#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jq8 s GLN 2 N 0.00 3.24 0.90 -0.67 0.74 -1.26 -4.87 119.66 117.75 2jq8 s GLN 2 Ca 0.00 -2.45 -0.14 0.00 0.05 0.00 0.00 55.36 52.83 2jq8 s GLN 2 Cb 0.00 -4.20 0.20 0.00 1.10 0.00 0.00 33.01 30.11 2jq8 s GLN 2 CO 0.00 -1.25 1.23 -0.85 -0.55 0.00 0.00 175.29 173.87 2jq8 n GLU 3 N 3.88 -1.07 -5.24 1.67 0.28 -1.26 -5.09 120.64 113.81 2jq8 n GLU 3 Ca 0.11 -2.08 -0.30 0.00 -0.16 0.00 0.00 57.16 54.73 2jq8 n GLU 3 Cb 0.44 -1.21 -0.16 0.00 1.43 0.00 0.00 31.44 31.94 2jq8 n GLU 3 CO 0.00 0.00 0.00 -1.12 -0.16 0.00 0.00 177.13 175.85 2jq8 s SER 4 N -5.56 2.94 -0.04 -1.84 0.01 -1.26 -4.91 113.70 103.04 2jq8 s SER 4 Ca 0.71 -0.46 -0.30 0.00 1.31 0.00 0.00 55.95 57.22 2jq8 s SER 4 Cb -0.02 -0.32 -0.03 0.00 0.21 0.00 0.00 66.02 65.86 2jq8 s SER 4 CO 0.49 0.30 1.05 0.00 0.41 0.00 0.00 173.24 175.50 2jq8 n LYS 6 N 4.50 0.00 -2.52 0.00 4.01 -1.26 -4.77 118.16 118.11 2jq8 n LYS 6 Ca 0.08 0.00 -0.21 0.00 -0.51 0.00 0.00 58.31 57.67 2jq8 n LYS 6 Cb 0.49 -0.01 0.01 0.00 -0.51 0.00 0.00 35.03 35.01 2jq8 n LYS 6 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2jq8 n GLY 7 N 2.90 4.61 0.00 0.72 0.00 -1.26 -4.43 105.19 107.74 2jq8 n GLY 7 Ca 0.00 -2.29 0.12 0.00 0.00 0.00 0.00 46.02 43.84 2jq8 n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jq8 n ARG 8 N -0.37 0.25 0.00 1.61 5.12 -1.26 -2.94 116.66 119.08 2jq8 n ARG 8 Ca 0.30 0.07 0.14 0.00 -1.93 0.00 0.00 57.85 56.43 2jq8 n ARG 8 Cb 0.72 -1.50 0.69 0.00 -1.16 0.00 0.00 32.46 31.21 2jq8 n ARG 8 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2jq8 n THR 10 N -1.37 1.55 -0.02 0.00 -2.24 -1.15 -4.51 114.28 106.54 2jq8 n THR 10 Ca 0.11 -0.68 -0.15 0.00 -2.27 0.00 0.00 64.05 61.06 2jq8 n THR 10 Cb 0.27 -1.24 -0.11 0.00 -2.10 0.00 0.00 70.33 67.16 2jq8 n THR 10 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 2jq8 h GLU 11 N 0.02 0.22 0.00 -0.78 9.09 -1.72 -3.50 114.58 117.90 2jq8 h GLU 11 Ca -0.50 -0.23 0.00 0.00 0.05 0.00 0.00 59.36 58.68 2jq8 h GLU 11 Cb 2.02 0.06 0.00 0.00 -1.65 0.00 0.00 28.75 29.18 2jq8 h GLU 11 CO -0.00 0.94 0.00 0.41 0.05 0.00 0.00 179.01 180.41 2jq8 n GLY 12 N 0.99 0.84 3.59 1.06 0.00 -0.98 -5.00 105.19 105.70 2jq8 n GLY 12 Ca -0.10 -2.25 -0.43 0.00 0.00 0.00 0.00 46.02 43.25 2jq8 n GLY 12 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2jq8 s PHE 13 N -0.92 2.69 -0.51 1.61 2.19 -1.26 -4.81 117.98 116.97 2jq8 s PHE 13 Ca 0.00 0.60 -0.19 0.00 0.33 0.00 0.00 56.93 57.67 2jq8 s PHE 13 Cb 0.00 -4.46 