#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jq8 n GLN 2 N 0.00 0.00 -1.64 -0.67 1.13 -1.26 -4.95 117.38 109.99 2jq8 n GLN 2 Ca 0.00 -0.97 -0.34 0.00 -1.94 0.00 0.00 57.00 53.75 2jq8 n GLN 2 Cb 0.00 -0.12 0.02 0.00 0.11 0.00 0.00 30.24 30.26 2jq8 n GLN 2 CO 0.00 0.00 0.00 -0.85 -1.44 0.00 0.00 177.06 174.77 2jq8 n GLU 3 N 0.11 2.59 -3.87 -1.09 0.00 -1.26 -3.88 120.64 113.24 2jq8 n GLU 3 Ca -0.03 -3.07 -0.12 0.00 0.00 0.00 0.00 57.16 53.95 2jq8 n GLU 3 Cb 0.75 -2.20 -0.13 0.00 0.00 0.00 0.00 31.44 29.86 2jq8 n GLU 3 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.13 176.01 2jq8 s SER 4 N -0.79 -0.01 -0.18 -1.84 0.01 -1.26 -4.81 113.70 104.82 2jq8 s SER 4 Ca 0.55 0.01 -0.09 0.00 1.31 0.00 0.00 55.95 57.72 2jq8 s SER 4 Cb 0.43 0.09 -0.05 0.00 0.21 0.00 0.00 66.02 66.70 2jq8 s SER 4 CO -0.27 -0.06 0.13 0.00 0.41 0.00 0.00 173.24 173.44 2jq8 n LYS 6 N 3.24 0.00 -0.74 0.00 4.76 -1.26 -4.85 118.16 119.31 2jq8 n LYS 6 Ca -0.17 0.00 -0.01 0.00 -2.87 0.00 0.00 58.31 55.26 2jq8 n LYS 6 Cb 0.53 -0.06 0.20 0.00 -1.84 0.00 0.00 35.03 33.86 2jq8 n LYS 6 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2jq8 n GLY 7 N 3.19 4.99 2.63 0.72 0.00 -1.26 -4.81 105.19 110.65 2jq8 n GLY 7 Ca 0.00 -1.26 -0.41 0.00 0.00 0.00 0.00 46.02 44.35 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 -1.13 5.04 -2.48 1.61 1.74 -1.26 -3.98 116.66 116.20 2jq8 n ARG 8 Ca 0.28 -4.25 -0.04 0.00 -0.77 0.00 0.00 57.85 53.08 2jq8 n ARG 8 Cb 0.92 -2.54 0.07 0.00 -1.02 0.00 0.00 32.46 29.89 2jq8 n ARG 8 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2jq8 n THR 10 N -0.78 0.00 0.08 0.00 -2.24 -1.26 -4.92 114.28 105.16 2jq8 n THR 10 Ca -0.12 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.59 2jq8 n THR 10 Cb 0.76 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 68.95 2jq8 n THR 10 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2jq8 h GLU 11 N 0.00 0.07 0.00 -0.78 4.39 -1.94 -3.50 114.58 112.82 2jq8 h GLU 11 Ca 0.00 -0.09 0.00 0.00 0.34 0.00 0.00 59.36 59.61 2jq8 h GLU 11 Cb 0.00 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 28.68 2jq8 h GLU 11 CO 0.00 0.93 0.00 0.41 -1.16 0.00 0.00 179.01 179.19 2jq8 n GLY 12 N 1.04 2.87 3.62 -3.84 0.00 -1.26 -5.00 105.19 102.62 2jq8 n GLY 12 Ca -0.02 -1.99 -0.43 0.00 0.00 0.00 0.00 46.02 43.58 2jq8 n GLY 12 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2jq8 n PHE 13 N -0.31 2.18 -2.46 1.61 -0.00 -1.26 -4.87 117.46 112.34 2jq8 n PHE 13 Ca 0.00 -0.20 -0.39 0.00 -0.00 0.00 0.00 57.45 56.86 