NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
20836 | 2glo | 7097 | cing | 1-original | 4 | XPLOR/CNS | distance | NOE | simple |
! unambiguous NOEs assign (resid 45 and name HD#) (resid 11 and name H4') 4.300 2.500 1.0 assign (resid 45 and name HA) (resid 16 and name H4') 3.100 1.300 1.0 assign (resid 45 and name HB#) (resid 16 and name H4') 3.500 1.700 1.0 assign (resid 45 and name HG#) (resid 16 and name H4') 3.900 2.100 1.0 assign (resid 45 and name HD#) (resid 16 and name H4') 3.900 2.100 1.0 assign (resid 45 and name HB#) (resid 12 and name H4') 3.200 1.400 1.0 assign (resid 45 and name HG#) (resid 12 and name H4') 3.500 1.700 1.0 assign (resid 45 and name HD#) (resid 12 and name H4') 3.900 2.100 1.0 assign (resid 45 and name HA) (resid 16 and name H1') 4.000 2.200 1.0 assign (resid 45 and name HB#) (resid 16 and name H1') 3.100 1.300 1.0 assign (resid 45 and name HG#) (resid 16 and name H1') 3.100 1.300 1.0 assign (resid 45 and name HD#) (resid 16 and name H1') 2.800 1.000 1.0 assign (resid 45 and name HB#) (resid 12 and name H1') 3.400 1.600 1.0 assign (resid 45 and name HG#) (resid 12 and name H1') 4.100 2.300 1.0 assign (resid 45 and name HD#) (resid 12 and name H1') 3.200 1.400 1.0 assign (resid 45 and name HB#) (resid 11 and name H1') 3.200 1.400 1.0 assign (resid 45 and name HG#) (resid 11 and name H1') 3.200 1.400 1.0 assign (resid 45 and name HD#) (resid 11 and name H1') 2.700 0.900 1.0 assign (resid 45 and name HB#) (resid 10 and name H2) 4.300 2.500 1.0 assign (resid 45 and name HG#) (resid 10 and name H2) 4.100 2.300 1.0 assign (resid 45 and name HD#) (resid 10 and name H2) 3.200 1.400 1.0 assign (resid 45 and name HG#) (resid 11 and name H2) 4.000 2.200 1.0 assign (resid 45 and name HD#) (resid 11 and name H2) 3.400 1.600 1.0 assign (resid 48 and name HD#) (resid 16 and name H8) 4.700 2.900 1.0 assign (resid 48 and name HZ) (resid 16 and name H8) 3.000 1.200 1.0 assign (resid 48 and name HD#) (resid 16 and name H1') 4.900 3.100 1.0 assign (resid 48 and name HZ) (resid 16 and name H1') 3.700 1.900 1.0 assign (resid 48 and name HE#) (resid 16 and name H3') 5.000 3.200 1.0 assign (resid 48 and name HD#) (resid 16 and name H3') 2.700 0.900 1.0 assign (resid 48 and name HZ) (resid 16 and name H3') 2.300 0.500 1.0 assign (resid 48 and name HE#) (resid 16 and name H4') 4.700 2.900 1.0 assign (resid 48 and name HD#) (resid 16 and name H4') 2.700 0.900 1.0 assign (resid 48 and name HZ) (resid 16 and name H4') 3.200 1.400 1.0 assign (resid 48 and name HZ) (resid 16 and name H2'') 3.900 2.100 1.0 assign (resid 71 and name HB#) (resid 3 and name H8) 4.400 2.600 1.0 assign (resid 71 and name HG#) (resid 3 and name H8) 3.200 1.400 1.0 assign (resid 71 and name HD#) (resid 3 and name H8) 2.600 0.800 1.0 assign (resid 82 and name HA) (resid 6 and name H41) 4.500 2.700 1.0 assign (resid 82 and name HB#) (resid 6 and name H41) 5.000 3.200 1.0 assign (resid 82 and name HG#) (resid 6 and name H41) 4.400 2.600 1.0 assign (resid 82 and name HD#) (resid 6 and name H41) 4.300 2.500 1.0 assign (resid 82 and name HB#) (resid 6 and name H42) 