#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jx8 s PRO 2 N 0.00 1.02 0.55 3.23 0.04 -1.26 -4.66 135.00 133.92 2jx8 s PRO 2 Ca 0.00 0.47 0.32 0.00 0.04 0.00 0.00 61.00 61.82 2jx8 s PRO 2 Cb 0.00 -1.81 1.47 0.00 0.04 0.00 0.00 34.50 34.20 2jx8 s PRO 2 CO 0.00 -2.31 1.85 1.49 0.04 0.00 0.00 177.00 178.07 2jx8 h GLU 3 N -1.59 0.00 0.21 4.56 4.22 -2.05 -1.00 114.58 118.93 2jx8 h GLU 3 Ca -0.51 0.00 -0.00 0.00 0.08 0.00 0.00 59.36 58.93 2jx8 h GLU 3 Cb 1.32 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.56 2jx8 h GLU 3 CO 0.59 0.00 -0.17 0.93 -2.18 0.00 0.00 179.01 178.19 2jx8 h GLU 4 N 0.00 -0.37 -0.16 1.92 4.39 -2.01 -0.54 114.58 117.80 2jx8 h GLU 4 Ca 0.41 0.03 -0.20 0.00 0.34 0.00 0.00 59.36 59.93 2jx8 h GLU 4 Cb 1.75 0.08 0.00 0.00 -0.10 0.00 0.00 28.75 30.49 2jx8 h GLU 4 CO -0.00 -0.25 -0.69 -0.07 -1.16 0.00 0.00 179.01 176.83 2jx8 h LEU 5 N -0.39 0.79 -1.97 1.33 3.38 -1.55 -3.02 115.31 113.89 2jx8 h LEU 5 Ca -0.01 -0.49 0.02 0.00 0.09 0.00 0.00 57.88 57.49 2jx8 h LEU 5 Cb 0.35 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 2jx8 h LEU 5 CO -0.02 1.26 0.06 0.58 0.09 0.00 0.00 178.44 180.41 2jx8 h VAL 6 N 0.48 0.98 -0.36 1.22 2.07 -1.17 -1.84 116.25 117.64 2jx8 h VAL 6 Ca -0.03 -0.01 -0.04 0.00 0.82 0.00 0.00 66.70 67.44 2jx8 h VAL 6 Cb 1.29 0.93 -0.01 0.00 -1.52 0.00 0.00 31.29 31.98 2jx8 h VAL 6 CO 0.14 0.01 0.06 0.45 0.02 0.00 0.00 177.57 178.25 2jx8 h HIS 7 N 0.04 0.63 0.25 1.57 3.86 -0.96 -3.30 115.15 117.25 2jx8 h HIS 7 Ca 0.04 -0.09 -0.01 0.00 -1.16 0.00 0.00 60.37 59.15 2jx8 h HIS 7 Cb 0.10 -0.17 0.00 0.00 1.06 0.00 0.00 27.41 28.40 2jx8 h HIS 7 CO -0.00 0.64 -0.12 0.00 0.86 0.00 0.00 177.93 179.31 2jx8 h ALA 8 N 0.91 -0.85 0.00 2.45 0.00 -1.39 -3.48 119.26 116.91 2jx8 h ALA 8 Ca 0.11 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2jx8 h ALA 8 Cb 0.35 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2jx8 h ALA 8 CO 0.01 -0.82 0.00 0.41 0.00 0.00 0.00 179.25 178.84 2jx8 n GLY 9 N -0.45 0.00 3.92 0.00 0.00 -0.95 -4.77 105.19 102.94 2jx8 n GLY 9 Ca -0.04 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.72 2jx8 n GLY 9 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2jx8 s TRP 10 N 0.00 3.51 -0.28 1.61 0.52 -1.15 -0.76 118.94 122.39 2jx8 s TRP 10 Ca 0.00 0.57 -0.17 0.00 0.02 0.00 0.00 56.10 56.52 2jx8 s TRP 10 Cb 0.00 -2.08 0.09 0.00 -1.15 0.00 0.00 33.47 30.34 2jx8 s TRP 