0.06 0.00 -1.31 0.00 0.00 43.02 37.31 2jq8 s PHE 13 CO 0.00 -1.46 0.62 1.21 1.83 0.00 0.00 175.22 177.43 2jq8 s ASN 14 N 2.81 6.22 0.59 6.13 2.47 -1.26 -4.91 114.94 126.99 2jq8 s ASN 14 Ca 0.47 -0.96 0.36 0.00 0.42 0.00 0.00 52.86 53.15 2jq8 s ASN 14 Cb -0.08 -2.29 1.83 0.00 -1.45 0.00 0.00 41.25 39.26 2jq8 s ASN 14 CO 0.30 -0.90 2.17 0.58 -3.72 0.00 0.00 177.10 175.53 2jq8 h VAL 15 N 5.86 0.18 -0.80 -5.21 2.07 -1.99 -2.12 116.25 114.24 2jq8 h VAL 15 Ca -0.28 -0.30 -0.51 0.00 0.82 0.00 0.00 66.70 66.43 2jq8 h VAL 15 Cb 1.09 1.25 -0.21 0.00 -1.52 0.00 0.00 31.29 31.90 2jq8 h VAL 15 CO 0.97 0.03 0.64 -0.67 0.02 0.00 0.00 177.57 178.57 2jq8 n ASP 16 N -3.27 7.06 -4.57 0.57 -0.08 -1.26 -4.87 116.55 110.13 2jq8 n ASP 16 Ca -0.02 -3.42 -0.26 0.00 -1.51 0.00 0.00 54.79 49.59 2jq8 n ASP 16 Cb 0.19 -1.04 -0.10 0.00 2.34 0.00 0.00 41.12 42.51 2jq8 n ASP 16 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 2jq8 s LYS 17 N -2.77 1.88 0.25 -0.67 -0.14 -0.80 -5.04 119.74 112.44 2jq8 s LYS 17 Ca 0.48 -1.92 0.23 0.00 -1.36 0.00 0.00 55.97 53.39 2jq8 s LYS 17 Cb 0.37 -1.74 0.11 0.00 -1.68 0.00 0.00 37.83 34.90 2jq8 s LYS 17 CO -0.04 0.12 1.20 0.87 -0.76 0.00 0.00 175.35 176.73 2jq8 h LYS 18 N 1.95 0.00 -3.16 1.68 1.57 -1.89 -3.45 116.57 113.28 2jq8 h LYS 18 Ca -0.42 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.19 2jq8 h LYS 18 Cb 1.25 0.00 -0.26 0.00 0.08 0.00 0.00 32.23 33.30 2jq8 h LYS 18 CO 0.71 0.00 -0.44 0.00 -0.57 0.00 0.00 179.45 179.15 2jq8 s GLN 20 N 0.19 0.99 -0.09 0.00 -1.52 -1.24 -4.96 119.66 113.03 2jq8 s GLN 20 Ca -0.00 -0.58 -0.02 0.00 -1.95 0.00 0.00 55.36 52.80 2jq8 s GLN 20 Cb -0.02 -0.97 0.04 0.00 -0.22 0.00 0.00 33.01 31.83 2jq8 s GLN 20 CO -0.00 0.26 0.05 0.00 -0.25 0.00 0.00 175.29 175.34 2jq8 s ASP 22 N 2.08 0.49 0.31 0.00 2.15 -1.26 -3.54 116.67 116.89 2jq8 s ASP 22 Ca 0.04 -1.36 0.25 0.00 0.43 0.00 0.00 52.55 51.91 2jq8 s ASP 22 Cb -0.13 0.79 1.07 0.00 -0.30 0.00 0.00 42.92 44.35 2jq8 s ASP 22 CO -0.05 -1.57 1.76 1.05 -0.17 0.00 0.00 175.17 176.19 2jq8 h GLU 23 N 2.03 0.00 -0.02 4.34 4.11 -1.96 -2.45 114.58 120.63 2jq8 h GLU 23 Ca -0.31 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.12 2jq8 h GLU 23 Cb 1.