2jq8 n PHE 13 Cb 0.00 -2.75 -0.03 0.00 -0.00 0.00 0.00 39.48 36.71 2jq8 n PHE 13 CO 0.00 0.00 0.00 -0.80 -0.00 0.00 0.00 176.76 175.96 2jq8 s ASN 14 N 6.61 6.32 0.00 -2.13 0.02 -1.26 -4.75 114.94 119.75 2jq8 s ASN 14 Ca 0.96 -1.70 0.18 0.00 -1.02 0.00 0.00 52.86 51.28 2jq8 s ASN 14 Cb -0.42 -2.57 0.87 0.00 0.02 0.00 0.00 41.25 39.15 2jq8 s ASN 14 CO 0.39 -1.68 1.53 0.52 0.02 0.00 0.00 177.10 177.88 2jq8 n VAL 15 N 6.93 0.53 0.08 1.60 0.31 -1.26 -1.54 118.33 124.99 2jq8 n VAL 15 Ca 0.40 0.13 -0.10 0.00 -0.01 0.00 0.00 64.34 64.77 2jq8 n VAL 15 Cb 0.48 -0.84 -0.07 0.00 -0.91 0.00 0.00 33.84 32.50 2jq8 n VAL 15 CO 0.00 0.00 0.00 -0.78 -1.32 0.00 0.00 176.83 174.73 2jq8 h ASP 16 N 0.00 0.22 -3.90 4.52 3.58 -2.00 -3.48 116.42 115.37 2jq8 h ASP 16 Ca 0.00 -0.21 -0.44 0.00 0.42 0.00 0.00 57.03 56.80 2jq8 h ASP 16 Cb 0.19 -0.07 0.16 0.00 1.72 0.00 0.00 39.33 41.33 2jq8 h ASP 16 CO 0.00 1.09 0.23 -0.54 -2.88 0.00 0.00 179.24 177.14 2jq8 s LYS 17 N -2.93 0.20 -0.22 0.28 -0.14 -0.59 -5.01 119.74 111.32 2jq8 s LYS 17 Ca -0.02 0.20 -0.18 0.00 -1.36 0.00 0.00 55.97 54.61 2jq8 s LYS 17 Cb 0.09 -1.74 -0.15 0.00 -1.68 0.00 0.00 37.83 34.36 2jq8 s LYS 17 CO 0.84 -2.82 -0.02 1.63 -0.76 0.00 0.00 175.35 174.22 2jq8 n LYS 18 N -4.18 0.56 -4.12 1.68 4.76 -1.26 -4.86 118.16 110.74 2jq8 n LYS 18 Ca 0.08 0.46 -0.36 0.00 -2.87 0.00 0.00 58.31 55.63 2jq8 n LYS 18 Cb 0.59 -1.65 -0.08 0.00 -1.84 0.00 0.00 35.03 32.05 2jq8 n LYS 18 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2jq8 s GLN 20 N -0.74 2.88 -0.06 0.00 -1.52 -0.83 -4.91 119.66 114.48 2jq8 s GLN 20 Ca 0.12 -0.86 -0.02 0.00 -1.95 0.00 0.00 55.36 52.66 2jq8 s GLN 20 Cb -0.12 -2.29 0.03 0.00 -0.22 0.00 0.00 33.01 30.41 2jq8 s GLN 20 CO 0.03 0.28 0.04 0.00 -0.25 0.00 0.00 175.29 175.39 2jq8 n ASP 22 N 5.25 0.00 0.23 0.00 2.03 -1.23 -4.09 116.55 118.74 2jq8 n ASP 22 Ca -0.04 -0.88 0.07 0.00 0.52 0.00 0.00 54.79 54.45 2jq8 n ASP 22 Cb 0.50 0.00 0.56 0.00 -0.72 0.00 0.00 41.12 41.46 2jq8 n ASP 22 CO 0.00 0.00 0.00 -0.08 -1.92 0.00 0.00 177.20 175.20 2jq8 h GLU 23 N 0.00 0.00 -0.56 -0.67 4.57 -1.91 -2.27 114.58 113.74 2jq8 h GLU 23 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 2jq8 h GLU 23 Cb 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.59 2jq8 h GLU 23 CO 0.00 0.15 0.00 1.28 -1.18 0.00 0.00 179.01 179.26 2jq8 n LEU 24 N -4.26 2.45 -0.21 1.64 4.32 -1.26 -4.24 117.00 115.44 2jq8 n LEU 24 Ca -0.02 -1.23 -0.02 0.00 -0.02 0.00 0.00 56.01 54.71 2jq8 n LEU 24 Cb 0.22 -0.39 0.18 0.00 -1.62 