10 CO 0.00 0.02 0.77 -1.83 0.02 0.00 0.00 176.95 175.93 2jx8 s GLU 11 N -4.21 0.64 0.07 4.98 -1.05 -1.13 -4.69 118.70 113.30 2jx8 s GLU 11 Ca 0.43 1.06 -0.30 0.00 -0.15 0.00 0.00 54.97 56.01 2jx8 s GLU 11 Cb -0.10 0.15 -0.05 0.00 -0.44 0.00 0.00 34.13 33.69 2jx8 s GLU 11 CO 0.37 -0.13 1.14 0.21 0.95 0.00 0.00 175.26 177.80 2jx8 s LYS 12 N 1.41 4.48 0.22 -4.83 2.20 -1.26 -1.76 119.74 120.20 2jx8 s LYS 12 Ca -0.08 1.69 0.05 0.00 -0.36 0.00 0.00 55.97 57.26 2jx8 s LYS 12 Cb -0.05 -3.36 -0.02 0.00 -1.51 0.00 0.00 37.83 32.89 2jx8 s LYS 12 CO -0.17 -0.16 0.19 0.00 -0.36 0.00 0.00 175.35 174.86 2jx8 s TRP 14 N -2.94 3.49 0.01 0.00 -0.11 -1.26 -1.25 118.94 116.88 2jx8 s TRP 14 Ca 0.26 -2.58 -0.30 0.00 1.22 0.00 0.00 56.10 54.69 2jx8 s TRP 14 Cb 0.01 -2.40 -0.05 0.00 -1.50 0.00 0.00 33.47 29.53 2jx8 s TRP 14 CO 0.18 -0.91 1.26 0.45 -4.62 0.00 0.00 176.95 173.31 2jx8 s SER 15 N 1.06 7.00 0.10 5.86 0.15 0.84 -4.88 113.70 123.83 2jx8 s SER 15 Ca 0.00 1.99 -0.13 0.00 0.70 0.00 0.00 55.95 58.51 2jx8 s SER 15 Cb -0.20 -2.57 -0.16 0.00 -1.71 0.00 0.00 66.02 61.38 2jx8 s SER 15 CO -0.06 -0.58 1.30 0.03 1.20 0.00 0.00 173.24 175.13 2jx8 h ARG 16 N 7.26 0.79 -0.58 5.44 3.08 -1.97 -0.46 114.38 127.94 2jx8 h ARG 16 Ca -0.38 -0.65 -0.01 0.00 0.07 0.00 0.00 59.98 59.00 2jx8 h ARG 16 Cb 1.19 0.14 -0.03 0.00 0.08 0.00 0.00 29.97 31.35 2jx8 h ARG 16 CO 0.86 1.26 0.32 0.00 -1.07 0.00 0.00 179.97 181.34 2jx8 h ARG 17 N 0.53 0.80 0.00 0.04 3.08 -1.95 -2.21 114.38 114.67 2jx8 h ARG 17 Ca -0.06 -0.09 0.00 0.00 0.07 0.00 0.00 59.98 59.90 2jx8 h ARG 17 Cb 1.41 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 31.30 2jx8 h ARG 17 CO 0.16 0.61 -0.21 0.39 -1.07 0.00 0.00 179.97 179.85 2jx8 n GLU 18 N -4.60 0.19 -3.47 0.04 -0.58 -1.23 -4.94 120.64 106.05 2jx8 n GLU 18 Ca 0.04 0.11 -0.18 0.00 -0.42 0.00 0.00 57.16 56.71 2jx8 n GLU 18 Cb 0.08 -1.68 0.09 0.00 -0.57 0.00 0.00 31.44 29.36 2jx8 n GLU 18 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 2jx8 n ASN 19 N -1.98 -2.75 -3.66 1.62 2.85 -0.22 -4.97 115.26 106.16 2jx8 n ASN 19 Ca 0.05 -0.61 0.01 0.00 -0.11 0.00 0.00 54.58 53.92 2jx8 n ASN 19 Cb 0.40 -5.07 0.00 0.00 1.24 0.00 0.00 39.78 36.35 2jx8 n ASN 19 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2jx8 s ARG 20 N -5.54 0.51 0.59 1.20 1.04 -0.99 -5.01 118.95 110.75 2jx8 s ARG 20 Ca 0.10 -0.30 -0.05 0.00 -1.04 0.00 0.00 55.73 54.44 2jx8 