.8 0.0 4.2 assign (residue 16 and name HN) (residue 15 and (name HB1 or name HB2)) 1.8 0.0 3.2 assign (residue 16 and name HN) (residue 15 and name HA) 1.8 0.0 1.7 ! assign (residue 16 and name HN) (residue 15 and name HN) 1.8 0.0 1.1 ! repeated ! assign (residue 16 and name HN) (residue 18 and name HB#) 1.8 0.0 4.2 ! confirmed, >6.5A assign (residue 16 and name HN) (residue 18 and name HN) 1.8 0.0 4.2 assign (residue 16 and name HN) (residue 19 and name HN) 1.8 0.0 4.2 assign (residue 16 and name HN) (residue 19 and (name HB1 or name HB2)) 1.8 0.0 4.2 assign (residue 16 and name HN) (residue 19 and (name HD1# or name HD2#)) 1.8 0.0 4.2 !!! assign (residue 16 and name HN) (residue 28 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! assign (residue 16 and name HN) (residue 30 and name HD2) 1.8 0.0 4.2 ! confirmed, 8.7A !! assign (residue 16 and name HA) (residue 15 and name HN) 1.8 0.0 4.2 !! assign (residue 16 and name HA) (residue 18 and name HA) 1.8 0.0 4.2 ! 6A assign (residue 16 and name HA) (residue 18 and name HN) 1.8 0.0 4.2 ! 5A violated assign (residue 16 and name HA) (residue 19 and name HN) 1.8 0.0 4.2 ! 5A violated assign (residue 16 and name HA) (residue 19 and name HB1) 1.8 0.0 4.2 assign (residue 16 and name HA) (residue 19 and name HB2) 1.8 0.0 4.2 assign (residue 16 and name HA) (residue 19 and (name HD1# or name HD2#)) 1.8 0.0 3.2 ! assign (residue 16 and name HA) (residue 30 and name HD2) 1.8 0.0 4.2 ! confirmed, 7.7a !! assign (residue 16 and (name HB1 or name HB2)) (residue 15 and name HN) 1.8 0.0 4.2 assign (residue 16 and (name HB2 or name HB1)) (residue 17 and name HN) 1.8 0.0 1.7 !!! assign (residue 16 and name HB1) (residue 19 and (name HD1# or name HD2#)) 1.8 0.0 4.2 !!! assign (residue 16 and name HB2) (residue 19 and (name HD1# or name HD2#)) 1.8 0.0 4.2 ! assign (residue 16 and (name HB2 or name HB1)) (residue 30 and name HB#) 1.8 0.0 4.2 ! confirmed,9.9A assign (residue 16 and (name HG2 or name HG1)) (residue 14 and name HA) 1.8 0.0 4.2 assign (residue 16 and name HG1) (residue 17 and name HN) 1.8 0.0 4.2 assign (residue 16 and name HG2) (residue 17 and name HN) 1.8 0.0 4.2 ! D17 ! intra assign (residue 17 and name HN) (residue 17 and name HA) 1.8 0.0 1.1 assign (residue 17 and name HN) (residue 17 and name HB2) 1.8 0.0 1.1 assign (residue 17 and name HB1) (residue 17 and name HN) 1.8 0.0 1.7 ! inter assign (residue 17 and name HN) (residue 16 and name HN) 1.8 0.0 1.7 assign (residue 17 and name HN) (residue 16 and name HA) 1.8 0.0 1.7 ! assign (residue 17 and name HN) (residue 16 and (name HB2 or name Hb1)) 1.8 0.0 1.7 ! repeated ! assign (residue 17 and name HN) (residue 16 and name HG1) 1.8 0.0 1.7 ! repeated assign (residue 17 and name HN) (residue 18 and name HN) 1.8 0.0 1.1 assign (residue 17 and name HN) (residue 18 and name HB#) 1.8 0.0 4.2 assign (residue 17 and name HN) (residue 19 and (name HB1 or name HB2)) 1.8 0.0 4.2 assign (residue 17 and name HN) (residue 19 and (name HD1# or name HD2#)) 1.8 0.0 4.2 assign (residue 17 and name HN) (residue 19 and name HN) 1.8 0.0 4.2 ! assign (residue 17 and name HN) (residue 30 and name HD2) 1.8 0.0 4.2 ! confirmed,9.6a ! assign (residue 17 and name HN) (residue 40 and name HA) 1.8 0.0 4.2 ! confirmed,11.8A ! assign (residue 17 and name HN) (residue 40 and name HN) 1.8 0.0 4.2 ! confirmed,13.6A ! assign (residue 17 and name HN) (residue 41 and (name HG1# or name HG2#)) 1.8 0.0 4.2 ! confirmed, >6.8A assign (residue 17 and (name HB2 or name HB1)) (residue 18 and name HN) 1.8 0.0 4.2 assign (residue 17 and name HA) (residue 16 and (name HB2 or name Hb1)) 1.8 0.0 4.2 assign (residue 17 and name HA) (residue 16 and (name HG1 or name HG2)) 1.8 0.0 4.2 ! 6.5A assign (residue 17 and name HA) (residue 18 and name HN) 1.8 0.0 1.7 !! assign (residue 17 and name HA) (residue 19 and (name HB2 or name HB1)) 1.8 0.0 4.2 assign (residue 17 and name HA) (residue 19 and name HN) 1.8 0.0 4.2 assign (residue 17 and name HB1) (residue 18 and name HB#) 1.8 0.0 4.2 assign (residue 17 and name HB2) (residue 18 and name HB#) 1.8 0.0 4.2 assign (residue 17 and (name HB1 or name HB2)) (residue 18 and name HN) 1.8 0.0 4.2 ! R18 ! intra assign (residue 18 and name HN) (residue 18 and name HA) 1.8 0.0 1.1 assign (residue 18 and name HN) (residue 18 and name HB#) 1.8 0.0 1.1 assign (residue 18 and name HN) (residue 18 and (name HD2 or name HD1)) 1.8 0.0 3.2 ! assign (residue 18 and name HA) (residue 18 and name HD2) 1.8 0.0 1.7 ! repeated ! assign (residue 18 and name HB#) (residue 18 and name HD1) 1.8 0.0 1.7 assign (residue 18 and name HG#) (residue 18 and name HA) 1.8 0.0 1.7 assign (residue 18 and name HG#) (residue 18 and name HN) 1.8 0.0 3.2 assign (residue 18 and name HD1) (residue 18 and name HA) 1.8 0.0 3.2 assign (residue 18 and name HD2) (residue 18 and name HA) 1.8 0.0 3.2 assign (residue 18 and name HD1) (residue 18 and name HB#) 1.8 0.0 3.2 assign (residue 18 and name HD2) (residue 18 and name HB#) 1.8 0.0 3.2 ! inter ! assign (residue 18 and name HN) (residue 14 and (name HD21 or name HD22)) 1.8 0.0 4.2 ! confirmed, 10.5a assign (residue 18 and name HN) (residue 15 and (name HB1 or name HB2)) 1.8 0.0 4.2 assign (residue 18 and name HN) (residue 16 and name HN) 1.8 0.0 4.2 ! assign (residue 18 and name HN) (residue 16 and name HA) 1.8 0.0 1.7 ! repeated ! assign (residue 18 and name HN) (residue 17 and name HN) 1.8 0.0 1.1 ! repeated assign (residue 18 and name HN) (residue 19 and name HN) 1.8 0.0 1.1 assign (residue 18 and name HN) (residue 19 and (name HB1 or name HB2)) 1.8 0.0 4.2 assign (residue 18 and name HN) (residue 19 and (name HD1# or name HD2#)) 1.8 0.0 4.2 ! confirmed,6.2a ! assign (residue 18 and name HN) (residue 30 and name HD2) 1.8 0.0 4.2 ! confirmed,7.9a, to HD1 3.85a, check again? ! assign (residue 18 and name HA) (residue 15 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! assign (residue 18 and name HA) (residue 19 and name HN) 1.8 0.0 1.7 ! repeated !!! assign (residue 18 and name HA) (residue 20 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! assign (residue 18 and name HB#) (residue 15 and (name HB1 or name HB2)) 1.8 0.0 4.2 assign (residue 18 and name HB#) (residue 19 and (name HB1 or name HB2)) 1.8 0.0 4.2 assign (residue 18 and name HG#) (residue 30 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! confirmed, >6.4a, assign (residue 18 and name HG#) (residue 32 and name HE#) 1.8 0.0 1.7 ! assign (residue 18 and (name HD1 or name HD2)) (residue 15 and name HN) 1.8 0.0 4.2 ! confirmed,~9a assign (residue 18 and (name HD1 or name HD2)) (residue 32 and name HN) 1.8 0.0 4.2 ! one close to 6a !assign (residue 18 and (name HD2 or name HD1)) (residue 32 and name HN) 1.8 0.0 4.2 ! one close to 7a ! assign (residue 18 and (name HD2 or name HD1)) (residue 15 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! violated assign (residue 18 and name HD1) (residue 32 and name HE#) 1.8 0.0 3.2 assign (residue 18 and name HD2) (residue 32 and name HE#) 1.8 0.0 3.2 ! assign (residue 18 and name HD1) (residue 40 and name HA) 1.8 0.0 1.7 ! confirmed,one close to 6a, the other 7.45a assign (residue 18 and (name HD2 or name HD1)) (residue 40 and name HA) 1.8 0.0 4.2 assign (residue 18 and name HD1) (residue 41 and (name HG1# or name HG2#)) 1.8 0.0 4.2 assign (residue 18 and name HD2) (residue 41 and (name HG1# or name HG2#)) 1.8 0.0 4.2 ! L19 ! intra assign (residue 19 and name HN) (residue 19 and name HA) 1.8 0.0 1.7 assign (residue 19 and name HN) (residue 19 and name HB1) 1.8 0.0 3.2 assign (residue 19 and name HN) (residue 19 and name HB2) 1.8 0.0 3.2 assign (residue 19 and name HN) (residue 19 