NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
20708 |
2gcx   |
cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
ASSI { 47}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 57 and name HA ))
2.500 2.500 3.500 peak 47 spectrum 1 weight 0.10000E+01 volume 0.11673E-01 ppm1 7.967 ppm2 5.280 CV 1
OR { 47}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 52 and name HA ))
ASSI { 51}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 59 and name HA ))
2.700 2.700 3.300 peak 51 spectrum 1 weight 0.10000E+01 volume 0.11015E-01 ppm1 8.734 ppm2 4.473 CV 1
OR { 51}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 64 and name HA ))
ASSI { 54}
(( segid " " and resid 65 and name HN ))
( segid " " and resid 68 and name HG2%)
2.700 2.700 3.300 peak 54 spectrum 1 weight 0.10000E+01 volume 0.10637E-01 ppm1 7.671 ppm2 0.913 CV 1
OR { 54}
(( segid " " and resid 65 and name HN ))
( segid " " and resid 67 and name HD1%)
ASSI { 79}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 70 and name HB2 ))
2.200 0.600 0.600 peak 79 spectrum 1 weight 0.10000E+01 volume 0.78975E-02 ppm1 8.220 ppm2 1.576 CV 1
OR { 79}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 69 and name HB3 ))
ASSI { 95}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 49 and name HA ))
2.200 0.600 0.600 peak 95 spectrum 1 weight 0.10000E+01 volume 0.66353E-02 ppm1 8.946 ppm2 4.243 CV 1
OR { 95}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 15 and name HA ))
ASSI { 111}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 42 and name HA ))
2.300 0.600 0.600 peak 111 spectrum 1 weight 0.10000E+01 volume 0.53847E-02 ppm1 7.873 ppm2 4.479 CV 1
OR { 111}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 43 and name HA ))
ASSI { 115}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 49 and name HB ))
2.300 0.700 0.700 peak 115 spectrum 1 weight 0.10000E+01 volume 0.53377E-02 ppm1 8.731 ppm2 1.745 CV 1
OR { 115}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 63 and name HB3 ))
ASSI { 147}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 46 and name HA1 ))
2.400 0.700 0.700 peak 147 spectrum 1 weight 0.10000E+01 volume 0.43962E-02 ppm1 8.576 ppm2 4.277 CV 1
OR { 147}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 45 and name HA ))
ASSI { 161}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 17 and name HN ))
2.300 0.600 0.600 peak 161 spectrum 1 weight 0.10000E+01 volume 0.40102E-02 ppm1 7.415 ppm2 8.261 CV 1
OR { 161}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HN ))
ASSI { 168}
(( segid " " and resid 50 and name HN ))
( segid " " and resid 40 and name HG2%)
3.300 1.400 1.400 peak 168 spectrum 1 weight 0.10000E+01 volume 0.37938E-02 ppm1 8.946 ppm2 0.876 CV 1
OR { 168}
(( segid " " and resid 16 and name HN ))
( segid " " and resid 18 and name HG2%)
ASSI { 189}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 22 and name HN ))
2.400 0.700 0.700 peak 189 spectrum 1 weight 0.10000E+01 volume 0.32666E-02 ppm1 8.241 ppm2 7.837 CV 1
OR { 189}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 24 and name HN ))
ASSI { 273}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 45 and name HA ))
2.800 1.000 1.000 peak 273 spectrum 1 weight 0.10000E+01 volume 0.23157E-02 ppm1 8.376 ppm2 4.281 CV 1
OR { 273}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HA ))
ASSI { 304}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 16 and name HG3 ))
3.200 1.300 1.300 peak 304 spectrum 1 weight 0.10000E+01 volume 0.21841E-02 ppm1 8.964 ppm2 1.703 CV 1
OR { 304}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 16 and name HG2 ))