5.000 3.200 1.0 assign (resid 82 and name HG#) (resid 6 and name H42) 4.400 2.600 1.0 assign (resid 82 and name HD#) (resid 6 and name H42) 3.900 2.100 1.0 assign (resid 82 and name HA) (resid 7 and name H1) 5.000 3.200 1.0 assign (resid 82 and name HA) (resid 19 and name H1) 5.000 3.200 1.0 assign (resid 82 and name HB#) (resid 7 and name H1) 3.400 1.600 1.0 assign (resid 82 and name HB#) (resid 19 and name H1) 4.000 2.200 1.0 assign (resid 82 and name HG#) (resid 7 and name H1) 3.500 1.700 1.0 assign (resid 82 and name HG#) (resid 19 and name H1) 4.000 2.200 1.0 assign (resid 82 and name HD#) (resid 7 and name H1) 4.700 2.900 1.0 assign (resid 82 and name HD#) (resid 19 and name H1) 3.000 1.200 1.0 assign (resid 83 and name HA) (resid 16 and name H8) 3.000 1.200 1.0 assign (resid 83 and name HB1) (resid 16 and name H8) 3.900 2.100 1.0 assign (resid 83 and name HB2) (resid 16 and name H8) 3.900 2.100 1.0 assign (resid 83 and name HG#) (resid 16 and name H8) 3.300 1.500 1.0 assign (resid 43 and name HA#) (resid 44 and name HN) 3.1509503 1.3509503 1.7 assign (resid 44 and name HB#) (resid 44 and name HA) 3.0133148 1.2133148 1.5 assign (resid 44 and name HB#) (resid 44 and name HN) 3.2924844 1.4924844 1.7 assign (resid 44 and name HB#) (resid 45 and name HN) 3.2745019 1.4745019 1.7 assign (resid 45 and name HB#) (resid 45 and name HA) 2.6890528 0.8890528 1.5 assign (resid 45 and name HB#) (resid 45 and name HD#) 2.5824042 0.7824042 1.75 assign (resid 45 and name HB#) (resid 45 and name HE) 3.4201627 1.6201627 1.5 assign (resid 45 and name HB#) (resid 45 and name HG#) 2.2008657 0.4008657 1.75 assign (resid 45 and name HB#) (resid 45 and name HN) 2.7632324 0.9632324 1.7 assign (resid 45 and name HB#) (resid 46 and name HN) 3.3294443 1.5294443 1.7 assign (resid 45 and name HD#) (resid 45 and name HA) 3.1606001 1.3606001 1.5 assign (resid 45 and name HD#) (resid 45 and name HE) 2.4593209 0.6593209 1.5 assign (resid 45 and name HD#) (resid 45 and name HG#) 2.660534 0.860534 1.75 assign (resid 45 and name HD#) (resid 45 and name HN) 3.463611 1.663611 1.7 assign (resid 45 and name HD#) (resid 46 and name HN) 3.511026 1.711026 1.7 assign (resid 45 and name HG#) (resid 45 and name HA) 2.7255917 0.9255917 1.5 assign (resid 45 and name HG#) (resid 45 and name HE) 2.9197144 1.1197144 1.5 assign (resid 45 and name HG#) (resid 45 and name HN) 3.0660426 1.2660426 1.7 assign (resid 45 and name HG#) (resid 46 and name HN) 3.0419062 1.2419062 1.7 assign (resid 46 and name HA) (resid 45 and name HN) 3.1544262 1.3544262 1.2 assign (resid 46 and name HA) (resid 46 and name HB1) 2.2708229 0.4708229 1 assign (resid 46 and name HA) (resid 46 and name HB2) 2.3297798 0.5297798 1 assign (resid 46 and name HA) (resid 46 and name HD#) 3.0153343 1.2153343 1.5 assign (resid 46 and name HA) (resid 46 and name HE) 2.9497539 1.1497539 1 assign (resid 46 and name HA) (resid 46 and name HG#) 2.3953183 0.5953183 1.5 assign (resid 46 and name HA) (resid 46 and name HN) 2.5405852 0.7405852 1.2 assign (resid 46 and name HA) (resid 47 and name HN) 2.0301807 0.2301807 1.2 assign (resid 