s ARG 20 Cb -0.04 0.16 0.01 0.00 -2.04 0.00 0.00 34.95 33.04 2jx8 s ARG 20 CO 0.73 -0.24 0.90 -1.25 -0.04 0.00 0.00 175.30 175.40 2jx8 s PRO 21 N -2.36 2.84 0.00 3.89 0.04 -1.26 -0.11 135.00 138.04 2jx8 s PRO 21 Ca 0.18 -0.08 0.00 0.00 0.04 0.00 0.00 61.00 61.14 2jx8 s PRO 21 Cb 0.03 -2.28 0.00 0.00 0.04 0.00 0.00 34.50 32.28 2jx8 s PRO 21 CO -0.02 -0.73 0.00 2.48 0.04 0.00 0.00 177.00 178.77 2jx8 n TYR 22 N -2.58 0.00 -4.54 0.56 4.11 -0.38 -4.81 117.16 109.51 2jx8 n TYR 22 Ca 0.05 0.00 -0.24 0.00 -0.00 0.00 0.00 57.90 57.71 2jx8 n TYR 22 Cb 0.58 0.00 -0.16 0.00 -0.00 0.00 0.00 39.34 39.76 2jx8 n TYR 22 CO 0.00 0.00 0.00 0.71 -0.00 0.00 0.00 176.86 177.57 2jx8 s TYR 23 N -1.43 1.34 -0.19 -3.48 1.51 -1.17 -2.62 117.35 111.30 2jx8 s TYR 23 Ca 0.00 -0.45 0.01 0.00 -1.01 0.00 0.00 57.07 55.61 2jx8 s TYR 23 Cb 0.00 -0.98 0.04 0.00 -0.11 0.00 0.00 41.96 40.91 2jx8 s TYR 23 CO 0.00 -0.23 -0.09 0.12 -1.11 0.00 0.00 175.55 174.24 2jx8 s PHE 24 N 0.55 2.25 -0.62 2.71 2.19 -0.72 -0.62 117.98 123.71 2jx8 s PHE 24 Ca -0.11 -1.47 -0.28 0.00 0.33 0.00 0.00 56.93 55.40 2jx8 s PHE 24 Cb -0.14 -1.57 0.03 0.00 -1.31 0.00 0.00 43.02 40.03 2jx8 s PHE 24 CO 0.03 -0.71 1.19 1.21 1.83 0.00 0.00 175.22 178.77 2jx8 s ASN 25 N 1.45 6.36 0.00 6.13 3.04 -0.34 -2.83 114.94 128.75 2jx8 s ASN 25 Ca -0.01 -0.08 0.10 0.00 0.04 0.00 0.00 52.86 52.91 2jx8 s ASN 25 Cb -0.16 -2.54 0.46 0.00 -1.54 0.00 0.00 41.25 37.46 2jx8 s ASN 25 CO -0.08 -1.55 1.30 -2.11 -3.04 0.00 0.00 177.10 171.62 2jx8 n ARG 26 N 8.59 0.04 -0.09 0.43 1.85 0.06 0.74 116.66 128.28 2jx8 n ARG 26 Ca 0.06 0.29 -0.22 0.00 -1.00 0.00 0.00 57.85 56.98 2jx8 n ARG 26 Cb 0.49 -1.50 -0.12 0.00 -1.05 0.00 0.00 32.46 30.28 2jx8 n ARG 26 CO 0.00 0.00 0.00 0.34 -0.01 0.00 0.00 177.63 177.96 2jx8 n PHE 27 N -1.45 0.99 -0.52 2.89 -0.00 -1.25 -4.38 117.46 113.73 2jx8 n PHE 27 Ca 0.03 0.40 0.08 0.00 -0.00 0.00 0.00 57.45 57.95 2jx8 n PHE 27 Cb 0.11 -1.10 0.25 0.00 -0.00 0.00 0.00 39.48 38.74 2jx8 n PHE 27 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.76 177.01 2jx8 n THR 28 N -4.31 1.56 -1.18 -2.13 -2.24 -1.14 -4.93 114.28 99.92 2jx8 n THR 28 Ca -0.33 -1.28 -0.09 0.00 -2.27 0.00 0.00 64.05 60.08 2jx8 n THR 28 Cb 0.74 0.21 -0.04 0.00 -2.10 0.00 0.00 70.33 69.13 2jx8 n THR 28 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2jx8 n ASN 29 N 0.51 -4.85 -4.68 3.42 4.05 0.23 -4.92 115.26 109.02 