NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
24053 |
2k02   |
15634 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
ASSI { 37}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 3 and name HN ))
3.400 1.400 1.400 peak 37 spectrum 1 weight 0.10000E+01 volume 0.55257E-03 ppm1 7.696 ppm2 8.821 CV 1
OR { 37}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 9 and name HN ))
ASSI { 38}
(( segid " " and resid 6 and name HN ))
( segid " " and resid 4 and name HD1%)
4.700 2.800 1.300 peak 38 spectrum 1 weight 0.10000E+01 volume 0.17779E-03 ppm1 7.696 ppm2 0.808 CV 1
OR { 38}
(( segid " " and resid 6 and name HN ))
( segid " " and resid 7 and name HG2%)
ASSI { 46}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 8 and name HB3 ))
5.800 4.200 0.200 peak 46 spectrum 1 weight 0.10000E+01 volume 0.53527E-04 ppm1 7.635 ppm2 1.997 CV 1
OR { 46}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 10 and name HB2 ))
ASSI { 63}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 6 and name HN ))
2.900 1.100 1.100 peak 63 spectrum 1 weight 0.10000E+01 volume 0.13455E-02 ppm1 8.222 ppm2 7.693 CV 1
OR { 63}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 10 and name HN ))
ASSI { 76}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 10 and name HA ))
2.700 0.900 0.900 peak 76 spectrum 1 weight 0.10000E+01 volume 0.18931E-02 ppm1 7.696 ppm2 4.347 CV 1
OR { 76}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 21 and name HA ))
ASSI { 141}
(( segid " " and resid 7 and name HN ))
( segid " " and resid 11 and name HD2%)
6.000 5.800 0.000 peak 141 spectrum 1 weight 0.10000E+01 volume 0.20084E-04 ppm1 7.636 ppm2 0.869 CV 1
OR { 141}
(( segid " " and resid 7 and name HN ))
( segid " " and resid 22 and name HD2%)
ASSI { 147}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HA2 ))
3.300 1.400 1.400 peak 147 spectrum 1 weight 0.10000E+01 volume 0.80433E-03 ppm1 8.175 ppm2 4.343 CV 1
OR { 147}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HA ))
ASSI { 203}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 18 and name HB2 ))
6.000 4.500 0.000 peak 203 spectrum 1 weight 0.10000E+01 volume 0.13455E-04 ppm1 9.135 ppm2 1.633 CV 1
OR { 203}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 20 and name HD3 ))
ASSI { 222}
(( segid " " and resid 21 and name HN ))
( segid " " and resid 33 and name HG2%)
5.800 4.200 0.200 peak 222 spectrum 1 weight 0.10000E+01 volume 0.57946E-04 ppm1 7.068 ppm2 0.728 CV 1
OR { 222}
(( segid " " and resid 21 and name HN ))
( segid " " and resid 22 and name HD1%)
ASSI { 223}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 19 and name HA ))
3.900 1.900 1.900 peak 223 spectrum 1 weight 0.10000E+01 volume 0.29790E-03 ppm1 7.068 ppm2 3.850 CV 1
OR { 223}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 22 and name HA ))
ASSI { 236}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 22 and name HB3 ))
2.800 1.000 1.000 peak 236 spectrum 1 weight 0.10000E+01 volume 0.17874E-02 ppm1 7.697 ppm2 1.964 CV 1
OR { 236}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 10 and name HB2 ))
ASSI { 237}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 21 and name HB2 ))
1.600 0.300 0.600 peak 237 spectrum 1 weight 0.10000E+01 volume 0.33538E-01 ppm1 7.697 ppm2 2.161 CV 1
OR { 237}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 10 and name HB3 ))
ASSI { 254}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 22 and name HG ))