and (name HD1# or name HD2#)) 1.8 0.0 3.2 assign (residue 19 and (name HD2# or name HD1#)) (residue 19 and name HA) 1.8 0.0 1.7 assign (residue 19 and (name HD2# or name HD1#)) (residue 19 and (name HB2 or name HB1)) 1.8 0.0 1.1 assign (residue 19 and name HG) (residue 19 and name HA) 1.8 0.0 1.7 ! inter assign (residue 19 and name HN) (residue 15 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! assign (residue 19 and name HN) (residue 16 and name HA) 1.8 0.0 1.7 ! repeated assign (residue 19 and name HN) (residue 16 and (name HB2 or name HB1)) 1.8 0.0 4.2 assign (residue 19 and name HN) (residue 16 and (name HG2 or name HG1)) 1.8 0.0 4.2 assign (residue 19 and name HN) (residue 17 and name HN) 1.8 0.0 4.2 ! assign (residue 19 and name HN) (residue 18 and name HN) 1.8 0.0 1.1 ! repeated assign (residue 19 and name HN) (residue 18 and name HA) 1.8 0.0 1.7 assign (residue 19 and name HN) (residue 18 and name HB#) 1.8 0.0 4.2 assign (residue 19 and name HN) (residue 18 and (name HD2 or name HD1)) 1.8 0.0 4.2 assign (residue 19 and name HN) (residue 20 and name HN) 1.8 0.0 3.2 ! assign (residue 19 and name HN) (residue 29 and name HN) 1.8 0.0 4.2 ! confirmed by 29HN/19HN? 6.94a !! assign (residue 19 and name HN) (residue 30 and name HN) 1.8 0.0 1.7 assign (residue 19 and name HN) (residue 30 and name HA) 1.8 0.0 3.2 ! 4.6a, measured ! assign (residue 19 and name HN) (residue 30 and name HD2) 1.8 0.0 4.2 ! 7.6a, to HD1 3.8a assign (residue 19 and name HA) (residue 18 and name HN) 1.8 0.0 4.2 assign (residue 19 and name HA) (residue 20 and name HN) 1.8 0.0 1.7 assign (residue 19 and name HA) (residue 30 and name HA) 1.8 0.0 4.2 ! 2.3a, measured assign (residue 19 and name HG) (residue 20 and name HN) 1.8 0.0 4.2 assign (residue 19 and (name HD2# or name HD1#)) (residue 7 and (name HB1 or name HB2)) 1.8 0.0 1.7 assign (residue 19 and (name HD2# or name HD1#)) (residue 5 and name HD#) 1.8 0.0 4.2 assign (residue 19 and (name HD2# or name HD1#)) (residue 7 and name HA) 1.8 0.0 3.2 assign (residue 19 and (name HD2# or name HD1#)) (residue 7 and name HN) 1.8 0.0 1.7 !! assign (residue 19 and (name HD2# or name HD1#)) (residue 10 and name HN) 1.8 0.0 4.2 ! confirmed,6.4a ! assign (residue 19 and (name HD2# or name HD1#)) (residue 17 and (name HB2 or name Hb1)) 1.8 0.0 4.2 ! confirmed,8.4a assign (residue 19 and (name HD2# or name HD1#)) (residue 20 and name HN) 1.8 0.0 1.7 assign (residue 19 and (name HD2# or name HD1#)) (residue 30 and name HA) 1.8 0.0 3.2 ! 3a, measured assign (residue 19 and (name HD2# or name HD1#)) (residue 30 and name HD2) 1.8 0.0 4.2 ! 4.5a, measured ! L20 ! intra assign (residue 20 and name HN) (residue 20 and name HA) 1.8 0.0 1.1 assign (residue 20 and name HN) (residue 20 and name HB1) 1.8 0.0 4.2 assign (residue 20 and name HN) (residue 20 and name HB2) 1.8 0.0 4.2 assign (residue 20 and name HN) (residue 20 and (name HD1# or name HD2#)) 1.8 0.0 4.2 assign (residue 20 and name HA) (residue 20 and name HD2#) 1.8 0.0 3.2 assign (residue 20 and name HA) (residue 20 and name HD1#) 1.8 0.0 3.2 ! inter ! assign (residue 20 and name HN) (residue 19 and name HN) 1.8 0.0 4.2 ! repeated ! assign (residue 20 and name HN) (residue 19 and name HA) 1.8 0.0 1.1 ! repeated assign (residue 20 and name HN) (residue 19 and name HB1) 1.8 0.0 3.2 assign (residue 20 and name HN) (residue 19 and name HB2) 1.8 0.0 3.2 ! one 3.5a, the other 4.4a ! assign (residue 20 and name HN) (residue 19 and (name HD1# or name HD2#)) 1.8 0.0 1.7 ! repeated !! assign (residue 20 and name HN) (residue 30 and name HA) 1.8 0.0 1.7 ! assign (residue 20 and name HA) (residue 21 and name HN) 1.8 0.0 1.1 ! repeated !! assign (residue 20 and (name HD1# or name HD2#)) (residue 1 and name HB#) 1.8 0.0 4.2 !! assign (residue 20 and (name HD1# or name HD2#)) (residue 2 and name HG#) 1.8 0.0 4.2 !! assign (residue 20 and (name HD1# or name HD2#)) (residue 3 and name HB#) 1.8 0.0 4.2 ! assign (residue 20 and (name HD1# or name HD2#)) (residue 5 and name HD#) 1.8 0.0 4.2 ! confirmed,>10a assign (residue 20 and (name HD1# or name HD2#)) (residue 19 and (name HD2# or name HD1#)) 1.8 0.0 4.2 ! assign (residue 20 and (name HD1# or name HD2#)) (residue 19 and name HG) 1.8 0.0 4.2 ! confirmed, >7.5a assign (residue 20 and (name HD2# or name HD1#)) (residue 21 and name HN) 1.8 0.0 4.2 ! assign (residue 20 and (name HD1# or name HD2#)) (residue 28 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! >7.5a, measured !! assign (residue 20 and (name HD1# or name HD2#)) (residue 42 and name HA) 1.8 0.0 4.2 ! assign (residue 20 and (name HD1# or name HD2#)) (residue 43 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! confirmed,9.6a !! assign (residue 20 and (name HD1# or name HD2#)) (residue 48 and name HA) 1.8 0.0 4.2 ! 5.8a, measured ! L21 ! intra assign (residue 21 and name HN) (residue 21 and name HB1) 1.8 0.0 1.7 assign (residue 21 and name HN) (residue 21 and name HB2) 1.8 0.0 1.7 assign (residue 21 and (name HD1# or name HD2#)) (residue 21 and name HB1) 1.8 0.0 1.1 assign (residue 21 and (name HD1# or name HD2#)) (residue 21 and name HB2) 1.8 0.0 1.1 assign (residue 21 and (name HD1# or name HD2#)) (residue 21 and name HN) 1.8 0.0 4.2 ! inter assign (residue 21 and name HN) (residue 5 and name HD#) 1.8 0.0 4.2 ! check Y5 assignment HD1 and HE2? assign (residue 21 and name HN) (residue 5 and name HE#) 1.8 0.0 4.2 !4a, measured assign (residue 21 and name HN) (residue 20 and name HN) 1.8 0.0 4.2 assign (residue 21 and name HN) (residue 20 and name HA) 1.8 0.0 1.1 assign (residue 21 and name HN) (residue 20 and (name HB2 or name HB1)) 1.8 0.0 1.7 assign (residue 21 and name HN) (residue 22 and name HA) 1.8 0.0 4.2 !! assign (residue 21 and name HN) (residue 28 and name HN) 1.8 0.0 4.2 !4a,measured assign (residue 21 and name HN) (residue 28 and name HB#) 1.8 0.0 4.2 !! assign (residue 21 and name HN) (residue 29 and name HA) 1.8 0.0 4.2 ! assign (residue 21 and name HN) (residue 48 and name HN) 1.8 0.0 4.2 ! 8.5a,measured assign (residue 21 and (name HD1# or name HD2#)) (residue 26 and name HA) 1.8 0.0 4.2 assign (residue 21 and (name HD1# or name HD2#)) (residue 28 and name HA) 1.8 0.0 4.2 ! assign (residue 21 and (name HD1# or name HD2#)) (residue 29 and name HA) 1.8 0.0 4.2 !7.8a,measured assign (residue 21 and (name HD1# or name HD2#)) (residue 22 and name HN) 1.8 0.0 1.7 !! assign (residue 21 and name HB1) (residue 22 and name HA) 1.8 0.0 4.2 ! one is 5.3a, the other 6.1a !! assign (residue 21 and name HB2) (residue 22 and name HA) 1.8 0.0 4.2 ! C22 ! intra assign (residue 22 and name HN) (residue 22 and name HA) 1.8 0.0 1.1 assign (residue 22 and name HN) (residue 22 and name HB1) 1.8 0.0 1.7 assign (residue 22 and name HN) (residue 22 and name HB2) 1.8 0.0 1.7 ! inter ! assign (residue 22 and name HN) (residue 5 and name HE#) 1.8 0.0 4.2 ! one 9.7a,the other 6.5a assign (residue 22 and name HN) (residue 21 and name HB2) 1.8 0.0 4.2 assign (residue 22 and name HN) (residue 21 and name HB1) 1.8 0.0 4.2 ! assign (residue 22 and name HN) (residue 21 and (name HD1# or name HD2#)) 1.8 0.0 1.7 ! repeated !! assign (residue 22 and name HN) (residue 24 and name HN) 1.8 0.0 4.2 assign (residue 22 and name HN) (residue 25 and name HN) 1.8 0.0 4.2 ! 5.5a assign (residue 22 and name HN) (residue 26 and name HN) 1.8 0.0 4.2 ! 5.4a, measured assign (residue 22 and name HN) (residue 27 and (name HB1 or name HB2)) 1.8 0.0 4.2 assign (residue 22 and name HN) (residue 28 and name HA) 1.8 0.0 3.2 assign (residue 22 and name HN) (residue 29 and name HD#) 1.8 0.0 4.2 assign (residue 22 and name HB2) (residue 25 and (name HB2 or name Hb1)) 1.8 0.0 4.2 assign (residue 22 and name HB1) (residue 25 and (name HB2 or name Hb1)) 1.8 0.0 4.2 ! 