2jx8 n ASN 29 Ca 0.19 0.22 -0.31 0.00 0.45 0.00 0.00 54.58 55.13 2jx8 n ASN 29 Cb 0.69 -3.62 0.15 0.00 1.23 0.00 0.00 39.78 38.24 2jx8 n ASN 29 CO 0.00 0.00 0.00 -1.58 -3.05 0.00 0.00 177.26 172.63 2jx8 s GLN 30 N -2.60 1.15 -0.38 1.20 0.74 -1.12 -4.73 119.66 113.92 2jx8 s GLN 30 Ca 0.00 1.36 0.04 0.00 0.05 0.00 0.00 55.36 56.81 2jx8 s GLN 30 Cb 0.00 -1.76 0.16 0.00 1.10 0.00 0.00 33.01 32.51 2jx8 s GLN 30 CO 0.00 -2.48 0.40 -1.12 -0.55 0.00 0.00 175.29 171.54 2jx8 s SER 31 N -2.87 0.99 0.15 6.67 0.01 -1.26 -1.20 113.70 116.20 2jx8 s SER 31 Ca 0.65 -1.69 0.00 0.00 1.31 0.00 0.00 55.95 56.22 2jx8 s SER 31 Cb -0.21 0.59 0.00 0.00 0.21 0.00 0.00 66.02 66.60 2jx8 s SER 31 CO 0.58 -0.24 0.00 0.18 0.41 0.00 0.00 173.24 174.17 2jx8 n LEU 32 N 4.07 0.00 0.00 2.44 4.77 0.21 -4.92 117.00 123.56 2jx8 n LEU 32 Ca 0.13 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 2jx8 n LEU 32 Cb 0.46 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.55 2jx8 n LEU 32 CO 0.08 -0.19 0.15 0.79 -1.33 0.00 0.00 177.39 176.89 2jx8 n TRP 33 N -0.52 0.00 -3.65 -1.77 7.02 -1.26 -3.07 117.44 114.20 2jx8 n TRP 33 Ca 0.00 -0.03 -0.15 0.00 -1.02 0.00 0.00 57.50 56.30 2jx8 n TRP 33 Cb 0.00 -0.00 -0.08 0.00 -2.42 0.00 0.00 31.31 28.81 2jx8 n TRP 33 CO 0.00 0.00 0.00 -1.21 -2.02 0.00 0.00 177.69 174.46 2jx8 s GLU 34 N -0.05 0.82 -0.06 -0.99 0.41 -1.26 -4.77 118.70 112.80 2jx8 s GLU 34 Ca 0.00 0.19 -0.41 0.00 -0.41 0.00 0.00 54.97 54.34 2jx8 s GLU 34 Cb 0.00 0.38 -0.20 0.00 -1.78 0.00 0.00 34.13 32.54 2jx8 s GLU 34 CO 0.00 -0.22 1.18 -0.12 -0.49 0.00 0.00 175.26 175.61 2jx8 n MET 35 N 1.43 0.16 -1.36 1.61 1.56 -1.26 -4.84 117.12 114.42 2jx8 n MET 35 Ca -0.19 0.06 -0.18 0.00 -0.27 0.00 0.00 57.70 57.12 2jx8 n MET 35 Cb 0.56 -1.58 0.12 0.00 2.15 0.00 0.00 33.22 34.48 2jx8 n MET 35 CO 0.00 0.00 0.00 -0.35 -0.73 0.00 0.00 175.97 174.89 2jx8 n PRO 36 N 2.02 -0.61 -4.68 2.12 -0.04 -1.26 -5.11 135.00 127.44 2jx8 n PRO 36 Ca 0.21 -1.41 -0.30 0.00 -0.04 0.00 0.00 63.50 61.96 2jx8 n PRO 36 Cb 0.08 -0.77 -0.09 0.00 -0.04 0.00 0.00 33.50 32.67 2jx8 n PRO 36 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2jx8 s VAL 37 N -2.64 1.44 0.02 0.52 1.01 -1.26 -5.05 120.40 114.44 2jx8 s VAL 37 Ca 0.47 -2.00 -0.09 0.00 0.00 0.00 0.00 61.98 60.36 2jx8 s VAL 37 Cb -0.02 -2.51 0.00 0.00 0.00 0.00 0.00 36.38 33.86 2jx8 s VAL 37 CO 0.33 0.00 0.17 -0.76 0.00 0.00 0.00 175.10 