6.000 4.700 0.000 peak 254 spectrum 1 weight 0.10000E+01 volume 0.50741E-04 ppm1 7.905 ppm2 1.531 CV 1
OR { 254}
(( segid " " and resid 23 and name HN ))
( segid " " and resid 24 and name HB% )
ASSI { 285}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 25 and name HA ))
3.600 1.600 1.600 peak 285 spectrum 1 weight 0.10000E+01 volume 0.41802E-03 ppm1 7.972 ppm2 4.136 CV 1
OR { 285}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 24 and name HA ))
ASSI { 313}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 31 and name HD3 ))
3.100 1.200 1.200 peak 313 spectrum 1 weight 0.10000E+01 volume 0.49586E-03 ppm1 9.150 ppm2 3.770 CV 1
OR { 313}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HA ))
ASSI { 315}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HG3 ))
2.800 1.000 1.000 peak 315 spectrum 1 weight 0.10000E+01 volume 0.13166E-02 ppm1 9.149 ppm2 2.452 CV 1
OR { 315}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HB3 ))
ASSI { 322}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 33 and name HG12))
4.300 2.300 1.700 peak 322 spectrum 1 weight 0.10000E+01 volume 0.36229E-03 ppm1 7.050 ppm2 0.864 CV 1
OR { 322}
(( segid " " and resid 32 and name HN ))
( segid " " and resid 32 and name HD2%)
ASSI { 346}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 32 and name HB2 ))
4.300 2.300 1.700 peak 346 spectrum 1 weight 0.10000E+01 volume 0.48145E-03 ppm1 7.232 ppm2 1.426 CV 1
OR { 346}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 33 and name HG13))
ASSI { 358}
(( segid " " and resid 34 and name HN ))
( segid " " and resid 35 and name HB% )
4.900 3.000 1.100 peak 358 spectrum 1 weight 0.10000E+01 volume 0.22967E-03 ppm1 9.040 ppm2 1.430 CV 1
OR { 358}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 33 and name HG13))
ASSI { 383}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 36 and name HB3 ))
2.900 2.900 3.100 peak 383 spectrum 1 weight 0.10000E+01 volume 0.49875E-02 ppm1 7.329 ppm2 2.154 CV 1
OR { 383}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 33 and name HB ))
ASSI { 455}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 42 and name HA ))
3.800 1.800 1.800 peak 455 spectrum 1 weight 0.10000E+01 volume 0.27195E-03 ppm1 7.650 ppm2 4.240 CV 1
OR { 455}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 41 and name HA ))
ASSI { 458}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 44 and name HN ))
3.000 1.100 1.100 peak 458 spectrum 1 weight 0.10000E+01 volume 0.81015E-03 ppm1 7.650 ppm2 8.040 CV 1
OR { 458}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 42 and name HN ))
ASSI { 460}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 44 and name HA2 ))
3.400 1.500 1.500 peak 460 spectrum 1 weight 0.10000E+01 volume 0.66393E-03 ppm1 8.036 ppm2 4.222 CV 1
OR { 460}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 41 and name HA ))
ASSI { 516}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 75 and name HA ))
3.700 1.700 1.700 peak 516 spectrum 1 weight 0.10000E+01 volume 0.74283E-03 ppm1 9.049 ppm2 4.724 CV 1
OR { 516}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 74 and name HA ))
ASSI { 528}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 73 and name HB3 ))
4.000 2.000 2.000 peak 528 spectrum 1 weight 0.10000E+01 volume 0.41899E-03 ppm1 8.721 ppm2 1.758 CV 1
OR { 528}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 72 and name HB3 ))
ASSI { 596}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 57 and name HA ))