4.6a, the other 5.6a assign (residue 22 and name HB1) (residue 25 and name HN) 1.8 0.0 4.2 assign (residue 22 and name HB2) (residue 25 and name HN) 1.8 0.0 4.2 ! one 3.3a,the other 4.5a assign (residue 22 and (name HB1 or name HB2)) (residue 26 and name HN) 1.8 0.0 1.7 assign (residue 22 and name HB1) (residue 27 and name HN) 1.8 0.0 3.2 assign (residue 22 and name HB2) (residue 27 and name HN) 1.8 0.0 3.2 ! one 2.94a, the other 4.1a assign (residue 22 and name HB1) (residue 29 and name HE#) 1.8 0.0 4.2 ! one 2.9a, the other 4a assign (residue 22 and name HB2) (residue 29 and name HE#) 1.8 0.0 4.2 ! D23 ! intra assign (residue 23 and name HN) (residue 23 and name HA) 1.8 0.0 1.1 assign (residue 23 and name HB1) (residue 23 and name HN) 1.8 0.0 3.2 assign (residue 23 and name HB2) (residue 23 and name HN) 1.8 0.0 1.7 ! inter ! assign (residue 23 and name HN) (residue 21 and (name HD1# or name HD2#)) 1.8 0.0 4.2 ! both about 6.5a assign (residue 23 and name HN) (residue 22 and name HB1) 1.8 0.0 4.2 assign (residue 23 and name HN) (residue 22 and name HB2) 1.8 0.0 4.2 assign (residue 23 and name HN) (residue 24 and name HN) 1.8 0.0 1.7 assign (residue 23 and name HN) (residue 24 and (name HA1 or name HA2)) 1.8 0.0 4.2 assign (residue 23 and name HN) (residue 47 and name HA) 1.8 0.0 4.2 ! 3.2a, measured assign (residue 23 and name HN) (residue 47 and (name HG2 or name HG1)) 1.8 0.0 4.2 ! assign (residue 23 and (name HB2 or name Hb1)) (residue 52 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! confirmed, >10.5a, measured ! G24 ! intra assign (residue 24 and name HA1) (residue 24 and name HN) 1.8 0.0 1.1 assign (residue 24 and name HA2) (residue 24 and name HN) 1.8 0.0 1.1 ! inter ! assign (residue 24 and name HN) (residue 21 and name HN) 1.8 0.0 4.2 ! >8.4a, measured !! assign (residue 24 and name HN) (residue 22 and (name HB1 or name HB2)) 1.8 0.0 4.2 assign (residue 24 and name HN) (residue 23 and name HA) 1.8 0.0 1.7 ! assign (residue 24 and name HN) (residue 23 and name HN) 1.8 0.0 1.7 ! repeated assign (residue 24 and name HN) (residue 25 and name HN) 1.8 0.0 1.1 ! assign (residue 24 and name HN) (residue 50 and name HB#) 1.8 0.0 4.2 ! both >8.4a, measured ! assign (residue 24 and name HN) (residue 52 and (name HB1 or name Hb2)) 1.8 0.0 4.2 ! both >9a, measured !! assign (residue 24 and name HN) (residue 63 and name HB#) 1.8 0.0 4.2 ! assign (residue 24 and name HA1) (residue 5 and name HE#) 1.8 0.0 4.2 ! both >11a ! assign (residue 24 and name HA2) (residue 5 and name HE#) 1.8 0.0 4.2 assign (residue 24 and name HA1) (residue 25 and name HN) 1.8 0.0 1.7 ! one 2.5a, the other 3.6a assign (residue 24 and name HA2) (residue 25 and name HN) 1.8 0.0 1.7 ! C25 ! intra assign (residue 25 and name HN) (residue 25 and name HA) 1.8 0.0 1.7 assign (residue 25 and name HN) (residue 25 and name HB1) 1.8 0.0 1.7 assign (residue 25 and name HN) (residue 25 and name HB2) 1.8 0.0 1.7 ! inter assign (residue 25 and name HN) (residue 22 and (name HB1 or name HB2)) 1.8 0.0 3.2 assign (residue 25 and name HN) (residue 24 and name HA#) 1.8 0.0 1.1 ! assign (residue 25 and name HN) (residue 24 and name HN) 1.8 0.0 1.1 ! repeated assign (residue 25 and name HN) (residue 26 and name HN) 1.8 0.0 4.2 !! assign (residue 25 and name HN) (residue 27 and name HN) 1.8 0.0 4.2 assign (residue 25 and (name HB1 or name HB2)) (residue 26 and name HN) 1.8 0.0 3.2 ! one 2a, the other 3.5a !! assign (residue 25 and name HB2) (residue 26 and name HN) 1.8 0.0 1.7 assign (residue 25 and name HB1) (residue 27 and name HN) 1.8 0.0 4.2 assign (residue 25 and name HB2) (residue 27 and name HN) 1.8 0.0 4.2 ! D26 ! intra assign (residue 26 and name HN) (residue 26 and name HA) 1.8 0.0 1.1 assign (residue 26 and name HN) (residue 26 and name HB1) 1.8 0.0 3.2 assign (residue 26 and name HN) (residue 26 and name HB2) 1.8 0.0 1.7 ! inter !!! assign (residue 26 and name HN) (residue 3 and name HB#) 1.8 0.0 4.2 ! assign (residue 26 and name HN) (residue 4 and name HN) 1.8 0.0 4.2 ! 8.3a, measured ! assign (residue 26 and name HN) (residue 6 and name HA) 1.8 0.0 4.2 ! 12.3a, measured ! assign (residue 26 and name HN) (residue 6 and name HG#) 1.8 0.0 4.2 ! >12a, measured ! assign (residue 26 and name HN) (residue 8 and (name HB2 or name HB1)) 1.8 0.0 4.2 ! both >9a ! assign (residue 26 and name HN) (residue 19 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! > 12a, measured assign (residue 26 and name HN) (residue 22 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! both <6a assign (residue 26 and name HN) (residue 27 and name HN) 1.8 0.0 3.2 ! assign (residue 26 and name HN) (residue 24 and name HN) 1.8 0.0 4.2 ! 6.86a ! D27 ! intra assign (residue 27 and name HN) (residue 27 and name HA) 1.8 0.0 1.7 assign (residue 27 and name HN) (residue 27 and name HB1) 1.8 0.0 3.2 assign (residue 27 and name HN) (residue 27 and name HB2) 1.8 0.0 1.7 ! inter ! assign (residue 27 and name HN) (residue 5 and name HE#) 1.8 0.0 4.2 ! confirmed, >7.5a, measured assign (residue 27 and name HN) (residue 21 and (name HD1# or name HD2#)) 1.8 0.0 4.2 assign (residue 27 and name HN) (residue 22 and (name HB1 or name HB2)) 1.8 0.0 1.7 assign (residue 27 and name HN) (residue 22 and name HN) 1.8 0.0 3.2 ! assign (residue 27 and name HN) (residue 26 and name HN) 1.8 0.0 1.1 ! repeated ! assign (residue 27 and name HN) (residue 50 and name HN) 1.8 0.0 4.2 ! confirmed, 8.5a, measured ! assign (residue 27 and name HN) (residue 51 and name HB#) 1.8 0.0 4.2 ! confirmed, >7.2a assign (residue 27 and name HB1) (residue 8 and (name HD2# or name HD1#)) 1.8 0.0 4.2 ! one 2.8a, the other 4a assign (residue 27 and name HB2) (residue 8 and (name HD2# or name HD1#)) 1.8 0.0 4.2 !! assign (residue 27 and name HB1) (residue 28 and name HN) 1.8 0.0 4.2 assign (residue 27 and (name HB2 or name HB1)) (residue 28 and name HN) 1.8 0.0 1.7 ! one 2.9a, one 4a assign (residue 27 and name HB1) (residue 29 and name HE#) 1.8 0.0 3.2 assign (residue 27 and name HB2) (residue 29 and name HE#) 1.8 0.0 1.7 ! S28 ! intra assign (residue 28 and name HN) (residue 28 and name HA) 1.8 0.0 1.7 assign (residue 28 and name HN) (residue 28 and name HB1) 1.8 0.0 3.2 assign (residue 28 and name HB2) (residue 28 and name HN) 1.8 0.0 3.2 ! inter ! assign (residue 28 and name HN) (residue 5 and name HE#) 1.8 0.0 4.2 ! confirmed, >7.5a, measured assign (residue 28 and name HN) (residue 8 and (name HD2# or name HD1#)) 1.8 0.0 4.2 assign (residue 28 and name HN) (residue 21 and (name HB2 or name HB1)) 1.8 0.0 4.2 assign (residue 28 and name HN) (residue 27 and name HN) 1.8 0.0 4.2 assign (residue 28 and name HN) (residue 27 and name HA) 1.8 0.0 1.7 ! 2.5a, measured ! assign (residue 28 and name HN) (residue 27 and name HB2) 1.8 0.0 1.7 ! repeated ! assign (residue 28 and name HN) (residue 29 and (name HB2 or name HB1)) 1.8 0.0 4.2 ! one 6.4a, the other 6.8a assign (residue 28 and name HN) (residue 29 and name HD#) 1.8 0.0 4.2 !!! assign (residue 28 and name HN) (residue 64 and (name HA2 or name HA1)) 1.8 0.0 4.2 assign (residue 28 and name HA) (residue 5 and name HD#) 1.8 0.0 4.2 ! 5.83a, measured ! assign (residue 28 and name HA) (residue 6 and name HG#) 1.8 0.0 4.2 ! confirmed, >8.4a ! assign (residue 28 and name HA) (residue 14 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! confirmed, >12.5a ! assign (residue 28 and name HA) (residue 15 and (name HB2 or name HB1)) 1.8 0.0 4.2 ! confirmed, >11a !! assign (residue 28 and name HA) (residue 19 and (name HB1 or name HB2)) 1.8 0.0 4.2 !! assign (residue 28 and name HA) (residue 19 and (name HD1# or name HD2#)) 1.8 0.0 4.2 assign (residue 28 and name HA) (residue 21 and name HA) 1.8 0.0 1.7 assign (residue 28 and name HA) (residue 22 and name HN) 1.8 0.0 4.2 ! 