46 and name HB1) (resid 46 and name HB2) 1.7106899 -0.0893101 1 assign (resid 46 and name HB1) (resid 46 and name HD#) 2.4645658 0.6645658 1.5 assign (resid 46 and name HB1) (resid 46 and name HE) 2.1413872 0.3413872 1 assign (resid 46 and name HB1) (resid 46 and name HG#) 2.3400124 0.5400124 1.5 assign (resid 46 and name HB1) (resid 46 and name HN) 2.2761703 0.4761703 1.2 assign (resid 46 and name HB1) (resid 47 and name HN) 2.1041126 0.3041126 1.2 assign (resid 46 and name HB2) (resid 46 and name HD#) 2.5617271 0.7617271 1.5 assign (resid 46 and name HB2) (resid 46 and name HE) 1.9813656 0.1813656 1 assign (resid 46 and name HB2) (resid 46 and name HG#) 2.2994594 0.4994594 1.5 assign (resid 46 and name HB2) (resid 46 and name HN) 2.0926303 0.2926303 1.2 assign (resid 46 and name HB2) (resid 47 and name HN) 2.2009252 0.4009252 1.2 assign (resid 46 and name HD#) (resid 46 and name HE) 2.2156614 0.4156614 1.5 assign (resid 46 and name HD#) (resid 46 and name HG#) 2.2994451 0.4994451 1.75 assign (resid 46 and name HD#) (resid 47 and name HN) 3.2003354 1.4003354 1.7 assign (resid 46 and name HD#) (resid 46 and name HN) 3.0989592 1.2989592 1.7 assign (resid 46 and name HG#) (resid 46 and name HE) 2.5191242 0.7191242 1.5 assign (resid 46 and name HG#) (resid 46 and name HN) 2.6221751 0.8221751 1.7 assign (resid 46 and name HG#) (resid 47 and name HN) 3.022042 1.222042 1.7 assign (resid 47 and name HA) (resid 47 and name HB) 2.7846253 0.9846253 1 assign (resid 47 and name HA) (resid 47 and name HD#) 3.2984292 1.4984292 1.5 assign (resid 47 and name HA) (resid 47 and name HG1#) 2.7648538 0.9648538 1.5 assign (resid 47 and name HA) (resid 47 and name HG2#) 2.8803075 1.0803075 1.5 assign (resid 47 and name HA) (resid 47 and name HN) 2.9282659 1.1282659 1.2 assign (resid 47 and name HA) (resid 48 and name HN) 2.1721456 0.3721456 1.2 assign (resid 47 and name HB) (resid 47 and name HD#) 2.723378 0.923378 1.5 assign (resid 47 and name HB) (resid 47 and name HG1#) 2.3349174 0.5349174 1.5 assign (resid 47 and name HB) (resid 47 and name HG2#) 2.646025 0.846025 1.5 assign (resid 47 and name HB) (resid 47 and name HN) 2.587665 0.787665 1.2 assign (resid 47 and name HB) (resid 48 and name HN) 3.4862949 1.6862949 1.2 assign (resid 47 and name HD#) (resid 47 and name HG1#) 2.4919802 0.6919802 1.75 assign (resid 47 and name HD#) (resid 47 and name HN) 4.3388579 2.5388579 1.7 assign (resid 47 and name HG1#) (resid 47 and name HG2#) 2.7066969 0.9066969 1.75 assign (resid 47 and name HG1#) (resid 47 and name HN) 3.0964504 1.2964504 1.7 assign (resid 47 and name HG1#) (resid 48 and name HN) 3.6958776 1.8958776 1.7 assign (resid 47 and name HG2#) (resid 47 and name HN) 4.2266719 2.4266719 1.7 assign (resid 47 and name HG2#) (resid 48 and name HN) 3.6448869 1.8448869 1.7 assign (resid 48 and name HA) (resid 47 and name HG1#) 2.4019446 0.6019446 1.5 assign (resid 48 and name HA) (resid 48 and name HB2) 2.7872191 0.9872191 1 assign (resid 48 and name HA) (resid 48 and name HB1) 2.6193141 0.8193141 1 assign (resid 48 and name HA) (resid 48 and name HN) 2.4056034 