2.900 1.100 1.100 peak 596 spectrum 1 weight 0.10000E+01 volume 0.11532E-02 ppm1 8.322 ppm2 4.382 CV 1
OR { 596}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 58 and name HA ))
ASSI { 606}
(( segid " " and resid 59 and name HN ))
(( segid " " and resid 58 and name HA ))
3.300 1.400 1.400 peak 606 spectrum 1 weight 0.10000E+01 volume 0.80334E-03 ppm1 8.477 ppm2 4.386 CV 1
OR { 606}
(( segid " " and resid 59 and name HN ))
(( segid " " and resid 57 and name HA ))
ASSI { 649}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 62 and name HB2 ))
1.600 1.600 4.400 peak 649 spectrum 1 weight 0.10000E+01 volume 0.53623E-01 ppm1 8.445 ppm2 1.709 CV 1
OR { 649}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 72 and name HB3 ))
ASSI { 726}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 73 and name HB3 ))
3.500 1.600 1.600 peak 726 spectrum 1 weight 0.10000E+01 volume 0.81690E-03 ppm1 8.580 ppm2 1.746 CV 1
OR { 726}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 72 and name HB3 ))
ASSI { 727}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 73 and name HB2 ))
3.300 1.400 1.400 peak 727 spectrum 1 weight 0.10000E+01 volume 0.85519E-03 ppm1 8.580 ppm2 1.534 CV 1
OR { 727}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 72 and name HG3 ))
ASSI { 755}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 75 and name HA ))
3.000 1.100 1.100 peak 755 spectrum 1 weight 0.10000E+01 volume 0.66208E-03 ppm1 9.026 ppm2 4.733 CV 1
OR { 755}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 18 and name HA ))
ASSI { 39}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 5 and name HA ))
6.000 4.500 0.000 peak 39 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.967 ppm2 4.032 CV 1
OR { 39}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 6 and name HA ))
ASSI { 42}
( segid " " and resid 4 and name HD2%)
(( segid " " and resid 40 and name HA ))
3.100 1.200 1.200 peak 42 spectrum 1 weight 0.10000E+01 volume 0.43218E-02 ppm1 0.891 ppm2 3.966 CV 1
OR { 42}
( segid " " and resid 4 and name HD2%)
(( segid " " and resid 4 and name HA ))
ASSI { 68}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 10 and name HN ))
2.400 0.700 0.700 peak 68 spectrum 1 weight 0.10000E+01 volume 0.10077E-01 ppm1 1.978 ppm2 7.696 CV 1
OR { 68}
(( segid " " and resid 5 and name HB2 ))
(( segid " " and resid 6 and name HN ))
ASSI { 121}
(( segid " " and resid 10 and name HG3 ))
( segid " " and resid 22 and name HD2%)
3.500 1.500 1.500 peak 121 spectrum 1 weight 0.10000E+01 volume 0.14938E-02 ppm1 2.472 ppm2 0.856 CV 1
OR { 121}
(( segid " " and resid 10 and name HG3 ))
( segid " " and resid 11 and name HD2%)
ASSI { 173}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 32 and name HB3 ))
2.200 0.600 0.600 peak 173 spectrum 1 weight 0.10000E+01 volume 0.24298E-01 ppm1 4.170 ppm2 1.751 CV 1
OR { 173}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HB2 ))
ASSI { 228}
(( segid " " and resid 20 and name HB2 ))
(( segid " " and resid 20 and name HN ))
3.900 1.900 1.900 peak 228 spectrum 1 weight 0.10000E+01 volume 0.90803E-03 ppm1 1.737 ppm2 9.137 CV 1
OR { 228}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 17 and name HN ))
ASSI { 229}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HG2 ))
3.800 1.800 1.800 peak 229 spectrum 1 weight 0.10000E+01 volume 0.12467E-02 ppm1 5.214 ppm2 1.317 CV 1
OR { 229}
(( segid " " and resid 16 and name HA ))
( segid " " and resid 77 and name HB% )