OR { 304}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 49 and name HB ))
ASSI { 321}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 51 and name HG12))
3.200 1.300 1.300 peak 321 spectrum 1 weight 0.10000E+01 volume 0.20616E-02 ppm1 8.717 ppm2 0.711 CV 1
OR { 321}
(( segid " " and resid 58 and name HN ))
( segid " " and resid 58 and name HD2%)
ASSI { 375}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 35 and name HB3 ))
3.600 1.600 1.600 peak 375 spectrum 1 weight 0.10000E+01 volume 0.17133E-02 ppm1 9.390 ppm2 4.285 CV 1
OR { 375}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 11 and name HA ))
ASSI { 419}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 26 and name HB2 ))
2.600 0.900 0.900 peak 419 spectrum 1 weight 0.10000E+01 volume 0.15156E-02 ppm1 8.015 ppm2 1.318 CV 1
OR { 419}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 25 and name HG3 ))
ASSI { 429}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 15 and name HB3 ))
3.100 1.200 1.200 peak 429 spectrum 1 weight 0.10000E+01 volume 0.14780E-02 ppm1 8.280 ppm2 4.143 CV 1
OR { 429}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 16 and name HA ))
ASSI { 514}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 51 and name HN ))
3.700 1.700 1.700 peak 514 spectrum 1 weight 0.10000E+01 volume 0.11203E-02 ppm1 9.051 ppm2 9.238 CV 1
OR { 514}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 40 and name HN ))
ASSI { 516}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 45 and name HB3 ))
3.400 1.400 1.400 peak 516 spectrum 1 weight 0.10000E+01 volume 0.11203E-02 ppm1 8.379 ppm2 1.917 CV 1
OR { 516}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HB2 ))
ASSI { 529}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HB3 ))
3.900 1.900 1.900 peak 529 spectrum 1 weight 0.10000E+01 volume 0.10732E-02 ppm1 7.763 ppm2 1.738 CV 1
OR { 529}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 31 and name HB2 ))
ASSI { 538}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 55 and name HB3 ))
4.000 2.000 2.000 peak 538 spectrum 1 weight 0.10000E+01 volume 0.10449E-02 ppm1 8.391 ppm2 1.951 CV 1
OR { 538}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 54 and name HB3 ))
OR { 538}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 54 and name HB2 ))
ASSI { 580}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 62 and name HA ))
3.600 1.700 1.700 peak 580 spectrum 1 weight 0.10000E+01 volume 0.91596E-03 ppm1 7.072 ppm2 3.760 CV 1
OR { 580}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 65 and name HA ))
ASSI { 605}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 44 and name HA ))
4.000 2.000 2.000 peak 605 spectrum 1 weight 0.10000E+01 volume 0.86229E-03 ppm1 7.874 ppm2 4.246 CV 1
OR { 605}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 49 and name HA ))
ASSI { 674}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 40 and name HN ))
3.800 1.800 1.800 peak 674 spectrum 1 weight 0.10000E+01 volume 0.69571E-03 ppm1 8.943 ppm2 9.229 CV 1
OR { 674}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 51 and name HN ))
ASSI { 756}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 49 and name HN ))
4.200 2.200 1.800 peak 756 spectrum 1 weight 0.10000E+01 volume 0.52341E-03 ppm1 8.943 ppm2 8.755 CV 1
OR { 756}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 60 and name HN ))
ASSI { 795}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 63 and name HE2 ))
4.900 3.000 1.100 peak 795 spectrum 1 weight 0.10000E+01 volume 0.47069E-03 ppm1 8.724 ppm2 2.834 CV 1
OR { 795}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 63 and name HE3 ))