0.6056034 1.2 assign (resid 48 and name HA) (resid 49 and name HN) 1.947927 0.147927 1.2 assign (resid 48 and name HB2) (resid 48 and name HB1) 2.3490154 0.5490154 1 assign (resid 48 and name HB2) (resid 48 and name HE#) 2.6416879 0.8416879 1.5 assign (resid 48 and name HB2) (resid 48 and name HN) 2.9351822 1.1351822 1.2 assign (resid 48 and name HB2) (resid 49 and name HN) 3.457456 1.657456 1.2 assign (resid 48 and name HB2) (resid 53 and name HD#) 3.6789814 1.8789814 1.5 assign (resid 48 and name HB1) (resid 48 and name HE#) 3.184958 1.384958 1.5 assign (resid 48 and name HB1) (resid 48 and name HN) 3.1323 1.3323 1.2 assign (resid 48 and name HB1) (resid 49 and name HN) 3.1581441 1.3581441 1.2 assign (resid 48 and name HB1) (resid 53 and name HD#) 3.6171179 1.8171179 1.5 assign (resid 48 and name HB1) (resid 53 and name HG#) 3.6244863 1.8244863 1.5 assign (resid 49 and name HG2#) (resid 48 and name HA) 4.1941319 2.3941319 1.5 assign (resid 49 and name HG2#) (resid 48 and name HB2) 5.3811431 3.5811431 1.5 assign (resid 49 and name HG2#) (resid 48 and name HB1) 5.6574126 3.8574126 1.5 assign (resid 49 and name HG2#) (resid 48 and name HD#) 5.0222207 3.2222207 1.75 assign (resid 49 and name HG2#) (resid 48 and name HE#) 5.3208282 3.5208282 1.75 assign (resid 49 and name HG2#) (resid 48 and name HN) 5.4580618 3.6580618 1.7 assign (resid 49 and name HG2#) (resid 49 and name HA) 3.1997362 1.3997362 1.5 assign (resid 49 and name HG2#) (resid 49 and name HB) 2.6697472 0.8697472 1.5 assign (resid 49 and name HG2#) (resid 49 and name HN) 3.0991068 1.2991068 1.7 assign (resid 49 and name HG2#) (resid 50 and name HD#) 3.1856186 1.3856186 1.75 assign (resid 49 and name HG2#) (resid 51 and name HA) 4.9458203 3.1458203 1.5 assign (resid 49 and name HG2#) (resid 51 and name HN) 4.3040641 2.5040641 1.7 assign (resid 49 and name HG2#) (resid 52 and name HB1) 3.6694833 1.8694833 1.5 assign (resid 49 and name HG2#) (resid 52 and name HB2) 3.9115018 2.1115018 1.5 assign (resid 49 and name HG2#) (resid 52 and name HN) 4.5896287 2.7896287 1.7 assign (resid 50 and name HA) (resid 50 and name HB#) 2.3397973 0.5397973 1.5 assign (resid 50 and name HA) (resid 50 and name HG#) 2.5918989 0.7918989 1.5 assign (resid 50 and name HA) (resid 51 and name HN) 2.9147635 1.1147635 1.2 assign (resid 50 and name HA) (resid 53 and name HB1) 2.6116122 0.8116122 1 assign (resid 50 and name HA) (resid 53 and name HB2) 2.3672104 0.5672104 1 assign (resid 50 and name HA) (resid 53 and name HG#) 2.5565429 0.7565429 1.5 assign (resid 50 and name HA) (resid 53 and name HN) 2.9828627 1.1828627 1.2 assign (resid 50 and name HB#) (resid 49 and name HA) 3.7031547 1.9031547 1.5 assign (resid 50 and name HB#) (resid 49 and name HB) 3.4025842 1.6025842 1.5 assign (resid 50 and name HB#) (resid 49 and name HG2#) 3.4033907 1.6033907 1.75 assign (resid 50 and name HB#) (resid 51 and name HN) 2.8075355 1.0075355 1.7 assign (resid 50 and name HB#) (resid 53 and name HN) 3.6016327 1.8016327 1.7 assign (resid 50 and name HD#) (resid 49 and name HA) 2.0283157 0.2283157 1.5 assign (resid 50 and name HD#) (resid 