0.00 0.00 43.42 41.80 2jq8 n LEU 24 CO 0.35 0.44 1.10 0.00 -1.22 0.00 0.00 177.39 178.06 2jq8 h SER 26 N 0.99 0.00 -0.20 0.00 4.64 -1.83 0.20 113.55 117.34 2jq8 h SER 26 Ca 0.24 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.45 2jq8 h SER 26 Cb 0.12 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.20 2jq8 h SER 26 CO -0.03 0.36 -0.22 0.22 -0.87 0.00 0.00 176.83 176.30 2jq8 h TYR 27 N 0.00 0.74 0.00 4.77 3.20 -1.61 -3.07 116.97 121.00 2jq8 h TYR 27 Ca -0.00 -0.16 0.00 0.00 3.14 0.00 0.00 58.73 61.71 2jq8 h TYR 27 Cb 0.82 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 38.91 2jq8 h TYR 27 CO 0.00 0.82 -1.53 0.66 -1.64 0.00 0.00 178.16 176.47 2jq8 n TYR 28 N -4.12 0.00 -3.55 -3.82 4.01 -1.12 -5.01 117.16 103.54 2jq8 n TYR 28 Ca 0.00 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.49 2jq8 n TYR 28 Cb 0.41 -0.27 0.05 0.00 -0.31 0.00 0.00 39.34 39.22 2jq8 n TYR 28 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 2jq8 n GLN 29 N -1.91 -2.05 -2.69 -0.72 1.13 0.68 -4.95 117.38 106.86 2jq8 n GLN 29 Ca -0.01 0.60 -0.07 0.00 -1.94 0.00 0.00 57.00 55.59 2jq8 n GLN 29 Cb 0.45 -4.79 0.07 0.00 0.11 0.00 0.00 30.24 26.08 2jq8 n GLN 29 CO 0.00 0.00 0.00 0.43 -1.44 0.00 0.00 177.06 176.05 2jq8 n SER 30 N -2.90 0.01 -4.83 1.08 7.64 -1.19 -5.06 113.62 108.38 2jq8 n SER 30 Ca -0.12 -2.52 -0.37 0.00 1.01 0.00 0.00 58.87 56.87 2jq8 n SER 30 Cb 0.61 0.13 -0.06 0.00 -1.01 0.00 0.00 64.21 63.88 2jq8 n SER 30 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jq8 h THR 33 N -0.88 0.77 0.00 0.00 1.35 -1.97 -1.27 112.91 110.91 2jq8 h THR 33 Ca -0.45 -0.24 0.00 0.00 -0.55 0.00 0.00 66.41 65.17 2jq8 h THR 33 Cb 1.24 1.14 0.00 0.00 -1.73 0.00 0.00 68.15 68.80 2jq8 h THR 33 CO 0.58 0.06 0.00 0.47 -0.25 0.00 0.00 175.52 176.38 2jq8 n ASP 34 N -4.06 0.04 -0.06 5.36 9.92 -1.26 -3.32 116.55 123.17 2jq8 n ASP 34 Ca -0.03 0.51 -0.12 0.00 -0.53 0.00 0.00 54.79 54.62 2jq8 n ASP 34 Cb 0.15 -0.52 -0.06 0.00 -0.64 0.00 0.00 41.12 40.05 2jq8 n ASP 34 CO 0.00 0.00 0.00 0.22 0.13 0.00 0.00 177.20 177.55 2jq8 h TYR 35 N 0.00 0.39 0.00 1.24 3.20 -1.58 0.17 116.97 120.39 2jq8 h TYR 35 Ca 0.00 -0.08 -0.13 0.00 3.14 0.00 0.00 58.73 61.65 2jq8 h TYR 35 Cb 0.33 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.49 2jq8 h TYR 35 CO 0.00 0.61 -0.64 1.79 -1.64 0.00 0.00 178.16 178.28 2jq8 h THR 36 N 0.06 1.39 0.02 1.81 1.35 -1.73 0.11 112.91 115.92 2jq8 h THR 36 Ca 0.05 -2.23 -0.00 0.00 -0.55 0.00 0.00 66.41 63.68 2jq8 h THR 36 Cb 0.48 2.22 0.00 0.00 -1.73 