OR { 795}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 64 and name HB2 ))
ASSI { 818}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 20 and name HB3 ))
4.900 3.100 1.100 peak 818 spectrum 1 weight 0.10000E+01 volume 0.41609E-03 ppm1 8.236 ppm2 2.348 CV 1
OR { 818}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 24 and name HG3 ))
ASSI { 897}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 69 and name HB2 ))
5.000 3.200 1.000 peak 897 spectrum 1 weight 0.10000E+01 volume 0.24570E-03 ppm1 9.292 ppm2 1.420 CV 1
OR { 897}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 10 and name HB2 ))
ASSI { 901}
(( segid " " and resid 64 and name HN ))
( segid " " and resid 60 and name HD1%)
5.200 3.400 0.800 peak 901 spectrum 1 weight 0.10000E+01 volume 0.22971E-03 ppm1 7.074 ppm2 0.715 CV 1
OR { 901}
(( segid " " and resid 64 and name HN ))
( segid " " and resid 68 and name HD1%)
ASSI { 935}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 6 and name HN ))
5.000 3.200 1.000 peak 935 spectrum 1 weight 0.10000E+01 volume 0.12237E-03 ppm1 9.243 ppm2 9.029 CV 1
OR { 935}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 52 and name HN ))
ASSI { 937}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 57 and name HA ))
5.200 3.400 0.800 peak 937 spectrum 1 weight 0.10000E+01 volume 0.11391E-03 ppm1 9.244 ppm2 5.273 CV 1
OR { 937}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 52 and name HA ))
ASSI { 993}
(( segid " " and resid 9 and name HE1 ))
(( segid " " and resid 7 and name HN ))
4.200 2.200 1.800 peak 993 spectrum 1 weight 0.10000E+01 volume 0.22782E-03 ppm1 10.261 ppm2 8.006 CV 1
OR { 993}
(( segid " " and resid 9 and name HE1 ))
(( segid " " and resid 8 and name HN ))
ASSI { 1008}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 62 and name HD2 ))
3.700 1.700 1.700 peak 1008 spectrum 1 weight 0.10000E+01 volume 0.78975E-03 ppm1 9.999 ppm2 1.639 CV 1
OR { 1008}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 61 and name HB2 ))
ASSI { 153}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 69 and name HG3 ))
2.000 0.500 0.500 peak 153 spectrum 1 weight 0.10000E+01 volume 0.27979E-01 ppm1 4.348 ppm2 1.909 CV 1
OR { 153}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 45 and name HB3 ))
OR { 153}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 69 and name HG2 ))
ASSI { 156}
(( segid " " and resid 20 and name HG2 ))
(( segid " " and resid 20 and name HB3 ))
2.000 0.500 0.500 peak 156 spectrum 1 weight 0.10000E+01 volume 0.27754E-01 ppm1 2.037 ppm2 2.367 CV 1
OR { 156}
(( segid " " and resid 24 and name HB2 ))
(( segid " " and resid 24 and name HG3 ))
OR { 156}
(( segid " " and resid 24 and name HB2 ))
(( segid " " and resid 24 and name HG2 ))
OR { 156}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 24 and name HG3 ))
ASSI { 183}
( segid " " and resid 18 and name HD1%)
( segid " " and resid 18 and name HG2%)
1.900 0.400 0.400 peak 183 spectrum 1 weight 0.10000E+01 volume 0.21689E-01 ppm1 0.709 ppm2 0.904 CV 1
OR { 183}
( segid " " and resid 68 and name HD1%)
( segid " " and resid 68 and name HG2%)
ASSI { 228}
(( segid " " and resid 30 and name HA1 ))
(( segid " " and resid 30 and name HA2 ))
1.700 0.400 0.500 peak 228 spectrum 1 weight 0.10000E+01 volume 0.15287E-01 ppm1 4.252 ppm2 3.516 CV 1
OR { 228}
(( segid " " and resid 46 and name HA1 ))
(( segid " " and resid 46 and name HA2 ))
ASSI { 229}
( segid " " and resid 70 and name HD2%)
(( segid " " and resid 70 and name HB3 ))
2.200 0.600 0.600 peak 229 spectrum 1 weight 0.10000E+01 volume 0.15265E-01 ppm1 0.731 ppm2 1.682 CV 1
OR { 229}