3.4a measured assign (residue 28 and name HA) (residue 22 and name HA) 1.8 0.0 4.2 ! 5.6a measured ! assign (residue 28 and name HA) (residue 29 and name HN) 1.8 0.0 1.1 ! repeated !! assign (residue 28 and name HB1) (residue 19 and (name HD1# or name HD2#)) 1.8 0.0 1.1 !! assign (residue 28 and name HB2) (residue 19 and (name HD1# or name HD2#)) 1.8 0.0 1.1 assign (residue 28 and name HB1) (residue 5 and name HD#) 1.8 0.0 4.2 ! both about 5a assign (residue 28 and name HB2) (residue 5 and name HD#) 1.8 0.0 4.2 assign (residue 28 and name HB1) (residue 6 and name HG#) 1.8 0.0 4.2 assign (residue 28 and name HB2) (residue 6 and name HG#) 1.8 0.0 4.2 !! assign (residue 28 and name HB1) (residue 19 and (name HB1 or name HB2)) 1.8 0.0 4.2 !! assign (residue 28 and name HB2) (residue 19 and (name HB1 or name HB2)) 1.8 0.0 4.2 assign (residue 28 and (name HB1 or name HB2)) (residue 29 and name HN) 1.8 0.0 1.7 ! one 2.7a, the other 4a !! assign (residue 28 and name HB2) (residue 29 and name HN) 1.8 0.0 1.7 !!! assign (residue 28 and name HB1) (residue 64 and (name HA2 or name HA1)) 1.8 0.0 4.2 !!! assign (residue 28 and name HB2) (residue 64 and (name HA2 or name HA1)) 1.8 0.0 4.2 ! Y29 ! intra assign (residue 29 and name HN) (residue 29 and name HA) 1.8 0.0 1.7 assign (residue 29 and name HN) (residue 29 and name HD#) 1.8 0.0 4.2 assign (residue 29 and name HA) (residue 29 and name HD#) 1.8 0.0 1.7 assign (residue 29 and name HB1) (residue 29 and name HD#) 1.8 0.0 1.1 assign (residue 29 and name HB2) (residue 29 and name HD#) 1.8 0.0 1.1 assign (residue 29 and name HB1) (residue 29 and name HN) 1.8 0.0 4.2 ! one 2.8a assign (residue 29 and name HB2) (residue 29 and name HN) 1.8 0.0 4.2 ! inter assign (residue 29 and name HN) (residue 7 and name HA) 1.8 0.0 4.2 ! assign (residue 29 and name HN) (residue 9 and (name HD2# or name HD1#)) 1.8 0.0 4.2 ! both >6.5a, measured assign (residue 29 and name HN) (residue 19 and name HA) 1.8 0.0 4.2 assign (residue 29 and name HN) (residue 19 and (name HD1# or name HD2#)) 1.8 0.0 3.2 assign (residue 29 and name HN) (residue 20 and (name HD1# or name HD2#)) 1.8 0.0 4.2 !! assign (residue 29 and name HN) (residue 21 and (name HD1# or name HD2#)) 1.8 0.0 4.2 ! only one close to 6a !! assign (residue 29 and name HN) (residue 22 and name HA) 1.8 0.0 4.2 ! 6.4a, measured assign (residue 29 and name HN) (residue 20 and name HN) 1.8 0.0 3.2 assign (residue 29 and name HN) (residue 28 and name HN) 1.8 0.0 3.2 assign (residue 29 and name HN) (residue 28 and name HA) 1.8 0.0 1.1 ! assign (residue 29 and name HN) (residue 28 and name HB1) 1.8 0.0 1.1 ! repeated !!! assign (residue 29 and name HN) (residue 34 and (name HB2 or name HB1)) 1.8 0.0 4.2 assign (residue 29 and name HA) (residue 7 and name HA) 1.8 0.0 1.7 ! 2.8a measured !! assign (residue 29 and name HA) (residue 20 and name HA) 1.8 0.0 4.2 ! assign (residue 29 and name HA) (residue 30 and name HN) 1.8 0.0 1.1 ! repeated assign (residue 29 and name HA) (residue 7 and name HB1) 1.8 0.0 4.2 assign (residue 29 and name HA) (residue 7 and name HB2) 1.8 0.0 4.2 assign (residue 29 and name HA) (residue 8 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! one 4.3a assign (residue 29 and name HA) (residue 19 and (name HD1# or name HD2#)) 1.8 0.0 4.2 ! 3.75a, smallest one assign (residue 29 and (name HB1 or name HB2)) (residue 9 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! only one less that 6a ! assign (residue 29 and name HB2) (residue 9 and (name HB1 or name HB2)) 1.8 0.0 4.2 assign (residue 29 and (name HB1 or name HB2)) (residue 30 and name HN) 1.8 0.0 3.2 ! H30 ! intra assign (residue 30 and name HN) (residue 30 and name HA) 1.8 0.0 1.7 assign (residue 30 and name HN) (residue 30 and (name HB1 or name HB2)) 1.8 0.0 1.7 assign (residue 30 and name HA) (residue 30 and name HD2) 1.8 0.0 4.2 ! inter assign (residue 30 and name HN) (residue 9 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! 4.5a, measured !! assign (residue 30 and name HN) (residue 10 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! 5.9a, measured ! assign (residue 30 and name HN) (residue 13 and (name HA1 or name HA2)) 1.8 0.0 4.2 ! >7.5a measured ! assign (residue 30 and name HN) (residue 19 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! both >6.4a, measured assign (residue 30 and name HN) (residue 19 and (name HD1# or name HD2#)) 1.8 0.0 3.2 !! assign (residue 30 and name HN) (residue 20 and name HA) 1.8 0.0 3.2 ! 7.5a, measured, for beta sheet assign (residue 30 and name HN) (residue 20 and name HN) 1.8 0.0 4.2 assign (residue 30 and name HN) (residue 29 and name HA) 1.8 0.0 1.7 ! assign (residue 30 and name HN) (residue 29 and (name HB1 or name HB2)) 1.8 0.0 1.1 ! repeated assign (residue 30 and name HN) (residue 29 and name HD#) 1.8 0.0 4.2 ! 5a always violated assign (residue 30 and name HN) (residue 29 and name HN) 1.8 0.0 3.2 assign (residue 30 and name HN) (residue 32 and name HN) 1.8 0.0 3.2 ! assign (residue 30 and name HA) (residue 9 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! both >7a, measured ! assign (residue 30 and name HA) (residue 12 and (name HB2 or name HB1)) 1.8 0.0 4.2 ! >7a, measured, revised as to be 19HA assign (residue 30 and name HA) (residue 19 and name HA) 1.8 0.0 4.2 assign (residue 30 and name HA) (residue 19 and (name HB1 or name HB2)) 1.8 0.0 4.2 assign (residue 30 and name HA) (residue 20 and (name HD2# or name HD1#)) 1.8 0.0 4.2 ! both less than 5a ! assign (residue 30 and name HA) (residue 31 and name HN) 1.8 0.0 1.1 ! repeated ! T31 ! intra assign (residue 31 and name HN) (residue 31 and name HA) 1.8 0.0 1.1 assign (residue 31 and name HN) (residue 31 and name HB) 1.8 0.0 1.7 ! inter ! assign (residue 31 and name HN) (residue 12 and name HA) 1.8 0.0 4.2 ! confirmed, >12a ! assign (residue 31 and name HN) (residue 15 and name HN) 1.8 0.0 4.2 ! confirmed, >10a assign (residue 31 and name HN) (residue 19 and name HN) 1.8 0.0 4.2 ! 5.1a measured assign (residue 31 and name HN) (residue 20 and (name HD2# or name HD1#)) 1.8 0.0 4.2 assign (residue 31 and name HN) (residue 30 and name HA) 1.8 0.0 1.7 assign (residue 31 and name HN) (residue 32 and (name HB1 or name HB2)) 1.8 0.0 4.2 assign (residue 31 and name HN) (residue 32 and name HN) 1.8 0.0 1.7 assign (residue 31 and name HN) (residue 33 and (name HB2 or name HB1)) 1.8 0.0 4.2 !! assign (residue 31 and name HN) (residue 34 and (name HB2 or name HB1)) 1.8 0.0 4.2 ! 6.2a, 7.7a ! assign (residue 31 and name HN) (residue 35 and name HA) 1.8 0.0 4.2 ! 10.3a, measured assign (residue 31 and name HA) (residue 18 and name HB#) 1.8 0.0 4.2 ! 5.9a measured assign (residue 31 and name HA) (residue 32 and name HN) 1.8 0.0 1.7 !! assign (residue 31 and name HA) (residue 38 and name HN) 1.8 0.0 4.2 ! assign (residue 31 and name HB) (residue 18 and name HG#) 1.8 0.0 4.2 ! both >7a measured !! assign (residue 31 and name HB) (residue 38 and name HN) 1.8 0.0 1.7 ! 3.25a, measured ! F32 ! intra assign (residue 32 and name HN) (residue 32 and name HA) 1.8 0.0 1.1 assign (residue 32 and name HN) (residue 32 and name HB1) 1.8 0.0 1.7 assign (residue 32 and name HN) (residue 32 and name HB2) 1.8 0.0 1.7 ! inter assign (residue 32 and name HN) (residue 18 and (name HD1 or name HD2)) 1.8 0.0 4.2 ! only one close to 6a !!! assign (residue 32 and name HN) (residue 29 and name HD#) 1.8 0.0 4.2 !!! assign (residue 32 and name HN) (residue 29 and (name HB1 or name HB2)) 1.8 0.0 4.2 assign (residue 32 and name HN) (residue 30 and name HA) 1.8 0.0 4.2 ! assign (residue 32 and name HN) (residue 31 and name HN) 1.8 0.0 1.1 ! repeated assign (residue 32 and name HN) (residue 31 and name HB) 1.8 0.0 1.7 ! 