ASSI { 277}
(( segid " " and resid 18 and name HB2 ))
(( segid " " and resid 17 and name HB3 ))
3.100 3.100 2.900 peak 277 spectrum 1 weight 0.10000E+01 volume 0.55966E-02 ppm1 1.610 ppm2 2.258 CV 1
OR { 277}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 17 and name HB3 ))
ASSI { 288}
(( segid " " and resid 19 and name HA ))
( segid " " and resid 22 and name HD1%)
3.600 1.600 1.600 peak 288 spectrum 1 weight 0.10000E+01 volume 0.11491E-02 ppm1 3.817 ppm2 0.717 CV 1
OR { 288}
(( segid " " and resid 19 and name HA ))
( segid " " and resid 33 and name HG2%)
ASSI { 305}
(( segid " " and resid 62 and name HG3 ))
(( segid " " and resid 62 and name HE3 ))
2.800 1.000 1.000 peak 305 spectrum 1 weight 0.10000E+01 volume 0.42223E-02 ppm1 1.381 ppm2 2.943 CV 1
OR { 305}
(( segid " " and resid 20 and name HG3 ))
(( segid " " and resid 20 and name HE2 ))
OR { 305}
(( segid " " and resid 62 and name HG2 ))
(( segid " " and resid 62 and name HE2 ))
OR { 305}
(( segid " " and resid 62 and name HG3 ))
(( segid " " and resid 62 and name HE2 ))
ASSI { 344}
(( segid " " and resid 29 and name HB3 ))
(( segid " " and resid 29 and name HG3 ))
6.000 4.500 0.000 peak 344 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.451 ppm2 2.155 CV 1
OR { 344}
(( segid " " and resid 21 and name HG3 ))
(( segid " " and resid 21 and name HB2 ))
OR { 344}
(( segid " " and resid 21 and name HG2 ))
(( segid " " and resid 21 and name HB2 ))
ASSI { 405}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 27 and name HN ))
2.400 0.700 0.700 peak 405 spectrum 1 weight 0.10000E+01 volume 0.94798E-02 ppm1 4.138 ppm2 7.756 CV 1
OR { 405}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 36 and name HN ))
ASSI { 443}
(( segid " " and resid 49 and name HB ))
( segid " " and resid 49 and name HG2%)
2.200 0.600 0.600 peak 443 spectrum 1 weight 0.10000E+01 volume 0.18224E-01 ppm1 1.618 ppm2 0.792 CV 1
OR { 443}
(( segid " " and resid 26 and name HB3 ))
( segid " " and resid 26 and name HD2%)
OR { 443}
(( segid " " and resid 26 and name HB2 ))
( segid " " and resid 26 and name HD2%)
ASSI { 444}
(( segid " " and resid 26 and name HB3 ))
( segid " " and resid 26 and name HD1%)
6.000 6.000 0.000 peak 444 spectrum 1 weight 0.10000E+01 volume 0.82841E-05 ppm1 1.618 ppm2 0.631 CV 1
OR { 444}
(( segid " " and resid 49 and name HB ))
( segid " " and resid 49 and name HD1%)
OR { 444}
(( segid " " and resid 26 and name HB2 ))
( segid " " and resid 26 and name HD1%)
ASSI { 458}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 31 and name HD3 ))
2.100 0.600 0.600 peak 458 spectrum 1 weight 0.10000E+01 volume 0.59151E-02 ppm1 2.064 ppm2 3.761 CV 1
OR { 458}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 30 and name HA ))
ASSI { 461}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 30 and name HB3 ))
6.000 4.500 0.000 peak 461 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.064 ppm2 2.149 CV 1
OR { 461}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 27 and name HB3 ))
ASSI { 479}
( segid " " and resid 28 and name HG2%)
(( segid " " and resid 27 and name HA ))
6.000 6.000 0.000 peak 479 spectrum 1 weight 0.10000E+01 volume 0.31469E-05 ppm1 1.212 ppm2 3.954 CV 1
OR { 479}
( segid " " and resid 28 and name HG2%)
(( segid " " and resid 4 and name HA ))
ASSI { 484}
(( segid " " and resid 30 and name HB3 ))
(( segid " " and resid 30 and name HA ))
2.600 0.900 0.900 peak 484 spectrum 1 weight 0.10000E+01 volume 0.66122E-02 ppm1 2.166 ppm2 3.752 CV 1
