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. 2020 Jul 24;74(8):431–442. doi: 10.1007/s10858-020-00334-w

Table 1.

500 MHz, 298 K, observed transverse relaxation rates for PioC HN amide protons

δ1H (ppm) δ15 N (ppm) residue R2 (s−1) AP error (s−1) AP R2 (s−1) IP error (s−1) AP
VAL 1
8.26 117.2 THR 2 11.1 0.4
8.42 123.7 LYS 3 15.4 1.3
8.43 121.8 LYS 4 23.0 6.9 19.1 1.5
8.76 122.3 ALA 5 25.8 7.3 23.4 0.8
9.08 115.2 SER 6 38.8 5.2 17.8 0.6
9.64 116.3 HIS 7 37.8 4.4 21.3 0.8
8.49 116.5 LYS 8 52.9 19.1 32.8 2.2
8.13 119.5 ASP 9 35.3 5.3 16.9 0.7
8.23 118.2 ALA 10 34.6 4.3 19.6 0.8
7.69 105.0 GLY 11 46.8 3.9 20.0 1.4
8.19 116.3 TYR 12 36.6 3.8 29.9 1.5
8.67 124.5 GLN 13 54.3 3.8 46.4 4.1
8.22 115.2 GLU 14 19.4 1.1
7.29 112.8 SER 15 21.9 5.8 21.6 1.0
PRO 16
7.92 116.4 ASN 17 31.2 4.4 22.8 1.1
8.17 111.6 GLY 18 43.5 5.2 25.1 1.5
8.78 126.9 ALA 19 52.6 12.0 44.4 2.8
7.62 118.4 LYS 20 41.8 10.9 17.8 0.8
7.47 115.9 ARG 21 38.0 2.8 44.4 3.1
9.47 131.4 CYS 22 313.6 19.6 n.o
8.62 97.5 GLY 23 60.3 6.2 48.8 6.3
8.62 109.8 THR 24 45.9 4.1 42.0 2.8
8.36 130.0 CYS 25 65.0 5.1 44.1 7.5
9.28 131.4 ARG 26 47.9 4.9 55.5 5.3
9.62 141.7 GLN 27 221.0 15.1 n.o
7.72 123.4 PHE 28 172.3 8.4 n.o
8.19 128.2 ARG 29 39.2 5.2 44.9 3.0
PRO 30
PRO 31
8.15 111.8 SER 32 43.5 5.2 25.1 1.5
7.55 114.9 SER 33 43.4 4.3 24.2 0.8
8.55 129.0 CYS 34 37.5 3.9 42.5 3.7
8.36 126.0 ILE 35 84.5 5.9 65.6 26
8.75 127.6 THR 36 115.0 12.3 n.o
7.00 149.9 VAL 37 161.5 10.7 n.o
8.61 122.8 GLU 38 43.0 4.0 24.2 0.8
8.43 115.7 SER 39 35.2 8.3 19.7 1.0
PRO 40
7.28 118.2 ILE 41 25.4 7.5 27.7 1.3
7.84 116.4 SER 42 36.7 3.8 42.8 2.4
9.12 121.2 GLU 43 24.1 3.4 19.2 0.5
7.98 116.8 ASN 44 25.7 5.2 27.4 1.5
7.20 102.6 GLY 45 55.5 3.8 46.2 6.5
7.86 113.7 TRP 46 73.1 5.0 54.8 14.8
6.47 118.9 CYS 47 182.7 11.0 n.o
6.79 115.2 ARG 48 57.9 5.3 74.0 28.6
7.74 154.7 LEU 49 168.4 12.4 n.o
6.02 119.5 TYR 50 56.6 14.3 n.o
5.46 119.0 ALA 51 216.6 42.0 n.o
8.33 109.7 GLY 52 39.4 4.4 23.0 1.3
8.43 120.2 LYS 53 24.9 5.0 18.0 0.9
8.04 128.5 ALA 54 7.7 0.3
8.53 124,0 TRP sc 46 53.1 4.2 33.9 2.1

Columns 5–6 refer to values observed with the R2-weighted HSQC-AP experiment, columns 7–8 to values observed with an in-phase HSQC experiment with a single exponential T2 decay prior to INEPT