3.7a measured assign (residue 32 and name HN) (residue 34 and (name HB2 or name HB1)) 1.8 0.0 4.2 !! assign (residue 32 and name HN) (residue 37 and name HB#) 1.8 0.0 4.2 !! assign (residue 32 and name HN) (residue 38 and (name HD1# or name HD2#)) 1.8 0.0 4.2 ! one 6.37a, the other 8.2a ! assign (residue 32 and name HB1) (residue 39 and name HD2) 1.8 0.0 4.2 ! assign (residue 32 and name HB2) (residue 39 and name HD2) 1.8 0.0 4.2 !confirmed, both >8a ! C33 ! intra assign (residue 33 and name HN) (residue 33 and name HA) 1.8 0.0 1.7 assign (residue 33 and name HN) (residue 33 and name HB2) 1.8 0.0 1.7 assign (residue 33 and name HN) (residue 33 and name HB1) 1.8 0.0 1.7 ! inter assign (residue 33 and name HN) (residue 30 and name HN) 1.8 0.0 4.2 assign (residue 33 and name HN) (residue 30 and name HA) 1.8 0.0 4.2 assign (residue 33 and name HN) (residue 30 and (name HB1 or name Hb2)) 1.8 0.0 1.7 ! 2.6a and 3.1a assign (residue 33 and name HN) (residue 31 and name HA) 1.8 0.0 4.2 assign (residue 33 and name HN) (residue 31 and name HN) 1.8 0.0 4.2 assign (residue 33 and name HN) (residue 32 and name HN) 1.8 0.0 1.1 assign (residue 33 and name HN) (residue 32 and name HA) 1.8 0.0 1.7 ! assign (residue 33 and name HN) (residue 32 and name HE#) 1.8 0.0 4.2 ! 5a, 6a, measured assign (residue 33 and name HN) (residue 34 and name HA) 1.8 0.0 4.2 ! assign (residue 33 and name HN) (residue 35 and name HB) 1.8 0.0 4.2 ! confirmed, 8.6a ! assign (residue 33 and name HN) (residue 35 and (name HD2# or name HD1#)) 1.8 0.0 4.2 ! confirmed, both >8a ! assign (residue 33 and name HA) (residue 8 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! confirmed, both >9a, measured assign (residue 33 and name HA) (residue 32 and name HN) 1.8 0.0 4.2 assign (residue 33 and (name HB1 or name HB2)) (residue 30 and name HN) 1.8 0.0 3.2 ! 2.7a, 4a assign (residue 33 and (name HB1 or name HB2)) (residue 34 and name HN) 1.8 0.0 1.7 ! assign (residue 33 and name HB1) (residue 35 and name HB) 1.8 0.0 4.2 ! both >??.5a, measured ! assign (residue 33 and name HB2) (residue 35 and name HB) 1.8 0.0 4.2 ! L34 ! intra assign (residue 34 and name HN) (residue 34 and name HA) 1.8 0.0 1.1 assign (residue 34 and name HN) (residue 34 and name HB1) 1.8 0.0 3.2 assign (residue 34 and name HN) (residue 34 and name HB2) 1.8 0.0 3.2 assign (residue 34 and (name HD1# or name HD2#)) (residue 34 and name HA) 1.8 0.0 1.7 ! inter ! assign (residue 34 and name HN) (residue 20 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! confirmed, both >7a assign (residue 34 and name HN) (residue 31 and name HA) 1.8 0.0 4.2 ! ? ! assign (residue 34 and name HN) (residue 32 and name HE#) 1.8 0.0 4.2 ! confirmed, >7a assign (residue 34 and name HN) (residue 33 and name HN) 1.8 0.0 1.1 assign (residue 34 and name HN) (residue 33 and name HA) 1.8 0.0 1.7 !! assign (residue 34 and name HN) (residue 33 and name HB1) 1.8 0.0 4.2 assign (residue 34 and name HN) (residue 33 and (name HB2 or name HB1)) 1.8 0.0 1.7 ! one 3.8a, the other 3.1a assign (residue 34 and name HN) (residue 35 and name HN) 1.8 0.0 4.2 !! assign (residue 34 and name HN) (residue 37 and name HB#) 1.8 0.0 4.2 !! assign (residue 34 and name HN) (residue 38 and name HN) 1.8 0.0 4.2 !!! assign (residue 34 and name HN) (residue 61 and (name HB1 or name HB2)) 1.8 0.0 4.2 assign (residue 34 and name HA) (residue 9 and (name HD2# or name HD1#)) 1.8 0.0 1.1 !! assign (residue 34 and name HA) (residue 29 and name HD#) 1.8 0.0 4.2 ! possible, one 4.55a, the other 7.4a ! assign (residue 34 and name HA) (residue 35 and name HB) 1.8 0.0 4.2 ! assign (residue 34 and name HA) (residue 35 and name HN) 1.8 0.0 1.1 !2.3a, measured, repeated !! assign (residue 34 and (name HD1# or name HD2#)) (residue 29 and (name HB1 or name HB2)) 1.8 0.0 4.2 !! assign (residue 34 and (name HD1# or name HD2#)) (residue 29 and name HD#) 1.8 0.0 4.2 ! smallest about 4a assign (residue 34 and (name HD1# or name HD2#)) (residue 32 and name HN) 1.8 0.0 4.2 !! assign (residue 34 and (name HD1# or name HD2#)) (residue 49 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! one 5.6a assign (residue 34 and (name HB2 or name HB1)) (residue 33 and name HA) 1.8 0.0 4.2 assign (residue 34 and (name HB1 or name HB2)) (residue 35 and name HN) 1.8 0.0 1.7 ! I35 ! intra assign (residue 35 and name HN) (residue 35 and name HA) 1.8 0.0 1.7 assign (residue 35 and name HN) (residue 35 and name HB) 1.8 0.0 1.7 assign (residue 35 and name HN) (residue 35 and name HG1#) 1.8 0.0 4.2 assign (residue 35 and name HB) (residue 35 and name HD1#) 1.8 0.0 1.7 assign (residue 35 and name HD1#) (residue 35 and name HA) 1.8 0.0 4.2 assign (residue 35 and name HD1#) (residue 35 and name HN) 1.8 0.0 4.2 assign (residue 35 and name HG1#) (residue 35 and name HA) 1.8 0.0 1.7 ! inter assign (residue 35 and name HN) (residue 34 and name HN) 1.8 0.0 4.2 assign (residue 35 and name HN) (residue 34 and name HA) 1.8 0.0 1.7 assign (residue 35 and name HN) (residue 36 and name HA) 1.8 0.0 4.2 assign (residue 35 and name HN) (residue 36 and name HD1) 1.8 0.0 4.2 assign (residue 35 and name HN) (residue 36 and name HD2) 1.8 0.0 4.2 ! assign (residue 35 and name HN) (residue 47 and name HA) 1.8 0.0 4.2 ! 12.9a, measured ! assign (residue 35 and name HN) (residue 52 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! >13a, measured !!! assign (residue 35 and name HN) (residue 55 and (name HB1 or name HB2)) 1.8 0.0 4.2 assign (residue 35 and name HA) (residue 36 and name HB#) 1.8 0.0 4.2 assign (residue 35 and name HA) (residue 36 and (name HD1 or name HD2)) 1.8 0.0 4.2 !! assign (residue 35 and name HA) (residue 37 and name HA) 1.8 0.0 4.2 !! assign (residue 35 and name HA) (residue 37 and name HB1) 1.8 0.0 4.2 !! assign (residue 35 and name HA) (residue 37 and name HB2) 1.8 0.0 4.2 !! assign (residue 35 and name HA) (residue 37 and name HG#) 1.8 0.0 4.2 !! assign (residue 35 and name HA) (residue 37 and name HD#) 1.8 0.0 1.7 ! assign (residue 35 and name HB) (residue 47 and name HA) 1.8 0.0 4.2 ! >15a, measured ! assign (residue 35 and name HB) (residue 47 and (name HD1 or name HD2)) 1.8 0.0 4.2 ! >15a ! assign (residue 35 and name HG1#) (residue 38 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! >10a measured assign (residue 35 and name HG2#) (residue 36 and name HA) 1.8 0.0 4.2 assign (residue 35 and name HG2#) (residue 36 and name HD1) 1.8 0.0 4.2 assign (residue 35 and name HG2#) (residue 36 and name HD2) 1.8 0.0 4.2 ! P36 ! intra assign (residue 36 and name HA) (residue 36 and name HG#) 1.8 0.0 4.2 assign (residue 36 and name HA) (residue 36 and name HD1) 1.8 0.0 4.2 assign (residue 36 and name HA) (residue 36 and name HD2) 1.8 0.0 4.2 ! inter assign (residue 36 and name HA) (residue 37 and name HA) 1.8 0.0 4.2 assign (residue 36 and name HA) (residue 37 and name HD#) 1.8 0.0 4.2 ! P37 ! intra ! L38 ! intra assign (residue 38 and name HN) (residue 38 and name HA) 1.8 0.0 1.1 assign (residue 38 and name HN) (residue 38 and (name HD1# or name HD2#)) 1.8 0.0 4.2 assign (residue 38 and (name HD1# or name HD2#)) (residue 38 and name HA) 1.8 0.0 1.7 assign (residue 38 and name HB1) (residue 38 and name HN) 1.8 0.0 3.2 assign (residue 38 and name HB2) (residue 38 and name HN) 1.8 0.0 3.2 ! intra !! assign (residue 38 and name HN) (residue 20 and (name HD1# or name HD2#)) 1.8 0.0 4.2 ! 