49 and name HB) 2.2212237 0.4212237 1.5 assign (resid 50 and name HD#) (resid 50 and name HB#) 2.639805 0.839805 1.75 assign (resid 50 and name HD#) (resid 50 and name HG#) 2.2780826 0.4780826 1.75 assign (resid 50 and name HD#) (resid 51 and name HN) 2.6690087 0.8690087 1.7 assign (resid 50 and name HD#) (resid 49 and name HN) 3.2103656 1.4103656 1.7 assign (resid 50 and name HG#) (resid 49 and name HA) 3.4846306 1.6846306 1.5 assign (resid 50 and name HG#) (resid 49 and name HB) 3.5275878 1.7275878 1.5 assign (resid 50 and name HG#) (resid 51 and name HN) 3.383778 1.583778 1.7 assign (resid 50 and name HG#) (resid 49 and name HG2#) 3.3285849 1.5285849 1.75 assign (resid 51 and name HA) (resid 51 and name HB1) 2.4926784 0.6926784 1 assign (resid 51 and name HA) (resid 51 and name HB2) 2.444358 0.644358 1 assign (resid 51 and name HA) (resid 51 and name HN) 2.7405313 0.9405313 1.2 assign (resid 51 and name HA) (resid 54 and name HB1) 2.9200609 1.1200609 1 assign (resid 51 and name HA) (resid 54 and name HB2) 2.6479901 0.8479901 1 assign (resid 51 and name HA) (resid 54 and name HD2#) 3.1908783 1.3908783 1.5 assign (resid 51 and name HA) (resid 54 and name HN) 3.2354563 1.4354563 1.2 assign (resid 51 and name HB1) (resid 50 and name HD#) 3.2812586 1.4812586 1.5 assign (resid 51 and name HB1) (resid 51 and name HB2) 1.6991366 -0.1008634 1 assign (resid 51 and name HB1) (resid 51 and name HD#) 3.0936905 1.2936905 1.5 assign (resid 51 and name HB1) (resid 51 and name HN) 2.2671051 0.4671051 1.2 assign (resid 51 and name HB1) (resid 52 and name HA) 3.5970436 1.7970436 1 assign (resid 51 and name HB2) (resid 50 and name HD#) 3.4517488 1.6517488 1.5 assign (resid 51 and name HB2) (resid 51 and name HN) 2.2287452 0.4287452 1.2 assign (resid 52 and name HA) (resid 52 and name HB1) 2.3905589 0.5905589 1 assign (resid 52 and name HA) (resid 52 and name HB2) 2.2273098 0.4273098 1 assign (resid 52 and name HA) (resid 52 and name HN) 2.5357535 0.7357535 1.2 assign (resid 52 and name HA) (resid 53 and name HN) 2.8524399 1.0524399 1.2 assign (resid 52 and name HA) (resid 55 and name HB#) 2.6640271 0.8640271 1 assign (resid 52 and name HA) (resid 55 and name HN) 2.8219224 1.0219224 1.2 assign (resid 52 and name HB1) (resid 49 and name HN) 2.2717946 0.4717946 1.2 assign (resid 52 and name HB1) (resid 52 and name HB2) 1.7074854 -0.0925146 1 assign (resid 52 and name HB1) (resid 52 and name HN) 1.9527614 0.1527614 1.2 assign (resid 52 and name HB1) (resid 53 and name HD#) 2.9172595 1.1172595 1.5 assign (resid 52 and name HB1) (resid 53 and name HN) 2.2291775 0.4291775 1.2 assign (resid 52 and name HB1) (resid 55 and name HB#) 3.414476 1.614476 1 assign (resid 52 and name HB2) (resid 49 and name HN) 2.4210672 0.6210672 1.2 assign (resid 52 and name HB2) (resid 52 and name HN) 2.0449071 0.2449071 1.2 assign (resid 52 and name HB2) (resid 53 and name HN) 2.427539 0.627539 1.2 assign (resid 52 and name HB2) (resid 55 and name HB#) 3.6221443 1.8221443 1 assign (resid 53 and name HA) (resid 50 and name HA) 3.7283326 1.9283326 1 assign (resid 53 and name HA) (resid 