#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 -6.05 -0.21 -0.67 -0.06 -1.26 -4.87 117.38 104.26 2jq8 n GLN 2 Ca 0.00 0.88 0.10 0.00 -2.00 0.00 0.00 57.00 55.98 2jq8 n GLN 2 Cb 0.00 -5.82 0.26 0.00 -4.06 0.00 0.00 30.24 20.63 2jq8 n GLN 2 CO 0.00 0.00 0.00 0.39 -0.20 0.00 0.00 177.06 177.25 2jq8 n GLU 3 N -4.41 2.19 -1.57 3.69 -0.58 -1.26 -4.96 120.64 113.74 2jq8 n GLU 3 Ca -0.07 -1.82 -0.39 0.00 -0.42 0.00 0.00 57.16 54.46 2jq8 n GLU 3 Cb 0.60 -1.43 0.03 0.00 -0.57 0.00 0.00 31.44 30.07 2jq8 n GLU 3 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 2jq8 n SER 4 N 1.00 0.35 -4.64 1.62 7.64 -1.26 -4.55 113.62 113.79 2jq8 n SER 4 Ca 0.18 0.86 -0.42 0.00 1.01 0.00 0.00 58.87 60.50 2jq8 n SER 4 Cb 0.46 -1.31 -0.03 0.00 -1.01 0.00 0.00 64.21 62.32 2jq8 n SER 4 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jq8 n LYS 6 N 6.32 0.00 -2.64 0.00 4.76 -1.26 -4.66 118.16 120.68 2jq8 n LYS 6 Ca 0.08 0.00 -0.20 0.00 -2.87 0.00 0.00 58.31 55.32 2jq8 n LYS 6 Cb 0.47 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.67 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 1.25 4.25 0.10 0.72 0.00 -1.26 -4.59 105.19 105.66 2jq8 n GLY 7 Ca 0.00 -2.18 0.09 0.00 0.00 0.00 0.00 46.02 43.93 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 -0.26 0.62 0.20 1.61 1.74 -1.26 -4.06 116.66 115.25 2jq8 n ARG 8 Ca 0.27 0.09 0.13 0.00 -0.77 0.00 0.00 57.85 57.57 2jq8 n ARG 8 Cb 0.69 -1.77 0.38 0.00 -1.02 0.00 0.00 32.46 30.74 2jq8 n ARG 8 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2jq8 h THR 10 N 0.00 0.19 0.00 0.00 1.35 -1.92 -3.34 112.91 109.19 2jq8 h THR 10 Ca 0.00 -1.28 -0.40 0.00 -0.55 0.00 0.00 66.41 64.19 2jq8 h THR 10 Cb 0.75 2.06 -0.07 0.00 -1.73 0.00 0.00 68.15 69.16 2jq8 h THR 10 CO 0.00 0.11 -2.45 -0.62 -0.25 0.00 0.00 175.52 172.31 2jq8 n GLU 11 N -3.10 0.62 0.00 4.72 -0.58 -1.03 -5.12 120.64 116.14 2jq8 n GLU 11 Ca 0.03 0.17 0.00 0.00 -0.42 0.00 0.00 57.16 56.94 2jq8 n GLU 11 Cb 0.58 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.96 2jq8 n GLU 11 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2jq8 n GLY 12 N 2.08 0.98 3.59 0.62 0.00 -0.09 -4.97 105.19 107.38 2jq8 n GLY 12 Ca -0.47 -2.28 -0.41 0.00 0.00 0.00 0.00 46.02 42.86 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 -1.05 1.31 -1.09 1.61 2.19 -1.25 -4.69 117.98 115.01 2jq8 s PHE 13 Ca 0.00 0.81 -0.16 0.00 0.33 0.00 0.00 56.93 57.91 2jq8 s PHE 13 Cb 0.00 -3.90 0.15 0.00 -1.31 0.00 0.00 43.02 37.96 2jq8 s PHE 13 CO 0.00 -3.39 1.31 0.54 1.83 0.00 0.00 175.22 175.51 2jq8 s ASN 14 N 8.73 6.87 0.26 6.13 4.22 -1.26 -4.80 114.94 135.09 2jq8 s ASN 14 Ca 0.94 -2.55 0.23 0.00 -2.14 0.00 0.00 52.86 49.33 2jq8 s ASN 14 Cb -0.26 -2.41 0.99 0.00 1.28 0.00 0.00 41.25 40.85 2jq8 s ASN 14 CO 0.32 -0.90 1.69 0.52 -2.04 0.00 0.00 177.10 176.69 2jq8 n VAL 15 N 5.06 0.87 0.22 3.54 0.31 -1.26 -1.11 118.33 125.96 2jq8 n VAL 15 Ca 0.31 0.30 0.11 0.00 -0.01 0.00 0.00 64.34 65.06 2jq8 n VAL 15 Cb 0.46 -1.24 0.28 0.00 -0.91 0.00 0.00 33.84 32.43 2jq8 n VAL 15 CO 0.00 0.00 0.00 -2.24 -1.32 0.00 0.00 176.83 173.27 2jq8 h ASP 16 N 0.00 0.00 -3.89 4.52 2.03 -1.96 -3.45 116.42 113.66 2jq8 h ASP 16 Ca 0.00 0.00 -0.46 0.00 -0.73 0.00 0.00 57.03 55.84 2jq8 