6.4a, measured !! assign (residue 38 and name HN) (residue 31 and name HN) 1.8 0.0 4.2 ! violated !! assign (residue 38 and name HN) (residue 31 and name HA) 1.8 0.0 4.2 ! measured 3.3a ! assign (residue 38 and name HN) (residue 32 and name HA) 1.8 0.0 4.2 ! assign (residue 38 and name HN) (residue 33 and (name HB2 or name HB1)) 1.8 0.0 4.2 ! >7a, measured !! assign (residue 38 and name HN) (residue 34 and name HN) 1.8 0.0 4.2 ! 4.3a measured !! assign (residue 38 and name HN) (residue 34 and (name HB2 or name HB1)) 1.8 0.0 4.2 ! 4.5a measured assign (residue 38 and name HN) (residue 37 and name HB#) 1.8 0.0 1.7 assign (residue 38 and name HN) (residue 39 and name HA) 1.8 0.0 4.2 !assign (residue 38 and (name HD1# or name HD2#)) (residue 33 and (name HB2 or name HB1)) 1.8 0.0 4.2 ! >8a measured ! H39 ! intra assign (residue 39 and name HN) (residue 39 and name HA) 1.8 0.0 1.7 assign (residue 39 and name HN) (residue 39 and name HB1) 1.8 0.0 1.7 assign (residue 39 and name HN) (residue 39 and name HB2) 1.8 0.0 1.7 ! inter ! assign (residue 39 and name HN) (residue 5 and name HD#) 1.8 0.0 4.2 ! confirmed >10a ! assign (residue 39 and name HN) (residue 19 and (name HD1# or name HD2#)) 1.8 0.0 1.7 ! confirmed >13a ! assign (residue 39 and name HN) ((residue 19 or residue 20) and name HG) 1.8 0.0 1.7 ! confirmed >14a ! assign (residue 39 and name HN) (residue 20 and (name HD1# or name HD2#)) 1.8 0.0 1.7 ! confirmed >7.5a ! assign (residue 39 and name HN) (residue 21 and (name HD1# or name HD2#)) 1.8 0.0 4.2 ! confirmed >17a ! assign (residue 39 and name HN) (residue 36 and name HA) 1.8 0.0 4.2 ! 8.8a measured assign (residue 39 and name HN) (residue 38 and name HD1#) 1.8 0.0 4.2 assign (residue 39 and name HN) (residue 38 and name HD2#) 1.8 0.0 4.2 assign (residue 39 and name HN) (residue 40 and name HB#) 1.8 0.0 4.2 assign (residue 39 and name HA) (residue 40 and name HN) 1.8 0.0 1.7 ! assign (residue 39 and name HA) (residue 43 and name HN) 1.8 0.0 4.2 ! confirmed >11.5a ! assign (residue 39 and name HA) (residue 46 and (name HB2 or name HB1)) 1.8 0.0 4.2 ! confirmed >12.8a ! D40 ! intra assign (residue 40 and name HN) (residue 40 and name HA) 1.8 0.0 1.1 assign (residue 40 and name HB1) (residue 40 and name HN) 1.8 0.0 1.7 assign (residue 40 and name HB2) (residue 40 and name HN) 1.8 0.0 1.7 ! inter assign (residue 40 and name HN) (residue 38 and (name HB1 or name HB2)) 1.8 0.0 3.2 ! 2.8a, 4a ! assign (residue 40 and name HN) (residue 39 and name HA) 1.8 0.0 1.7 ! repeated assign (residue 40 and name HN) (residue 41 and name HN) 1.8 0.0 4.2 !!! assign (residue 40 and name HN) (residue 64 and (name HA1 or name HA2)) 1.8 0.0 4.2 !!! assign (residue 40 and name HN) (residue 68 and name HB#) 1.8 0.0 4.2 assign (residue 40 and (name HB1 or name HB2)) (residue 41 and name HN) 1.8 0.0 4.2 ! one 2.7a the other 3.8a !! assign (residue 40 and name HB2) (residue 41 and name HN) 1.8 0.0 4.2 ! V41 ! intra assign (residue 41 and name HN) (residue 41 and name HA) 1.8 0.0 1.1 assign (residue 41 and name HN) (residue 41 and name HB) 1.8 0.0 1.1 assign (residue 41 and name HN) (residue 41 and (name HG1# or name HG2#)) 1.8 0.0 1.1 assign (residue 41 and name HG1#) (residue 41 and name HA) 1.8 0.0 1.1 ! inter assign (residue 41 and name HN) (residue 18 and (name HD1 or name HD2)) 1.8 0.0 4.2 ! assign (residue 41 and name HN) (residue 30 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! confirmed >10a ! assign (residue 41 and name HN) (residue 32 and (name HB2 or name HB1)) 1.8 0.0 4.2 ! confirmed >9a assign (residue 41 and name HN) (residue 40 and name HA) 1.8 0.0 1.1 ! assign (residue 41 and name HN) (residue 40 and name HB1) 1.8 0.0 1.1 ! repeated assign (residue 41 and name HB) (residue 40 and name HA) 1.8 0.0 4.2 assign (residue 41 and name HB) (residue 42 and name HA) 1.8 0.0 4.2 ! P42 ! intra !assign (residue 42 and name HA) (residue 42 and name HB#) 1.8 0.0 1.1 !assign (residue 42 and name HB#) (residue 42 and name HA) 1.8 0.0 1.1 ! inter ! assign (residue 42 and name HA) (residue 31 and name HA) 1.8 0.0 4.2 ! confirmed 9a assign (residue 42 and name HA) (residue 43 and (name HB2 or name HB1)) 1.8 0.0 4.2 assign (residue 42 and name HA) (residue 43 and name HN) 1.8 0.0 1.1 ! 2.3a measured ! assign (residue 42 and name HA) (residue 47 and (name HD2 or name HD1)) 1.8 0.0 4.2 ! confirmed 9.5a ! assign (residue 42 and name HB#) (residue 43 and name HN) 1.8 0.0 1.7 ! repeated ! K43 ! intra assign (residue 43 and name HN) (residue 43 and name HA) 1.8 0.0 1.1 assign (residue 43 and name HB1) (residue 43 and name HN) 1.8 0.0 3.2 assign (residue 43 and name HB2) (residue 43 and name HN) 1.8 0.0 1.7 assign (residue 43 and name HG1) (residue 43 and name HA) 1.8 0.0 1.7 assign (residue 43 and name HG2) (residue 43 and name HA) 1.8 0.0 1.7 assign (residue 43 and name HG1) (residue 43 and name HN) 1.8 0.0 4.2 assign (residue 43 and name HG2) (residue 43 and name HN) 1.8 0.0 4.2 ! inter assign (residue 43 and name HN) (residue 41 and (name HG1# or name HG2#)) 1.8 0.0 4.2 ! assign (residue 43 and name HN) (residue 42 and name HA) 1.8 0.0 1.1 ! repeated assign (residue 43 and name HN) (residue 42 and name HB#) 1.8 0.0 1.7 assign (residue 43 and name HN) (residue 44 and name HN) 1.8 0.0 4.2 !!! assign (residue 43 and name HN) (residue 63 and name HB#) 1.8 0.0 4.2 ! assign (residue 43 and name HA) (residue 44 and name HN) 1.8 0.0 1.1 ! repeated !!! assign (residue 43 and name HG1) (residue 58 and name HN) 1.8 0.0 4.2 !!! assign (residue 43 and name HG2) (residue 58 and name HN) 1.8 0.0 4.2 ! G44 ! intra assign (residue 44 and name HN) (residue 44 and (name HA2 or name HA1)) 1.8 0.0 1.1 ! inter assign (residue 44 and name HN) (residue 42 and name HB#) 1.8 0.0 4.2 assign (residue 44 and name HN) (residue 43 and name HN) 1.8 0.0 4.2 assign (residue 44 and name HN) (residue 43 and name HA) 1.8 0.0 1.1 assign (residue 44 and name HN) (residue 43 and (name HB1 or name HB2)) 1.8 0.0 1.1 assign (residue 44 and name HN) (residue 43 and (name HG1 or name HG2)) 1.8 0.0 1.7 !!! assign (residue 44 and name HN) (residue 64 and (name HA1 or name HA2)) 1.8 0.0 4.2 assign (residue 44 and name HA1) (residue 45 and name HN) 1.8 0.0 1.7 assign (residue 44 and name HA2) (residue 45 and name HN) 1.8 0.0 3.2 ! D45 ! dismissed in fudan pdb struct ! intra assign (residue 45 and name HN) (residue 45 and name HA) 1.8 0.0 1.7 ! assign (residue 45 and name HN) (residue 45 and name HB#) 1.8 0.0 1.1 assign (residue 45 and name HB1) (residue 45 and name HN) 1.8 0.0 1.7 assign (residue 45 and name HB2) (residue 45 and name HN) 1.8 0.0 1.7 ! inter !!! assign (residue 45 and name HN) (residue 43 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! assign (residue 45 and name HN) (residue 44 and name HA2) 1.8 0.0 1.1 ! repeated !!! assign (residue 45 and name HN) (residue 48 and name HN) 1.8 0.0 4.2 assign (residue 45 and (name HB1 or name HB2)) (residue 46 and name HN) 1.8 0.0 1.7 !!! assign (residue 45 and (name HB2 or name HB1)) (residue 48 and name HN) 1.8 0.0 4.2 ! W46 ! intra assign (residue 46 and name HN) (residue 46 and name HA) 1.8 0.0 1.7 assign (residue 46 and name HN) (residue 46 and (name HB2 or name HB1)) 1.8 0.0 1.7 ! inter assign (residue 46 and name HN) (residue 45 and name HN) 1.8 0.0 3.2 assign (residue 46 and name HN) (residue 45 and name HA) 1.8 0.0 1.1 ! assign (residue 46 and name HN) (residue 45 and name HB1) 1.8 0.0 4.2 ! repeated assign (residue 46 and name HA) (residue 47 and name HN) 1.8 0.0 1.1 assign (residue 46 and name HA) (residue 47 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! assign (residue 46 and name HA) (residue 50 and name HB#) 1.8 0.0 4.2 ! confirmed >11a ! assign (residue 46 and (name HB1 or name HB2)) (residue 29 and name HD#) 1.8 0.0 4.2 ! confirmed >7a ! assign (residue 46 and name HB1) (residue 40 and name HN) 1.8 0.0 4.2 ! confirmed >9.5a ! assign (residue 46 and name HB2) (residue 40 and name HN) 1.8 0.0 4.2 ! R47 ! intra assign (residue 47 and name HN) (residue 47 and name HA) 1.8 0.0 1.7 !! assign (residue 47 and name HB1) (residue 47 and name HN) 1.8 0.0 4.2 assign (residue 47 and (name HB2 or name HB1)) (residue 47 and name HN) 1.8 0.0 1.7 ! 