(( segid " " and resid 51 and name HG12))
(( segid " " and resid 51 and name HB ))
ASSI { 231}
(( segid " " and resid 63 and name HD3 ))
(( segid " " and resid 63 and name HG3 ))
2.000 0.500 0.500 peak 231 spectrum 1 weight 0.10000E+01 volume 0.14614E-01 ppm1 1.542 ppm2 1.297 CV 1
OR { 231}
(( segid " " and resid 25 and name HD3 ))
(( segid " " and resid 25 and name HG3 ))
OR { 231}
(( segid " " and resid 63 and name HD2 ))
(( segid " " and resid 63 and name HG3 ))
OR { 231}
(( segid " " and resid 25 and name HD2 ))
(( segid " " and resid 25 and name HG3 ))
ASSI { 244}
( segid " " and resid 58 and name HD1%)
(( segid " " and resid 58 and name HB2 ))
2.300 0.600 0.600 peak 244 spectrum 1 weight 0.10000E+01 volume 0.13296E-01 ppm1 0.780 ppm2 1.351 CV 1
OR { 244}
( segid " " and resid 58 and name HD1%)
(( segid " " and resid 58 and name HB3 ))
OR { 244}
( segid " " and resid 27 and name HD2%)
(( segid " " and resid 27 and name HB2 ))
ASSI { 298}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 35 and name HB3 ))
1.800 0.400 0.400 peak 298 spectrum 1 weight 0.10000E+01 volume 0.10162E-01 ppm1 4.036 ppm2 4.293 CV 1
OR { 298}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 7 and name HA ))
ASSI { 311}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 4 and name HB ))
2.300 0.700 0.700 peak 311 spectrum 1 weight 0.10000E+01 volume 0.93994E-02 ppm1 4.779 ppm2 4.293 CV 1
OR { 311}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 35 and name HB3 ))
ASSI { 364}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 48 and name HB3 ))
2.900 1.100 1.100 peak 364 spectrum 1 weight 0.10000E+01 volume 0.75650E-02 ppm1 4.627 ppm2 1.842 CV 1
OR { 364}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 62 and name HB3 ))
ASSI { 400}
( segid " " and resid 29 and name HD1%)
(( segid " " and resid 29 and name HB3 ))
2.700 0.900 0.900 peak 400 spectrum 1 weight 0.10000E+01 volume 0.65588E-02 ppm1 0.774 ppm2 1.751 CV 1
OR { 400}
( segid " " and resid 67 and name HD2%)
(( segid " " and resid 67 and name HB2 ))
ASSI { 640}
( segid " " and resid 26 and name HD2%)
(( segid " " and resid 26 and name HB3 ))
2.600 0.800 0.800 peak 640 spectrum 1 weight 0.10000E+01 volume 0.36260E-02 ppm1 0.509 ppm2 1.743 CV 1
OR { 640}
(( segid " " and resid 23 and name HG2 ))
(( segid " " and resid 23 and name HB3 ))
ASSI { 689}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 15 and name HB3 ))
2.600 0.800 0.800 peak 689 spectrum 1 weight 0.10000E+01 volume 0.32007E-02 ppm1 4.292 ppm2 4.125 CV 1
OR { 689}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HB3 ))
ASSI { 694}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 35 and name HN ))
2.900 1.100 1.100 peak 694 spectrum 1 weight 0.10000E+01 volume 0.31111E-02 ppm1 4.040 ppm2 8.433 CV 1
OR { 694}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 36 and name HN ))
ASSI { 696}
(( segid " " and resid 25 and name HD3 ))
(( segid " " and resid 25 and name HE2 ))
2.700 0.900 0.900 peak 696 spectrum 1 weight 0.10000E+01 volume 0.30888E-02 ppm1 1.546 ppm2 2.849 CV 1
OR { 696}
(( segid " " and resid 63 and name HD2 ))
(( segid " " and resid 63 and name HE2 ))
OR { 696}
(( segid " " and resid 25 and name HD2 ))
(( segid " " and resid 25 and name HE2 ))
OR { 696}
(( segid " " and resid 25 and name HD3 ))
(( segid " " and resid 25 and name HE3 ))
ASSI { 720}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 15 and name HA ))
3.300 1.400 1.400 peak 720 spectrum 1 weight 0.10000E+01 volume 0.29096E-02 ppm1 5.165 ppm2 4.303 CV 1
OR { 720}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 68 and name HA ))