52 and name HD#) 2.6925021 0.8925021 1.5 assign (resid 53 and name HA) (resid 53 and name HB1) 2.1978937 0.3978937 1 assign (resid 53 and name HA) (resid 53 and name HB2) 2.3504718 0.5504718 1 assign (resid 53 and name HA) (resid 53 and name HD#) 2.4957125 0.6957125 1.5 assign (resid 53 and name HA) (resid 53 and name HE#) 3.2443395 1.4443395 1.5 assign (resid 53 and name HA) (resid 53 and name HG#) 2.9443336 1.1443336 1.5 assign (resid 53 and name HA) (resid 53 and name HN) 2.4217658 0.6217658 1.2 assign (resid 53 and name HA) (resid 54 and name HN) 2.7218397 0.9218397 1.2 assign (resid 53 and name HA) (resid 56 and name HB) 2.5189952 0.7189952 1 assign (resid 53 and name HA) (resid 56 and name HG1#) 3.0839592 1.2839592 1.5 assign (resid 53 and name HB1) (resid 53 and name HB2) 1.7120126 -0.0879874 1 assign (resid 53 and name HB1) (resid 53 and name HD#) 2.3138364 0.5138364 1.5 assign (resid 53 and name HB1) (resid 53 and name HG#) 2.2483899 0.4483899 1.5 assign (resid 53 and name HB1) (resid 53 and name HN) 2.3228614 0.5228614 1.2 assign (resid 53 and name HB1) (resid 54 and name HD2#) 2.0736201 0.2736201 1.5 assign (resid 53 and name HB1) (resid 54 and name HN) 2.3332847 0.5332847 1.2 assign (resid 53 and name HB1) (resid 87 and name HZ3) 2.8409309 1.0409309 1 assign (resid 53 and name HB2) (resid 53 and name HD#) 2.310525 0.510525 1.5 assign (resid 53 and name HB2) (resid 53 and name HG#) 2.2101974 0.4101974 1.5 assign (resid 53 and name HB2) (resid 53 and name HN) 2.1563032 0.3563032 1.2 assign (resid 53 and name HB2) (resid 54 and name HD2#) 2.0122193 0.2122193 1.5 assign (resid 53 and name HB2) (resid 54 and name HN) 2.1300754 0.3300754 1.2 assign (resid 53 and name HD#) (resid 53 and name HE#) 2.4411717 0.6411717 1.75 assign (resid 53 and name HD#) (resid 53 and name HG#) 2.4849312 0.6849312 1.75 assign (resid 53 and name HD#) (resid 53 and name HN) 2.1984215 0.3984215 1.7 assign (resid 53 and name HD#) (resid 54 and name HN) 3.1123828 1.3123828 1.7 assign (resid 53 and name HE#) (resid 53 and name HG#) 2.3417018 0.5417018 1.75 assign (resid 53 and name HE#) (resid 53 and name HN) 2.6612315 0.8612315 1.7 assign (resid 53 and name HG#) (resid 53 and name HN) 2.7849576 0.9849576 1.7 assign (resid 54 and name HA) (resid 54 and name HB1) 2.281469 0.481469 1 assign (resid 54 and name HA) (resid 54 and name HB2) 2.360339 0.560339 1 assign (resid 54 and name HA) (resid 54 and name HD1#) 2.5328691 0.7328691 1.5 assign (resid 54 and name HA) (resid 54 and name HD2#) 3.2241938 1.4241938 1.5 assign (resid 54 and name HA) (resid 54 and name HN) 2.3956161 0.5956161 1.2 assign (resid 54 and name HA) (resid 55 and name HN) 3.0271362 1.2271362 1.2 assign (resid 54 and name HA) (resid 57 and name HB2) 2.378998 0.578998 1 assign (resid 54 and name HA) (resid 57 and name HG) 2.7565176 0.9565176 1 assign (resid 54 and name HA) (resid 58 and name HB#) 3.5162781 1.7162781 1 assign (resid 54 and name HA) (resid 58 and name HN) 3.3404705 1.5404705 1.2 assign (resid 54 and name HB1) (resid 54 and name HB2) 1.7771649 -0.0228351 1 assign (resid 54 and name