2.6a & 3.75a !! assign (residue 47 and name HG1) (residue 47 and name HN) 1.8 0.0 4.2 assign (residue 47 and (name HG1 or name HG2)) (residue 47 and name HN) 1.8 0.0 4.2 ! 3a & 4.1a assign (residue 47 and name HG1) (residue 47 and name HA) 1.8 0.0 3.2 assign (residue 47 and name HG2) (residue 47 and name HA) 1.8 0.0 1.7 assign (residue 47 and name HD1) (residue 47 and name HA) 1.8 0.0 3.2 assign (residue 47 and name HD2) (residue 47 and name HA) 1.8 0.0 3.2 ! inter ! assign (residue 47 and name HN) (residue 19 and name HN) 1.8 0.0 4.2 ! confirmed >14a ! assign (residue 47 and name HN) (residue 23 and name HA) 1.8 0.0 4.2 ! confirmed 7.3a ! assign (residue 47 and name HN) (residue 24 and (name HA1 or name HA2)) 1.8 0.0 4.2 ! confirmed >7a !! assign (residue 47 and name HN) (residue 24 and name HN) 1.8 0.0 4.2 ! assign (residue 47 and name HN) (residue 29 and name HE#) 1.8 0.0 1.7 ! confirmed >8.5a assign (residue 47 and name HN) (residue 46 and name HN) 1.8 0.0 3.2 assign (residue 47 and name HN) (residue 46 and name HA) 1.8 0.0 1.1 assign (residue 47 and name HN) (residue 46 and (name HB1 or name HB2)) 1.8 0.0 3.2 ! assign (residue 47 and name HN) (residue 50 and name HB#) 1.8 0.0 4.2 ! confirmed >9a assign (residue 47 and name HN) (residue 52 and (name HD1# or name HD2#)) 1.8 0.0 4.2 !!! assign (residue 47 and name HN) (residue 54 and name HN) 1.8 0.0 4.2 !assign (residue 47 and name HD1) (residue 52 and (name HB2 or name HB1)) 1.8 0.0 1.7 ! confirmed both >7a !assign (residue 47 and name HD2) (residue 52 and (name HB2 or name HB1)) 1.8 0.0 1.7 assign (residue 47 and name HB1) (residue 52 and (name HD1# or name HD2#)) 1.8 0.0 4.2 assign (residue 47 and name HB2) (residue 52 and (name HD1# or name HD2#)) 1.8 0.0 4.2 assign (residue 47 and (name HD2 or name HD1)) (residue 24 and name HN) 1.8 0.0 3.2 assign (residue 47 and (name HD2 or name HD1)) (residue 25 and name HN) 1.8 0.0 4.2 ! assign (residue 47 and (name HD2 or name HD1)) (residue 44 and (name HA1 or name HA2)) 1.8 0.0 1.7 ! confirmed >9.5a, measured assign (residue 47 and (name HD2 or name HD1)) (residue 46 and name HN) 1.8 0.0 4.2 assign (residue 47 and name HD1) (residue 52 and (name HD1# or name HD2#)) 1.8 0.0 3.2 assign (residue 47 and name HD2) (residue 52 and (name HD1# or name HD2#)) 1.8 0.0 3.2 assign (residue 47 and name HG1) (residue 51 and name HB#) 1.8 0.0 4.2 assign (residue 47 and name HG2) (residue 51 and name HB#) 1.8 0.0 4.2 assign (residue 47 and name HG1) (residue 52 and (name HD1# or name HD2#)) 1.8 0.0 4.2 assign (residue 47 and name HG2) (residue 52 and (name HD1# or name HD2#)) 1.8 0.0 4.2 ! C48 ! intra assign (residue 48 and name HN) (residue 48 and name HA) 1.8 0.0 1.7 assign (residue 48 and name HN) (residue 48 and name HB1) 1.8 0.0 1.7 assign (residue 48 and name HN) (residue 48 and name HB2) 1.8 0.0 1.7 ! inter !! assign (residue 48 and name HN) (residue 24 and name HN) 1.8 0.0 4.2 ! assign (residue 48 and name HN) (residue 29 and name HN) 1.8 0.0 4.2 ! confirmed >8a ! assign (residue 48 and name HN) (residue 43 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! confirmed >14a, measured assign (residue 48 and name HN) (residue 47 and name HN) 1.8 0.0 3.2 assign (residue 48 and name HN) (residue 47 and name HA) 1.8 0.0 1.1 assign (residue 48 and name HN) (residue 47 and (name HB2 or name HB1)) 1.8 0.0 1.7 assign (residue 48 and name HN) (residue 51 and name HB#) 1.8 0.0 4.2 ! 3a & 4.7a assign (residue 48 and name HN) (residue 50 and name HN) 1.8 0.0 4.2 assign (residue 48 and name HN) (residue 52 and (name HD1# or name HD2#)) 1.8 0.0 4.2 ! assign (residue 48 and name HA) (residue 23 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! confirmed >8a measured assign (residue 48 and name HA) (residue 29 and name HD#) 1.8 0.0 4.2 assign (residue 48 and name HA) (residue 29 and name HE#) 1.8 0.0 4.2 ! assign (residue 48 and name HA) (residue 41 and name HB#) 1.8 0.0 4.2 ! confirmed >13a assign (residue 48 and name HA) (residue 52 and (name HD1# or name HD2#)) 1.8 0.0 4.2 assign (residue 48 and name HB1) (residue 29 and name HD#) 1.8 0.0 4.2 assign (residue 48 and name HB2) (residue 29 and name HD#) 1.8 0.0 4.2 assign (residue 48 and name HB1) (residue 29 and name HE#) 1.8 0.0 1.7 assign (residue 48 and name HB2) (residue 29 and name HE#) 1.8 0.0 1.7 ! P49 ! K50 ! intra assign (residue 50 and name HN) (residue 50 and name HA) 1.8 0.0 1.1 assign (residue 50 and name HN) (residue 50 and name HB#) 1.8 0.0 1.7 assign (residue 50 and name HN) (residue 50 and name HG1) 1.8 0.0 1.7 assign (residue 50 and name HN) (residue 50 and name HG2) 1.8 0.0 1.7 assign (residue 50 and name HG1) (residue 50 and name HA) 1.8 0.0 1.7 assign (residue 50 and name HG2) (residue 50 and name HA) 1.8 0.0 1.7 ! inter assign (residue 50 and name HN) (residue 48 and name HA) 1.8 0.0 3.2 assign (residue 50 and name HN) (residue 49 and name HA) 1.8 0.0 3.2 assign (residue 50 and name HN) (residue 49 and (name HG2 or name HG1)) 1.8 0.0 3.2 !! assign (residue 50 and name HN) (residue 49 and name HD1) 1.8 0.0 1.7 ! 3.1a & 4.3a assign (residue 50 and name HN) (residue 49 and (name HD1 or name HD2)) 1.8 0.0 4.2 assign (residue 50 and name HN) (residue 51 and name HN) 1.8 0.0 1.1 !! assign (residue 50 and name HN) (residue 51 and name HB#) 1.8 0.0 4.2 assign (residue 50 and name HN) (residue 52 and name HN) 1.8 0.0 3.2 assign (residue 50 and name HN) (residue 52 and (name HD1# or name HD2#)) 1.8 0.0 4.2 assign (residue 50 and name HA) (residue 51 and name HN) 1.8 0.0 1.7 assign (residue 50 and name HA) (residue 52 and name HN) 1.8 0.0 3.2 assign (residue 50 and name HA) (residue 53 and name HN) 1.8 0.0 3.2 assign (residue 50 and name HA) (residue 53 and name HB#) 1.8 0.0 3.2 ! assign (residue 50 and name HG1) (residue 47 and name HA) 1.8 0.0 4.2 ! confirmed both>9a ! assign (residue 50 and name HG2) (residue 47 and name HA) 1.8 0.0 4.2 ! assign (residue 50 and name HG1) (residue 47 and (name HD1 or name HD2)) 1.8 0.0 4.2 ! confirmed >10a ! assign (residue 50 and name HG2) (residue 47 and (name HD1 or name HD2)) 1.8 0.0 4.2 ! C51 ! intra assign (residue 51 and name HN) (residue 51 and name HA) 1.8 0.0 1.1 assign (residue 51 and name HN) (residue 51 and name HB#) 1.8 0.0 1.7 ! inter ! assign (residue 51 and name HN) (residue 24 and (name HA2 or name HA1)) 1.8 0.0 4.2 ! 6.8a & 8.6a, revised as 50HA ! assign (residue 51 and name HN) (residue 26 and (name HB2 or name HB1)) 1.8 0.0 4.2 ! >10a measured ! assign (residue 51 and name HN) (residue 28 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! >10a measured assign (residue 51 and name HN) (residue 50 and name HB#) 1.8 0.0 1.7 ! assign (residue 51 and name HN) (residue 50 and name HN) 1.8 0.0 1.1 ! repeated ! assign (residue 51 and name HN) (residue 50 and name HA) 1.8 0.0 1.1 ! repeated assign (residue 51 and name HN) (residue 52 and name HN) 1.8 0.0 1.1 !! assign (residue 51 and name HN) (residue 52 and (name HB2 or name HB1)) 1.8 0.0 4.2 assign (residue 51 and name HN) (residue 52 and (name HD1# or name HD2#)) 1.8 0.0 4.2 assign (residue 51 and name HN) (residue 53 and name HN) 1.8 0.0 3.2 !!! assign (residue 51 and name HN) (residue 54 and (name HG2 or name HG1)) 1.8 0.0 4.2 !! assign (residue 51 and name HA) (residue 50 and name HN) 1.8 0.0 4.2 assign (residue 51 and name HA) (residue 52 and name HN) 1.8 0.0 1.7 assign (residue 51 and name HA) (residue 53 and name HN) 1.8 0.0 3.2 assign (residue 51 and name HA) (residue 54 and name HN) 1.8 0.0 3.2 assign (residue 51 and name HA) (residue 54 and (name HB1 or name HB2)) 1.8 0.0 4.2 assign (residue 51 and name HB#) (residue 47 and (name HB1 or name HB2)) 1.8 0.0 3.2 ! 