ASSI { 728}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 36 and name HN ))
2.800 1.000 1.000 peak 728 spectrum 1 weight 0.10000E+01 volume 0.28651E-02 ppm1 4.779 ppm2 8.433 CV 1
OR { 728}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 35 and name HN ))
ASSI { 782}
(( segid " " and resid 23 and name HG2 ))
(( segid " " and resid 23 and name HB2 ))
2.700 0.900 0.900 peak 782 spectrum 1 weight 0.10000E+01 volume 0.25965E-02 ppm1 0.511 ppm2 1.319 CV 1
OR { 782}
( segid " " and resid 26 and name HD2%)
(( segid " " and resid 26 and name HB2 ))
ASSI { 810}
(( segid " " and resid 35 and name HB3 ))
(( segid " " and resid 35 and name HN ))
2.800 0.900 0.900 peak 810 spectrum 1 weight 0.10000E+01 volume 0.24396E-02 ppm1 4.273 ppm2 8.440 CV 1
OR { 810}
(( segid " " and resid 35 and name HB3 ))
(( segid " " and resid 36 and name HN ))
ASSI { 824}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 27 and name HN ))
2.700 0.900 0.900 peak 824 spectrum 1 weight 0.10000E+01 volume 0.23726E-02 ppm1 3.801 ppm2 8.339 CV 1
OR { 824}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 27 and name HN ))
ASSI { 911}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 61 and name HN ))
2.800 1.000 1.000 peak 911 spectrum 1 weight 0.10000E+01 volume 0.18981E-02 ppm1 4.732 ppm2 8.829 CV 1
OR { 911}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 60 and name HN ))
ASSI { 969}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 40 and name HN ))
2.700 0.900 0.900 peak 969 spectrum 1 weight 0.10000E+01 volume 0.16743E-02 ppm1 4.290 ppm2 9.232 CV 1
OR { 969}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HN ))
ASSI { 1084}
(( segid " " and resid 7 and name HB3 ))
(( segid " " and resid 7 and name HN ))
3.500 1.500 1.500 peak 1084 spectrum 1 weight 0.10000E+01 volume 0.13431E-02 ppm1 4.125 ppm2 8.012 CV 1
OR { 1084}
(( segid " " and resid 7 and name HB3 ))
(( segid " " and resid 8 and name HN ))
ASSI { 1115}
( segid " " and resid 49 and name HG1%)
( segid " " and resid 49 and name HG2%)
3.200 1.300 1.300 peak 1115 spectrum 1 weight 0.10000E+01 volume 0.12444E-02 ppm1 0.739 ppm2 0.612 CV 1
OR { 1115}
( segid " " and resid 73 and name HG2%)
( segid " " and resid 73 and name HG1%)
ASSI { 1158}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 25 and name HG3 ))
3.100 1.200 1.200 peak 1158 spectrum 1 weight 0.10000E+01 volume 0.11259E-02 ppm1 1.826 ppm2 1.352 CV 1
OR { 1158}
(( segid " " and resid 62 and name HB3 ))
(( segid " " and resid 62 and name HG3 ))
OR { 1158}
(( segid " " and resid 62 and name HB3 ))
(( segid " " and resid 62 and name HG2 ))
OR { 1158}
(( segid " " and resid 25 and name HB3 ))
(( segid " " and resid 25 and name HG3 ))
ASSI { 1173}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 4 and name HA ))
3.500 1.500 1.500 peak 1173 spectrum 1 weight 0.10000E+01 volume 0.10876E-02 ppm1 3.906 ppm2 4.750 CV 1
OR { 1173}
(( segid " " and resid 57 and name HB3 ))
(( segid " " and resid 58 and name HA ))
ASSI { 1194}
(( segid " " and resid 70 and name HA ))
(( segid " " and resid 11 and name HA ))
3.400 1.500 1.500 peak 1194 spectrum 1 weight 0.10000E+01 volume 0.10364E-02 ppm1 5.582 ppm2 4.348 CV 1
OR { 1194}
(( segid " " and resid 70 and name HA ))
(( segid " " and resid 69 and name HA ))
ASSI { 1224}
(( segid " " and resid 60 and name HB3 ))
(( segid " " and resid 61 and name HN ))
3.300 1.300 1.300 peak 1224 spectrum 1 weight 0.10000E+01 volume 0.93567E-03 ppm1 1.323 ppm2 8.812 CV 1
OR { 1224}
(( segid " " and resid 60 and name HB3 ))
(( segid " " and resid 60 and name HN ))
ASSI { 1234}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 8 and name HN ))