OR { 484}
(( segid " " and resid 30 and name HB3 ))
(( segid " " and resid 31 and name HD3 ))
ASSI { 485}
(( segid " " and resid 30 and name HG3 ))
(( segid " " and resid 30 and name HA ))
2.500 0.800 0.800 peak 485 spectrum 1 weight 0.10000E+01 volume 0.90803E-02 ppm1 2.449 ppm2 3.752 CV 1
OR { 485}
(( segid " " and resid 29 and name HB3 ))
(( segid " " and resid 31 and name HD3 ))
ASSI { 493}
(( segid " " and resid 30 and name HG3 ))
(( segid " " and resid 30 and name HG2 ))
6.000 4.500 0.000 peak 493 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.450 ppm2 2.128 CV 1
OR { 493}
(( segid " " and resid 29 and name HB3 ))
(( segid " " and resid 29 and name HG3 ))
ASSI { 542}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 32 and name HB2 ))
2.800 1.000 1.000 peak 542 spectrum 1 weight 0.10000E+01 volume 0.31667E-02 ppm1 4.151 ppm2 1.444 CV 1
OR { 542}
(( segid " " and resid 32 and name HA ))
( segid " " and resid 35 and name HB% )
ASSI { 586}
( segid " " and resid 33 and name HD1%)
(( segid " " and resid 33 and name HB ))
3.300 1.400 1.400 peak 586 spectrum 1 weight 0.10000E+01 volume 0.38240E-02 ppm1 0.432 ppm2 2.179 CV 1
OR { 586}
( segid " " and resid 33 and name HD1%)
(( segid " " and resid 36 and name HB3 ))
ASSI { 655}
(( segid " " and resid 37 and name HA ))
( segid " " and resid 4 and name HD2%)
3.300 1.400 1.400 peak 655 spectrum 1 weight 0.10000E+01 volume 0.31867E-02 ppm1 3.407 ppm2 0.862 CV 1
OR { 655}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 48 and name HB3 ))
ASSI { 664}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 39 and name HB2 ))
6.000 6.000 0.000 peak 664 spectrum 1 weight 0.10000E+01 volume 0.15814E-05 ppm1 4.014 ppm2 1.952 CV 1
OR { 664}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 39 and name HB3 ))
OR { 664}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 40 and name HB3 ))
ASSI { 677}
(( segid " " and resid 38 and name HG2 ))
(( segid " " and resid 39 and name HN ))
2.700 0.900 0.900 peak 677 spectrum 1 weight 0.10000E+01 volume 0.13384E-01 ppm1 2.279 ppm2 7.790 CV 1
OR { 677}
(( segid " " and resid 38 and name HG2 ))
(( segid " " and resid 38 and name HN ))
ASSI { 678}
(( segid " " and resid 38 and name HG3 ))
(( segid " " and resid 39 and name HN ))
4.100 2.100 1.900 peak 678 spectrum 1 weight 0.10000E+01 volume 0.14938E-02 ppm1 2.530 ppm2 7.790 CV 1
OR { 678}
(( segid " " and resid 38 and name HG3 ))
(( segid " " and resid 38 and name HN ))
ASSI { 693}
(( segid " " and resid 39 and name HB3 ))
(( segid " " and resid 36 and name HA ))
2.400 0.700 0.700 peak 693 spectrum 1 weight 0.10000E+01 volume 0.94600E-02 ppm1 1.952 ppm2 3.940 CV 1
OR { 693}
(( segid " " and resid 39 and name HB2 ))
(( segid " " and resid 36 and name HA ))
OR { 693}
(( segid " " and resid 39 and name HB3 ))
(( segid " " and resid 40 and name HA ))
ASSI { 883}
( segid " " and resid 49 and name HG2%)
(( segid " " and resid 74 and name HA ))
6.000 4.400 0.000 peak 883 spectrum 1 weight 0.10000E+01 volume 0.89236E-04 ppm1 0.791 ppm2 4.734 CV 1
OR { 883}
( segid " " and resid 49 and name HG2%)
(( segid " " and resid 75 and name HA ))
ASSI { 900}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 73 and name HB3 ))
6.000 4.500 0.000 peak 900 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.945 ppm2 1.751 CV 1
OR { 900}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 72 and name HB3 ))
ASSI { 930}
(( segid " " and resid 52 and name HB ))