HB1) (resid 54 and name HD1#) 2.6564749 0.8564749 1.5 assign (resid 54 and name HB1) (resid 54 and name HD2#) 2.6388443 0.8388443 1.5 assign (resid 54 and name HB1) (resid 54 and name HN) 2.3572273 0.5572273 1.2 assign (resid 54 and name HB1) (resid 55 and name HN) 2.7608197 0.9608197 1.2 assign (resid 54 and name HB1) (resid 58 and name HG#) 3.7522148 1.9522148 1.5 assign (resid 54 and name HB2) (resid 54 and name HD1#) 2.1900236 0.3900236 1.5 assign (resid 54 and name HB2) (resid 54 and name HD2#) 2.0663863 0.2663863 1.5 assign (resid 54 and name HB2) (resid 54 and name HN) 2.184475 0.384475 1.2 assign (resid 54 and name HB2) (resid 55 and name HN) 2.5526675 0.7526675 1.2 assign (resid 54 and name HB2) (resid 58 and name HG#) 3.3069597 1.5069597 1.5 assign (resid 54 and name HB2) (resid 94 and name HB1) 3.5316424 1.7316424 1 assign (resid 54 and name HD1#) (resid 54 and name HG) 2.5765635 0.7765635 1.5 assign (resid 54 and name HD1#) (resid 54 and name HN) 3.7729435 1.9729435 1.7 assign (resid 54 and name HD1#) (resid 55 and name HN) 4.1760497 2.3760497 1.7 assign (resid 54 and name HD1#) (resid 58 and name HG#) 4.4550367 2.6550367 1.75 assign (resid 54 and name HD1#) (resid 94 and name HB1) 3.4625937 1.6625937 1.5 assign (resid 54 and name HD1#) (resid 94 and name HB2) 3.2404972 1.4404972 1.5 assign (resid 54 and name HD1#) (resid 94 and name HG) 3.2583314 1.4583314 1.5 assign (resid 54 and name HD2#) (resid 53 and name HN) 4.4062813 2.6062813 1.7 assign (resid 54 and name HD2#) (resid 54 and name HG) 2.7486906 0.9486906 1.5 assign (resid 54 and name HD2#) (resid 54 and name HN) 3.9461305 2.1461305 1.7 assign (resid 54 and name HD2#) (resid 55 and name HN) 4.4951302 2.6951302 1.7 assign (resid 54 and name HD2#) (resid 58 and name HG#) 4.9467596 3.1467596 1.75 assign (resid 54 and name HD2#) (resid 94 and name HB1) 3.9111081 2.1111081 1.5 assign (resid 54 and name HD2#) (resid 94 and name HG) 3.5994459 1.7994459 1.5 assign (resid 54 and name HD2#) (resid 95 and name HA) 2.901127 1.101127 1.5 assign (resid 54 and name HG) (resid 54 and name HA) 2.8908512 1.0908512 1 assign (resid 54 and name HG) (resid 54 and name HB1) 2.503785 0.703785 1 assign (resid 54 and name HG) (resid 54 and name HN) 2.5436621 0.7436621 1.2 assign (resid 54 and name HG) (resid 55 and name HN) 3.5926599 1.7926599 1.2 assign (resid 54 and name HG) (resid 58 and name HG#) 3.9274122 2.1274122 1.5 assign (resid 54 and name HG) (resid 94 and name HB1) 2.8850776 1.0850776 1 assign (resid 54 and name HG) (resid 94 and 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(resid 87 and name HZ2) (resid 48 and name HD#) 2.6025038 0.8025038 1.5 assign (resid 87 and name HZ2) (resid 53 and name HD#) 3.47393 1.67393 1.5 assign (resid 87 and name HZ2) (resid 56 and name HG2#) 3.2429945 1.4429945 1.5 assign (resid 87 and name HZ2) (resid 79 and name HD#) 3.2429945 1.4429945 1.5 assign (resid 87 and name HZ2) (resid 87 and name HZ3) 3.2925391 1.4925391 1 assign (resid 87 and name HZ3) (resid 56 and name HN) 3.3140345 1.5140345 1.2
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