3.5a, measured !!! assign (residue 51 and name HB#) (residue 50 and name HB#) 1.8 0.0 4.2 assign (residue 51 and name HB#) (residue 52 and name HN) 1.8 0.0 1.7 ! L52 ! intra assign (residue 52 and name HN) (residue 52 and name HA) 1.8 0.0 1.1 assign (residue 52 and name HN) (residue 52 and (name HD1# or name HD2#)) 1.8 0.0 3.2 assign (residue 52 and name HN) (residue 52 and name HG) 1.8 0.0 4.2 assign (residue 52 and name HB1) (residue 52 and (name HD1# or name HD2#)) 1.8 0.0 1.1 assign (residue 52 and name HB2) (residue 52 and (name HD1# or name HD2#)) 1.8 0.0 1.1 assign (residue 52 and name HB1) (residue 52 and name HN) 1.8 0.0 3.2 assign (residue 52 and name HB2) (residue 52 and name HN) 1.8 0.0 3.2 assign (residue 52 and (name HD1# or name HD2#)) (residue 52 and name HA) 1.8 0.0 1.7 assign (residue 52 and name HG) (residue 52 and name HA) 1.8 0.0 3.2 ! inter assign (residue 52 and name HN) (residue 50 and name HB#) 1.8 0.0 4.2 assign (residue 52 and name HN) (residue 50 and name HN) 1.8 0.0 4.2 ! assign (residue 52 and name HN) (residue 51 and name HB#) 1.8 0.0 1.1 ! repeated ! assign (residue 52 and name HN) (residue 51 and name HN) 1.8 0.0 1.1 ! repeated assign (residue 52 and name HN) (residue 53 and name HN) 1.8 0.0 1.1 assign (residue 52 and name HN) (residue 54 and name HN) 1.8 0.0 3.2 assign (residue 52 and name HN) (residue 54 and (name HG2 or name HG1)) 1.8 0.0 4.2 assign (residue 52 and name HA) (residue 53 and name HN) 1.8 0.0 1.7 assign (residue 52 and name HA) (residue 54 and name HN) 1.8 0.0 3.2 assign (residue 52 and name HA) (residue 55 and name HN) 1.8 0.0 3.2 assign (residue 52 and name HA) (residue 55 and (name HB1 or name HB2)) 1.8 0.0 4.2 !assign (residue 52 and name HB2) (residue 50 and name HB#) 1.8 0.0 4.2 ! confirmed >6.5a !assign (residue 52 and name HB1) (residue 50 and name HB#) 1.8 0.0 4.2 assign (residue 52 and name HB1) (residue 53 and name HN) 1.8 0.0 3.2 assign (residue 52 and name HB2) (residue 53 and name HN) 1.8 0.0 3.2 ! assign (residue 52 and (name HD1# or name HD2#)) (residue 47 and name HN) 1.8 0.0 4.2 ! repeated ! A53 ! intra assign (residue 53 and name HN) (residue 53 and name HA) 1.8 0.0 1.1 assign (residue 53 and name HN) (residue 53 and name HB#) 1.8 0.0 1.1 ! inter !! assign (residue 53 and name HN) (residue 43 and name HN) 1.8 0.0 4.2 ! assign (residue 53 and name HN) (residue 52 and name HN) 1.8 0.0 1.1 ! repeated assign (residue 53 and name HN) (residue 52 and (name HD1# or name HD2#)) 1.8 0.0 3.2 assign (residue 53 and name HN) (residue 54 and name HN) 1.8 0.0 1.7 ! overlapped assign (residue 53 and name HN) (residue 54 and (name HG2 or name HG1)) 1.8 0.0 4.2 assign (residue 53 and name HN) (residue 55 and name HN) 1.8 0.0 3.2 !! assign (residue 53 and name HN) (residue 55 and (name HB2 or name HB1)) 1.8 0.0 4.2 assign (residue 53 and name HA) (residue 54 and name HN) 1.8 0.0 1.7 assign (residue 53 and name HA) (residue 55 and name HN) 1.8 0.0 3.2 assign (residue 53 and name HB#) (residue 54 and (name HG2 or name HG1)) 1.8 0.0 1.7 ! Q54 ! intra assign (residue 54 and name HN) (residue 54 and name HA) 1.8 0.0 1.1 assign (residue 54 and name HB1) (residue 54 and name HN) 1.8 0.0 3.2 assign (residue 54 and name HB2) (residue 54 and name HN) 1.8 0.0 1.7 assign (residue 54 and name HG1) (residue 54 and name HA) 1.8 0.0 3.2 assign (residue 54 and name HG2) (residue 54 and name HA) 1.8 0.0 1.7 assign (residue 54 and name HG1) (residue 54 and name HN) 1.8 0.0 1.7 assign (residue 54 and name HG2) (residue 54 and name HN) 1.8 0.0 1.7 ! inter !! assign (residue 54 and name HN) (residue 51 and name HB#) 1.8 0.0 4.2 assign (residue 54 and name HN) (residue 52 and (name HD1# or name HD2#)) 1.8 0.0 4.2 assign (residue 54 and name HN) (residue 53 and name HB#) 1.8 0.0 3.2 assign (residue 54 and name HN) (residue 55 and name HN) 1.8 0.0 1.1 !!! assign (residue 54 and name HN) (residue 57 and name HB#) 1.8 0.0 4.2 !! assign (residue 54 and name HN) (residue 58 and name HN) 1.8 0.0 4.2 assign (residue 54 and name HA) (residue 55 and name HN) 1.8 0.0 1.7 assign (residue 54 and (name HG2 or name HG1)) (residue 55 and (name HB1 or name HB2)) 1.8 0.0 4.2 ! E55 ! intra assign (residue 55 and name HN) (residue 55 and name HA) 1.8 0.0 1.1 assign (residue 55 and name HB1) (residue 55 and name HN) 1.8 0.0 1.7 assign (residue 55 and name HB2) (residue 55 and name HN) 1.8 0.0 1.7 assign (residue 55 and name HG1) (residue 55 and name HN) 1.8 0.0 4.2 assign (residue 55 and name HG2) (residue 55 and name HN) 1.8 0.0 4.2 assign (residue 55 and name HG1) (residue 55 and name HA) 1.8 0.0 1.7 assign (residue 55 and name HG2) (residue 55 and name HA) 1.8 0.0 1.7 ! inter !!! assign (residue 55 and name HN) (residue 29 and (name HB1 or name HB2)) 1.8 0.0 4.2 assign (residue 55 and name HN) (residue 47 and (name HD2 or name HD1)) 1.8 0.0 4.2 assign (residue 55 and name HN) (residue 52 and name HA) 1.8 0.0 4.2 assign (residue 55 and name HN) (residue 52 and (name HD1# or name HD2#)) 1.8 0.0 4.2 !! assign (residue 55 and name HN) (residue 53 and name HB#) 1.8 0.0 4.2 ! assign (residue 55 and name HN) (residue 54 and name HN) 1.8 0.0 1.1 ! repeated assign (residue 55 and name HN) (residue 54 and name HB#) 1.8 0.0 1.7 ! overlap ! C56 ! intra assign (residue 56 and name HN) (residue 56 and name HA) 1.8 0.0 1.7 assign (residue 56 and name HB#) (residue 56 and name HN) 1.8 0.0 1.1 ! inter assign (residue 56 and name HN) (residue 55 and name HA) 1.8 0.0 4.2 !!! assign (residue 56 and name HN) (residue 50 and name HN) 1.8 0.0 4.2 assign (residue 56 and name HN) (residue 55 and (name HB2 or name HB1)) 1.8 0.0 1.7 ! S57 ! intra assign (residue 57 and name HN) (residue 57 and name HA) 1.8 0.0 4.2 assign (residue 57 and name HN) (residue 57 and name HB#) 1.8 0.0 4.2 ! inter assign (residue 57 and name HN) (residue 56 and name HB#) 1.8 0.0 4.2 assign (residue 57 and name HA) (residue 58 and name HN) 1.8 0.0 1.1 ! K58 ! intra assign (residue 58 and name HN) (residue 58 and (name HB2 or name HB1)) 1.8 0.0 1.7 assign (residue 58 and name HG#) (residue 58 and name HN) 1.8 0.0 4.2 ! inter assign (residue 58 and name HN) (residue 43 and (name HG1 or name HG2)) 1.8 0.0 4.2 ! assign (residue 58 and name HN) (residue 57 and name HA) 1.8 0.0 1.1 ! repeated assign (residue 58 and name HN) (residue 57 and name HN) 1.8 0.0 4.2 ! overlap assign (residue 58 and name HN) (residue 57 and name HB#) 1.8 0.0 4.2 assign (residue 58 and name HN) (residue 59 and name HA) 1.8 0.0 4.2 assign (residue 58 and name HN) (residue 59 and name HD#) 1.8 0.0 4.2 !!! assign (residue 58 and name HG#) (residue 7 and (name HB1 or name HB2)) 1.8 0.0 4.2 !!! assign (residue 58 and name HG#) (residue 21 and (name HD1# or name HD2#)) 1.8 0.0 4.2 !!! assign (residue 58 and name HG#) (residue 22 and name HN) 1.8 0.0 4.2 !!! assign (residue 58 and name HG#) (residue 22 and name HA) 1.8 0.0 4.2 assign (residue 58 and name HG#) (residue 55 and (name HB1 or name HB2)) 1.8 0.0 4.2 !!! assign (residue 58 and name HG#) (residue 63 and name HB#) 1.8 0.0 4.2
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