(( segid " " and resid 52 and name HN ))
3.600 1.600 1.600 peak 930 spectrum 1 weight 0.10000E+01 volume 0.13205E-02 ppm1 4.183 ppm2 8.458 CV 1
OR { 930}
(( segid " " and resid 52 and name HB ))
(( segid " " and resid 53 and name HN ))
ASSI { 935}
( segid " " and resid 52 and name HG2%)
(( segid " " and resid 52 and name HA ))
3.100 1.200 1.200 peak 935 spectrum 1 weight 0.10000E+01 volume 0.66724E-02 ppm1 1.136 ppm2 4.517 CV 1
OR { 935}
( segid " " and resid 52 and name HG2%)
(( segid " " and resid 51 and name HA ))
ASSI { 939}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 53 and name HB3 ))
2.100 0.600 0.600 peak 939 spectrum 1 weight 0.10000E+01 volume 0.22904E-01 ppm1 4.450 ppm2 3.882 CV 1
OR { 939}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 60 and name HB3 ))
ASSI { 947}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 53 and name HN ))
3.000 1.100 1.100 peak 947 spectrum 1 weight 0.10000E+01 volume 0.30273E-02 ppm1 4.450 ppm2 8.490 CV 1
OR { 947}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 57 and name HN ))
ASSI { 951}
(( segid " " and resid 63 and name HB2 ))
(( segid " " and resid 63 and name HA ))
2.700 0.900 0.900 peak 951 spectrum 1 weight 0.10000E+01 volume 0.54771E-02 ppm1 3.843 ppm2 4.426 CV 1
OR { 951}
(( segid " " and resid 60 and name HB2 ))
(( segid " " and resid 60 and name HA ))
OR { 951}
(( segid " " and resid 63 and name HB3 ))
(( segid " " and resid 63 and name HA ))
ASSI { 962}
(( segid " " and resid 6 and name HB2 ))
(( segid " " and resid 6 and name HB3 ))
6.000 4.500 0.000 peak 962 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.912 ppm2 2.246 CV 1
OR { 962}
(( segid " " and resid 54 and name HB2 ))
(( segid " " and resid 54 and name HG3 ))
ASSI { 970}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 54 and name HB3 ))
5.300 3.600 0.700 peak 970 spectrum 1 weight 0.10000E+01 volume 0.12308E-03 ppm1 4.217 ppm2 2.035 CV 1
OR { 970}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 66 and name HB3 ))
ASSI { 971}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 54 and name HB2 ))
2.000 0.500 0.500 peak 971 spectrum 1 weight 0.10000E+01 volume 0.29675E-01 ppm1 4.217 ppm2 1.932 CV 1
OR { 971}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 66 and name HB2 ))
ASSI { 1030}
(( segid " " and resid 58 and name HB3 ))
(( segid " " and resid 58 and name HA ))
3.600 1.600 1.600 peak 1030 spectrum 1 weight 0.10000E+01 volume 0.97192E-03 ppm1 3.869 ppm2 4.373 CV 1
OR { 1030}
(( segid " " and resid 63 and name HB3 ))
(( segid " " and resid 63 and name HA ))
ASSI { 1031}
(( segid " " and resid 60 and name HB3 ))
(( segid " " and resid 60 and name HB2 ))
6.000 4.500 0.000 peak 1031 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.869 ppm2 3.818 CV 1
OR { 1031}
(( segid " " and resid 58 and name HB3 ))
(( segid " " and resid 58 and name HB2 ))
OR { 1031}
(( segid " " and resid 53 and name HB3 ))
(( segid " " and resid 53 and name HB2 ))
OR { 1031}
(( segid " " and resid 63 and name HB3 ))
(( segid " " and resid 63 and name HB2 ))
ASSI { 1034}
(( segid " " and resid 53 and name HB3 ))
(( segid " " and resid 53 and name HN ))
6.000 4.500 0.000 peak 1034 spectrum 1 weight 0.10000E+01 volume 0.61539E-04 ppm1 3.869 ppm2 8.464 CV 1
OR { 1034}
(( segid " " and resid 58 and name HB3 ))
(( segid " " and resid 59 and name HN ))
ASSI { 1038}
(( segid " " and resid 63 and name HB2 ))
(( segid " " and resid 63 and name HA ))