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.49 2jq8 h GLU 23 CO 0.41 0.00 0.00 1.28 0.07 0.00 0.00 179.01 180.77 2jq8 n LEU 24 N -2.38 1.50 0.24 3.06 4.77 -1.26 -4.17 117.00 118.76 2jq8 n LEU 24 Ca 0.02 -0.51 0.10 0.00 -0.03 0.00 0.00 56.01 55.59 2jq8 n LEU 24 Cb 0.23 -0.01 0.62 0.00 -2.33 0.00 0.00 43.42 41.93 2jq8 n LEU 24 CO 0.20 0.25 0.91 0.00 -1.33 0.00 0.00 177.39 177.42 2jq8 h SER 26 N 0.00 0.93 -0.77 0.00 4.64 -1.80 0.54 113.55 117.09 2jq8 h SER 26 Ca -0.00 -0.66 -0.05 0.00 -0.47 0.00 0.00 61.79 60.61 2jq8 h SER 26 Cb 0.45 -0.28 -0.03 0.00 -0.31 0.00 0.00 62.40 62.23 2jq8 h SER 26 CO 0.02 1.46 0.30 0.22 -0.87 0.00 0.00 176.83 177.96 2jq8 h TYR 27 N 0.48 1.18 0.00 4.77 3.20 -1.68 -2.73 116.97 122.18 2jq8 h TYR 27 Ca -0.08 -0.09 0.00 0.00 3.14 0.00 0.00 58.73 61.69 2jq8 h TYR 27 Cb 1.52 -0.35 0.00 0.00 1.54 0.00 0.00 36.73 39.44 2jq8 h TYR 27 CO 0.09 0.90 -0.65 1.88 -1.64 0.00 0.00 178.16 178.74 2jq8 h TYR 28 N 1.12 0.00 -6.12 -3.82 0.05 -1.47 -3.48 116.97 103.25 2jq8 h TYR 28 Ca 0.25 0.00 -0.43 0.00 0.05 0.00 0.00 58.73 58.60 2jq8 h TYR 28 Cb 0.23 0.00 0.04 0.00 1.01 0.00 0.00 36.73 38.01 2jq8 h TYR 28 CO 0.02 0.00 -0.78 1.04 -1.05 0.00 0.00 178.16 177.39 2jq8 n GLN 29 N -2.18 -5.55 -3.05 4.88 1.13 0.15 -4.95 117.38 107.81 2jq8 n GLN 29 Ca 0.03 0.65 -0.19 0.00 -1.94 0.00 0.00 57.00 55.55 2jq8 n GLN 29 Cb 0.45 -5.41 -0.03 0.00 0.11 0.00 0.00 30.24 25.36 2jq8 n GLN 29 CO 0.00 0.00 0.00 -1.13 -1.44 0.00 0.00 177.06 174.49 2jq8 n SER 30 N -2.97 -0.81 -4.66 1.08 3.41 -1.01 -5.05 113.62 103.61 2jq8 n SER 30 Ca -0.14 -2.88 -0.31 0.00 -0.26 0.00 0.00 58.87 55.29 2jq8 n SER 30 Cb 0.61 0.14 -0.09 0.00 -0.26 0.00 0.00 64.21 64.61 2jq8 n SER 30 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2jq8 h THR 33 N -0.96 0.85 -0.41 0.00 2.02 -1.95 -2.46 112.91 109.99 2jq8 h THR 33 Ca -0.45 -1.30 0.00 0.00 0.77 0.00 0.00 66.41 65.43 2jq8 h THR 33 Cb 1.26 1.79 0.00 0.00 -1.74 0.00 0.00 68.15 69.46 2jq8 h THR 33 CO 0.48 0.31 0.00 -0.90 0.37 0.00 0.00 175.52 175.79 2jq8 n ASP 34 N -3.60 3.40 -0.07 4.18 5.68 -1.26 -4.15 116.55 120.72 2jq8 n ASP 34 Ca -0.01 -2.35 -0.14 0.00 -0.50 0.00 0.00 54.79 51.79 2jq8 n ASP 34 Cb 0.45 -0.49 -0.03 0.00 -1.14 0.00 0.00 41.12 39.90 2jq8 n ASP 34 CO 0.00 0.00 0.00 0.22 -1.33 0.00 0.00 177.20 176.09 2jq8 h TYR 35 N 2.63 1.06 -0.08 2.11 3.20 -1.76 -1.42 116.97 122.71 2jq8 h TYR 35 Ca 0.00 -0.38 -0.18 0.00 3.14 0.00 0.00 58.73 61.31 2jq8 h TYR 35 Cb 1.11 -0.20 -0.00 0.00 1.54 0.00 0.00 36.73 39.17 2jq8 h TYR 35 CO 0.54 1.20 -0.73 1.79 -1.64 0.00 0.00 178.16 179.32 2jq8 h THR 36 N 0.65 1.37 -0.06 1.81 1.35 -1.80 -0.02 112.91 116.21 2jq8 h THR 36 Ca 0.01 -2.12 -0.03 0.00 -0.55 0.00 0.00 66.41 63.73 2jq8 h THR 36 Cb 1.15 2.10 -0.00 0.00 -1.73 0.00 0.00 68.15 69.66 2jq8 h THR 36 CO 