3.300 1.400 1.400 peak 1234 spectrum 1 weight 0.10000E+01 volume 0.91085E-03 ppm1 4.000 ppm2 8.012 CV 1
OR { 1234}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 7 and name HN ))
ASSI { 1271}
(( segid " " and resid 41 and name HA ))
( segid " " and resid 40 and name HG1%)
4.100 2.100 1.900 peak 1271 spectrum 1 weight 0.10000E+01 volume 0.83938E-03 ppm1 4.476 ppm2 0.881 CV 1
OR { 1271}
(( segid " " and resid 41 and name HA ))
( segid " " and resid 42 and name HG2%)
ASSI { 1296}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 60 and name HA ))
3.900 1.900 1.900 peak 1296 spectrum 1 weight 0.10000E+01 volume 0.78785E-03 ppm1 4.435 ppm2 4.738 CV 1
OR { 1296}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 58 and name HA ))
ASSI { 1311}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 20 and name HB3 ))
4.300 2.300 1.700 peak 1311 spectrum 1 weight 0.10000E+01 volume 0.75876E-03 ppm1 4.083 ppm2 2.349 CV 1
OR { 1311}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 24 and name HG2 ))
ASSI { 1347}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 54 and name HN ))
3.500 1.500 1.500 peak 1347 spectrum 1 weight 0.10000E+01 volume 0.69381E-03 ppm1 5.007 ppm2 9.023 CV 1
OR { 1347}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 53 and name HN ))
ASSI { 1443}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 58 and name HB3 ))
4.100 2.100 1.900 peak 1443 spectrum 1 weight 0.10000E+01 volume 0.54390E-03 ppm1 4.437 ppm2 1.333 CV 1
OR { 1443}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 60 and name HG ))
OR { 1443}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 60 and name HB3 ))
ASSI { 1504}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HN ))
3.600 1.600 1.600 peak 1504 spectrum 1 weight 0.10000E+01 volume 0.40960E-03 ppm1 5.450 ppm2 9.241 CV 1
OR { 1504}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 40 and name HN ))
ASSI { 1565}
(( segid " " and resid 50 and name HA ))
( segid " " and resid 51 and name HG2%)
4.300 2.300 1.700 peak 1565 spectrum 1 weight 0.10000E+01 volume 0.30217E-03 ppm1 5.029 ppm2 0.571 CV 1
OR { 1565}
(( segid " " and resid 50 and name HA ))
( segid " " and resid 49 and name HG2%)
ASSI { 1587}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 60 and name HN ))
4.900 3.000 1.100 peak 1587 spectrum 1 weight 0.10000E+01 volume 0.26860E-03 ppm1 0.020 ppm2 8.813 CV 1
OR { 1587}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 38 and name HN ))
ASSI { 1675}
( segid " " and resid 39 and name HG1%)
(( segid " " and resid 40 and name HN ))
4.800 2.900 1.200 peak 1675 spectrum 1 weight 0.10000E+01 volume 0.11797E-03 ppm1 1.154 ppm2 9.232 CV 1
OR { 1675}
( segid " " and resid 39 and name HG1%)
(( segid " " and resid 39 and name HN ))
! dihedral angle file generated by Csi2Aria.py
! CSI derived hbond restraint:assign (resid 25 and name N) (resid 20: 22 and name O) 3.2 1.0 0.0
! CSI derived hbond restraint:assign (resid 25 and name HN) (resid 20: 22 and name O) 2.2 1.0 0.0
! CSI derived hbond restraint:assign (resid 26 and name N) (resid 21: 23 and name O) 3.2 1.0 0.0
! CSI derived hbond restraint:assign (resid 26 and name HN) (resid 21: 23 and name O) 2.2 1.0 0.0
! CSI derived hbond restraint:assign (resid 27 and name N) (resid 22: 24 and name O) 3.2 1.0 0.0
! CSI derived hbond restraint:assign (resid 27 and name HN) (resid 22: 24 and name O) 2.2 1.0 0.0
! CSI derived hbond restraint:assign (resid 28 and name N) (resid 23: 25 and name O) 3.2 1.0 0.0
! CSI derived hbond restraint:assign (resid 28 and name HN) (resid 23: 25 and name O) 2.2 1.0 0.0
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