3.900 1.900 1.900 peak 1038 spectrum 1 weight 0.10000E+01 volume 0.57758E-03 ppm1 3.826 ppm2 4.373 CV 1
OR { 1038}
(( segid " " and resid 58 and name HB2 ))
(( segid " " and resid 58 and name HA ))
ASSI { 1040}
(( segid " " and resid 60 and name HB2 ))
(( segid " " and resid 60 and name HN ))
2.100 0.600 0.600 peak 1040 spectrum 1 weight 0.10000E+01 volume 0.24895E-01 ppm1 3.825 ppm2 8.230 CV 1
OR { 1040}
(( segid " " and resid 63 and name HB2 ))
(( segid " " and resid 63 and name HN ))
ASSI { 1057}
(( segid " " and resid 63 and name HB2 ))
(( segid " " and resid 63 and name HA ))
3.800 1.800 1.800 peak 1057 spectrum 1 weight 0.10000E+01 volume 0.63139E-03 ppm1 3.825 ppm2 4.427 CV 1
OR { 1057}
(( segid " " and resid 60 and name HB2 ))
(( segid " " and resid 60 and name HA ))
OR { 1057}
(( segid " " and resid 53 and name HB2 ))
(( segid " " and resid 53 and name HA ))
ASSI { 1058}
(( segid " " and resid 53 and name HB3 ))
(( segid " " and resid 53 and name HA ))
2.400 0.700 0.700 peak 1058 spectrum 1 weight 0.10000E+01 volume 0.12627E-01 ppm1 3.869 ppm2 4.427 CV 1
OR { 1058}
(( segid " " and resid 63 and name HB3 ))
(( segid " " and resid 63 and name HA ))
OR { 1058}
(( segid " " and resid 60 and name HB3 ))
(( segid " " and resid 60 and name HA ))
ASSI { 1061}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 58 and name HA ))
6.000 4.500 0.000 peak 1061 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.428 ppm2 4.377 CV 1
OR { 1061}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 63 and name HA ))
ASSI { 1083}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 61 and name HN ))
6.000 6.000 0.000 peak 1083 spectrum 1 weight 0.10000E+01 volume 0.13285E-06 ppm1 4.504 ppm2 8.428 CV 1
OR { 1083}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 62 and name HN ))
ASSI { 1091}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 68 and name HB2 ))
1.900 0.400 0.400 peak 1091 spectrum 1 weight 0.10000E+01 volume 0.36646E-01 ppm1 4.274 ppm2 1.711 CV 1
OR { 1091}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 62 and name HB2 ))
ASSI { 1093}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 62 and name HG3 ))
2.500 0.800 0.800 peak 1093 spectrum 1 weight 0.10000E+01 volume 0.12747E-01 ppm1 4.274 ppm2 1.395 CV 1
OR { 1093}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 62 and name HG2 ))
OR { 1093}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 68 and name HG2 ))
ASSI { 1095}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 68 and name HD3 ))
6.000 6.000 0.000 peak 1095 spectrum 1 weight 0.10000E+01 volume 0.53975E-06 ppm1 4.274 ppm2 1.627 CV 1
OR { 1095}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 62 and name HD3 ))
OR { 1095}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 62 and name HD2 ))
ASSI { 1125}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 63 and name HB2 ))
2.000 0.500 0.500 peak 1125 spectrum 1 weight 0.10000E+01 volume 0.30671E-01 ppm1 4.396 ppm2 3.824 CV 1
OR { 1125}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 60 and name HB2 ))
ASSI { 1126}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 63 and name HB3 ))
5.600 3.900 0.400 peak 1126 spectrum 1 weight 0.10000E+01 volume 0.81267E-04 ppm1 4.396 ppm2 3.871 CV 1
OR { 1126}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 60 and name HB3 ))
ASSI { 1132}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 63 and name HN ))