0.12 0.64 -0.07 0.00 -0.25 0.00 0.00 175.52 175.96 2jq8 h ALA 37 N 0.92 0.09 0.09 6.62 0.00 -1.78 -2.92 119.26 122.28 2jq8 h ALA 37 Ca -0.03 -0.29 -0.33 0.00 0.00 0.00 0.00 54.91 54.26 2jq8 h ALA 37 Cb 1.30 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.05 2jq8 h ALA 37 CO 0.13 -0.09 -1.84 0.39 0.00 0.00 0.00 179.25 177.84 2jq8 n GLU 38 N -4.71 0.70 -0.07 0.00 -0.58 -0.54 -4.57 120.64 110.86 2jq8 n GLU 38 Ca -0.07 0.34 -0.13 0.00 -0.42 0.00 0.00 57.16 56.87 2jq8 n GLU 38 Cb 0.31 -1.71 -0.10 0.00 -0.57 0.00 0.00 31.44 29.37 2jq8 n GLU 38 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2jq8 n LYS 40 N -4.60 -1.90 -0.16 0.00 3.00 -0.99 -4.90 118.16 108.60 2jq8 n LYS 40 Ca -0.13 1.77 -0.02 0.00 -0.00 0.00 0.00 58.31 59.93 2jq8 n LYS 40 Cb 0.44 -5.31 0.05 0.00 0.00 0.00 0.00 35.03 30.21 2jq8 n LYS 40 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.40 176.40 2jq8 h PRO 41 N 1.28 0.04 0.00 1.64 0.13 -1.85 -3.45 132.00 129.80 2jq8 h PRO 41 Ca -0.07 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.06 2jq8 h PRO 41 Cb 1.05 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.17 2jq8 h PRO 41 CO 0.25 0.03 0.00 0.94 -0.23 0.00 0.00 178.00 178.99 2jq8 n GLN 42 N -5.32 0.00 -1.83 0.86 7.27 -1.26 -4.93 117.38 112.17 2jq8 n GLN 42 Ca 0.05 0.00 -0.42 0.00 0.07 0.00 0.00 57.00 56.70 2jq8 n GLN 42 Cb 0.28 -2.46 -0.03 0.00 2.41 0.00 0.00 30.24 30.44 2jq8 n GLN 42 CO 0.00 0.00 0.00 0.08 0.07 0.00 0.00 177.06 177.21 2jq8 s VAL 43 N -1.84 3.17 -0.03 1.69 1.01 -1.26 -4.99 120.40 118.16 2jq8 s VAL 43 Ca 0.00 0.32 0.07 0.00 0.00 0.00 0.00 61.98 62.38 2jq8 s VAL 43 Cb 0.00 -3.21 -0.02 0.00 0.00 0.00 0.00 36.38 33.15 2jq8 s VAL 43 CO 0.00 -0.02 -0.25 -0.89 0.00 0.00 0.00 175.10 173.94 2jq8 s THR 44 N 3.90 2.13 -0.21 3.92 2.01 -1.26 -5.11 115.64 121.02 2jq8 s THR 44 Ca 0.81 -1.07 -0.04 0.00 0.31 0.00 0.00 61.69 61.70 2jq8 s THR 44 Cb -0.39 -1.75 0.11 0.00 0.01 0.00 0.00 72.50 70.48 2jq8 s THR 44 CO 0.36 0.58 0.35 -0.60 -0.69 0.00 0.00 174.62 174.61 2jq8 s ARG 45 N -0.51 0.29 0.00 4.92 3.52 -1.26 -5.11 118.95 120.80 2jq8 s ARG 45 Ca 0.07 0.63 0.00 0.00 -0.13 0.00 0.00 55.73 56.30 2jq8 s ARG 45 Cb -0.11 -0.34 0.00 0.00 -1.56 0.00 0.00 34.95 32.94 2jq8 s ARG 45 CO 0.00 -0.51 0.00 0.41 -0.81 0.00 0.00 175.30 174.39 2jq8 n GLY 46 N 5.36 3.89 0.00 8.12 0.00 -1.26 -5.34 105.19 115.97 2jq8 n GLY 46 Ca -0.05 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.46 2jq8 n GLY 46 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66