174.84 2jx8 s LEU 38 N -3.79 1.44 -0.65 3.92 1.43 -1.26 -5.01 118.68 114.77 2jx8 s LEU 38 Ca 0.19 -0.29 0.03 0.00 -1.03 0.00 0.00 54.13 53.03 2jx8 s LEU 38 Cb 0.05 0.84 0.36 0.00 0.03 0.00 0.00 46.19 47.47 2jx8 s LEU 38 CO 0.10 -0.47 1.25 0.61 0.23 0.00 0.00 176.35 178.07 2jx8 n GLY 39 N 1.03 5.81 0.00 -3.19 0.00 -1.26 -4.76 105.19 102.81 2jx8 n GLY 39 Ca -0.21 -2.72 0.11 0.00 0.00 0.00 0.00 46.02 43.20 2jx8 n GLY 39 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2jx8 n GLN 40 N -0.31 0.00 -3.12 1.61 1.13 -1.26 -3.81 117.38 111.63 2jx8 n GLN 40 Ca 0.38 0.12 -0.18 0.00 -1.94 0.00 0.00 57.00 55.39 2jx8 n GLN 40 Cb 0.42 -1.50 -0.02 0.00 0.11 0.00 0.00 30.24 29.25 2jx8 n GLN 40 CO 0.00 0.00 0.00 1.58 -1.44 0.00 0.00 177.06 177.20 2jx8 n HIS 41 N -1.50 0.48 -0.07 1.08 -0.00 -1.26 -5.11 115.22 108.83 2jx8 n HIS 41 Ca 0.05 -3.72 0.00 0.00 0.46 0.00 0.00 57.72 54.51 2jx8 n HIS 41 Cb 0.26 -0.42 0.00 0.00 -0.12 0.00 0.00 29.99 29.71 2jx8 n HIS 41 CO 0.00 0.00 0.00 -0.25 0.46 0.00 0.00 176.34 176.55 2jx8 n ASP 42 N 0.22 -1.14 -4.69 0.26 8.00 -1.25 -4.91 116.55 113.04 2jx8 n ASP 42 Ca 0.24 -0.07 -0.41 0.00 0.71 0.00 0.00 54.79 55.26 2jx8 n ASP 42 Cb 0.66 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.72 2jx8 n ASP 42 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2jx8 s VAL 43 N -0.64 4.92 -0.56 2.53 1.01 -1.26 -5.00 120.40 121.40 2jx8 s VAL 43 Ca 0.00 1.66 -0.27 0.00 0.00 0.00 0.00 61.98 63.37 2jx8 s VAL 43 Cb 0.00 -4.14 0.03 0.00 0.00 0.00 0.00 36.38 32.27 2jx8 s VAL 43 CO 0.00 0.11 1.11 0.27 0.00 0.00 0.00 175.10 176.59 2jx8 s ILE 44 N 1.57 4.15 0.00 2.22 -5.25 -1.26 -4.85 121.20 117.78 2jx8 s ILE 44 Ca 0.41 0.72 0.00 0.00 -0.99 0.00 0.00 60.65 60.78 2jx8 s ILE 44 Cb -0.18 -4.66 0.00 0.00 2.95 0.00 0.00 42.46 40.58 2jx8 s ILE 44 CO 0.17 -1.25 0.00 -1.20 -1.79 0.00 0.00 174.94 170.87 2jx8 n SER 45 N 8.08 0.00 -2.66 4.36 7.64 -1.26 -5.10 113.62 124.68 2jx8 n SER 45 Ca 0.06 0.00 -0.01 0.00 1.01 0.00 0.00 58.87 59.94 2jx8 n SER 45 Cb 0.49 0.00 -0.00 0.00 -1.01 0.00 0.00 64.21 63.68 2jx8 n SER 45 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2jx8 n ASP 46 N -0.71 -7.06 0.00 6.43 -0.08 -1.26 -5.34 116.55 108.52 2jx8 n ASP 46 Ca 0.00 1.39 0.10 0.00 -1.51 0.00 0.00 54.79 54.77 2jx8 n ASP 46 Cb 0.00 -5.20 0.61 0.00 2.34 0.00 0.00 41.12 38.87 2jx8 n ASP 46 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51