1.900 0.500 0.500 peak 1132 spectrum 1 weight 0.10000E+01 volume 0.44215E-01 ppm1 4.396 ppm2 8.254 CV 1
OR { 1132}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 60 and name HN ))
OR { 1132}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 64 and name HN ))
ASSI { 1155}
(( segid " " and resid 20 and name HB3 ))
(( segid " " and resid 20 and name HA ))
2.000 0.500 0.500 peak 1155 spectrum 1 weight 0.10000E+01 volume 0.38240E-01 ppm1 1.877 ppm2 4.351 CV 1
OR { 1155}
(( segid " " and resid 65 and name HB2 ))
(( segid " " and resid 65 and name HA ))
ASSI { 1226}
(( segid " " and resid 70 and name HA ))
( segid " " and resid 70 and name HB% )
2.800 1.000 1.000 peak 1226 spectrum 1 weight 0.10000E+01 volume 0.45011E-02 ppm1 4.244 ppm2 1.342 CV 1
OR { 1226}
(( segid " " and resid 69 and name HA ))
( segid " " and resid 69 and name HB% )
ASSI { 1230}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 70 and name HN ))
2.700 0.900 0.900 peak 1230 spectrum 1 weight 0.10000E+01 volume 0.55569E-02 ppm1 4.244 ppm2 8.251 CV 1
OR { 1230}
(( segid " " and resid 70 and name HA ))
(( segid " " and resid 70 and name HN ))
ASSI { 1238}
( segid " " and resid 69 and name HB% )
(( segid " " and resid 70 and name HN ))
1.700 0.400 0.500 peak 1238 spectrum 1 weight 0.10000E+01 volume 0.10077E+00 ppm1 1.338 ppm2 8.251 CV 1
OR { 1238}
( segid " " and resid 70 and name HB% )
(( segid " " and resid 70 and name HN ))
ASSI { 1254}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 72 and name HN ))
4.600 2.700 1.400 peak 1254 spectrum 1 weight 0.10000E+01 volume 0.13443E-03 ppm1 4.486 ppm2 8.433 CV 1
OR { 1254}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 61 and name HN ))
ASSI { 1301}
(( segid " " and resid 73 and name HB3 ))
(( segid " " and resid 20 and name HA ))
3.000 1.100 1.100 peak 1301 spectrum 1 weight 0.10000E+01 volume 0.44613E-02 ppm1 1.735 ppm2 4.359 CV 1
OR { 1301}
(( segid " " and resid 72 and name HB3 ))
(( segid " " and resid 31 and name HA ))
ASSI { 1321}
(( segid " " and resid 73 and name HB3 ))
(( segid " " and resid 74 and name HN ))
4.700 2.700 1.300 peak 1321 spectrum 1 weight 0.10000E+01 volume 0.29875E-03 ppm1 1.735 ppm2 8.404 CV 1
OR { 1321}
(( segid " " and resid 72 and name HB3 ))
(( segid " " and resid 72 and name HN ))
ASSI { 1429}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 22 and name HB3 ))
6.000 4.500 0.000 peak 1429 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.784 ppm2 1.976 CV 1
OR { 1429}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 10 and name HB2 ))
ASSI { 1491}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 43 and name HN ))
5.900 4.400 0.100 peak 1491 spectrum 1 weight 0.10000E+01 volume 0.37046E-04 ppm1 4.513 ppm2 7.658 CV 1
OR { 1491}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 79 and name HN ))
ASSI { 1576}
( segid " " and resid 33 and name HG2%)
( segid " " and resid 32 and name HD1%)
6.000 4.500 0.000 peak 1576 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.714 ppm2 0.816 CV 1
OR { 1576}
( segid " " and resid 33 and name HG2%)
( segid " " and resid 7 and name HG2%)
ASSI { 1586}
( segid " " and resid 7 and name HG1%)
(( segid " " and resid 10 and name HB3 ))
5.300 3.500 0.700 peak 1586 spectrum 1 weight 0.10000E+01 volume 0.12109E-03 ppm1 0.639 ppm2 2.171 CV 1
OR { 1586}
( segid " " and resid 7 and name HG1%)
(( segid " " and resid 36 and name HB3 ))
Contact the webmaster for help, if required. Thursday, May 23, 2024 6:32:23 AM GMT (wattos1)