0.00 0.00 68.15 69.12 2jq8 h THR 36 CO 0.02 0.62 -0.01 0.00 -0.25 0.00 0.00 175.52 175.90 2jq8 h ALA 37 N 1.36 -0.03 0.10 6.62 0.00 -1.54 -2.53 119.26 123.25 2jq8 h ALA 37 Ca -0.01 -0.24 -0.31 0.00 0.00 0.00 0.00 54.91 54.35 2jq8 h ALA 37 Cb 1.17 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.96 2jq8 h ALA 37 CO 0.08 -0.27 -1.66 0.93 0.00 0.00 0.00 179.25 178.33 2jq8 h GLU 38 N -0.52 0.21 0.14 0.00 4.39 -0.69 -3.39 114.58 114.72 2jq8 h GLU 38 Ca -0.00 -0.36 -0.28 0.00 0.34 0.00 0.00 59.36 59.06 2jq8 h GLU 38 Cb 0.50 0.13 0.01 0.00 -0.10 0.00 0.00 28.75 29.29 2jq8 h GLU 38 CO 0.00 1.17 -1.36 0.00 -1.16 0.00 0.00 179.01 177.66 2jq8 n LYS 40 N -3.89 -1.66 0.20 0.00 4.81 -0.95 -4.92 118.16 111.75 2jq8 n LYS 40 Ca -0.22 1.13 0.13 0.00 -0.87 0.00 0.00 58.31 58.48 2jq8 n LYS 40 Cb 0.93 -5.44 0.32 0.00 0.02 0.00 0.00 35.03 30.86 2jq8 n LYS 40 CO 0.00 0.00 0.00 -1.00 1.17 0.00 0.00 177.40 177.57 2jq8 h PRO 41 N -0.37 0.00 -3.52 1.64 0.13 -1.82 -3.41 132.00 124.64 2jq8 h PRO 41 Ca -0.32 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.30 2jq8 h PRO 41 Cb 1.17 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.90 2jq8 h PRO 41 CO 0.37 0.00 -0.76 -1.14 -0.23 0.00 0.00 178.00 176.24 2jq8 s GLN 42 N -3.27 0.61 0.31 0.86 2.00 -1.26 -5.13 119.66 113.77 2jq8 s GLN 42 Ca 0.07 -0.37 -0.15 0.00 -2.00 0.00 0.00 55.36 52.90 2jq8 s GLN 42 Cb 0.07 -2.03 -0.09 0.00 0.80 0.00 0.00 33.01 31.77 2jq8 s GLN 42 CO 0.62 -0.62 0.73 0.08 -0.50 0.00 0.00 175.29 175.60 2jq8 s VAL 43 N 1.89 4.67 0.18 1.34 1.01 -1.26 -5.03 120.40 123.20 2jq8 s VAL 43 Ca -0.00 0.98 -0.31 0.00 0.00 0.00 0.00 61.98 62.64 2jq8 s VAL 43 Cb -0.17 -3.64 -0.10 0.00 0.00 0.00 0.00 36.38 32.47 2jq8 s VAL 43 CO -0.08 -0.13 1.56 -0.89 0.00 0.00 0.00 175.10 175.57 2jq8 s THR 44 N -1.92 2.57 0.63 3.92 2.01 -1.26 -4.99 115.64 116.60 2jq8 s THR 44 Ca 0.52 0.42 -0.10 0.00 0.31 0.00 0.00 61.69 62.84 2jq8 s THR 44 Cb -0.11 -3.27 -0.02 0.00 0.01 0.00 0.00 72.50 69.12 2jq8 s THR 44 CO 0.18 0.04 1.02 0.00 -0.69 0.00 0.00 174.62 175.16 2jq8 s ARG 45 N 0.92 3.27 0.02 4.92 1.70 -1.26 -5.08 118.95 123.44 2jq8 s ARG 45 Ca 0.69 0.52 0.02 0.00 -0.47 0.00 0.00 55.73 56.49 2jq8 s ARG 45 Cb -0.44 -2.11 -0.02 0.00 -0.57 0.00 0.00 34.95 31.82 2jq8 s ARG 45 CO 0.33 -0.71 -0.07 0.20 -1.08 0.00 0.00 175.30 173.97 2jq8 s GLY 46 N -4.25 0.40 0.00 3.88 0.00 -1.26 -5.34 107.32 100.75 2jq8 s GLY 46 Ca 0.55 -0.54 0.06 0.00 0.00 0.00 0.00 44.72 44.79 2jq8 s GLY 46 CO 0.51 -0.56 0.70 1.34 0.00 0.00 0.00 173.10 175.09