h ASP 16 Cb 0.31 0.00 0.09 0.00 -0.83 0.00 0.00 39.33 38.90 2jq8 h ASP 16 CO 0.00 0.12 0.28 -0.54 -1.03 0.00 0.00 179.24 178.07 2jq8 s LYS 17 N -3.31 1.96 0.00 4.15 -0.14 -0.27 -4.99 119.74 117.14 2jq8 s LYS 17 Ca 0.04 -0.24 0.24 0.00 -1.36 0.00 0.00 55.97 54.66 2jq8 s LYS 17 Cb 0.07 -2.10 0.28 0.00 -1.68 0.00 0.00 37.83 34.40 2jq8 s LYS 17 CO 0.65 -1.45 1.26 1.63 -0.76 0.00 0.00 175.35 176.68 2jq8 n LYS 18 N -3.09 0.03 -4.05 1.68 4.01 -1.26 -4.81 118.16 110.67 2jq8 n LYS 18 Ca 0.09 -0.02 -0.15 0.00 -0.51 0.00 0.00 58.31 57.72 2jq8 n LYS 18 Cb 0.60 -1.50 -0.15 0.00 -0.51 0.00 0.00 35.03 33.48 2jq8 n LYS 18 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2jq8 s GLN 20 N 0.11 0.78 -0.09 0.00 1.11 -1.21 -4.85 119.66 115.50 2jq8 s GLN 20 Ca -0.01 -0.81 -0.03 0.00 0.01 0.00 0.00 55.36 54.52 2jq8 s GLN 20 Cb -0.04 -0.74 0.05 0.00 -1.01 0.00 0.00 33.01 31.27 2jq8 s GLN 20 CO -0.00 0.17 0.13 0.00 0.01 0.00 0.00 175.29 175.60 2jq8 n ASP 22 N 5.31 -0.66 0.27 0.00 -0.08 -1.26 -3.93 116.55 116.19 2jq8 n ASP 22 Ca -0.04 -1.68 0.17 0.00 -1.51 0.00 0.00 54.79 51.73 2jq8 n ASP 22 Cb 0.50 1.17 0.70 0.00 2.34 0.00 0.00 41.12 45.83 2jq8 n ASP 22 CO 0.00 0.00 0.00 1.05 0.12 0.00 0.00 177.20 178.37 2jq8 h GLU 23 N 0.00 0.00 -0.55 -0.67 4.11 -1.99 -2.58 114.58 112.90 2jq8 h GLU 23 Ca -0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.32 2jq8 h GLU 23 Cb 0.46 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.71 2jq8 h GLU 23 CO 0.15 0.00 0.00 1.28 0.07 0.00 0.00 179.01 180.51 2jq8 n LEU 24 N -3.00 2.30 -0.20 3.06 4.77 -1.26 -4.25 117.00 118.42 2jq8 n LEU 24 Ca 0.00 -1.16 -0.00 0.00 -0.03 0.00 0.00 56.01 54.82 2jq8 n LEU 24 Cb 0.28 -0.38 0.23 0.00 -2.33 0.00 0.00 43.42 41.22 2jq8 n LEU 24 CO 0.26 0.42 1.19 0.00 -1.33 0.00 0.00 177.39 177.92 2jq8 h SER 26 N 0.98 0.00 -0.28 0.00 4.64 -1.85 0.84 113.55 117.88 2jq8 h SER 26 Ca 0.26 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.49 2jq8 h SER 26 Cb -0.04 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.05 2jq8 h SER 26 CO -0.05 0.47 -0.14 0.22 -0.87 0.00 0.00 176.83 176.45 2jq8 h TYR 27 N 0.00 0.69 0.00 4.77 3.20 -1.55 -2.98 116.97 121.10 2jq8 h TYR 27 Ca -0.00 -0.17 0.00 0.00 3.14 0.00 0.00 58.73 61.69 2jq8 h TYR 27 Cb 1.05 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 39.17 2jq8 h TYR 27 CO 0.00 0.84 -0.66 1.88 -1.64 0.00 0.00 178.16 178.58 2jq8 h TYR 28 N 0.33 0.00 -5.89 -3.82 0.05 -1.46 -3.48 116.97 102.70 2jq8 h TYR 28 Ca 0.06 0.00 -0.38 0.00 0.05 0.00 0.00 58.73 58.46 2jq8 h TYR 28 Cb 0.66 0.00 0.11 0.00 1.01 0.00 0.00 36.73 38.51 2jq8 h TYR 28 CO 0.06 0.00 -0.80 1.04 -1.05 0.00 0.00 178.16 177.41 2jq8 n GLN 29 N -2.22 -5.77 -3.00 4.88 1.13 0.25 -4.97 117.38 107.68 2jq8 n GLN 29 Ca 0.03 0.73 -0.14 0.00 -1.94 0.00 0.00 57.00 55.67 2jq8 n GLN 29 Cb 0.46 -5.51 -0.02 0.00 0.11 0.00 0.00 30.24 25.27 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 -3.08 -1.98 -4.44 1.08 7.64 -0.96 -5.03 113.62 106.85 2jq8 n SER 30 Ca -0.28 -2.81 -0.28 0.00 1.01 0.00 0.00 58.87 56.51 2jq8 n SER 30 Cb 0.67 0.77 -0.12 0.00 -1.01 0.00 0.00 64.21 64.52 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 -0.32 0.78 -0.27 0.00 1.35 -1.97 -1.84 112.91 110.65 2jq8 h THR 33 Ca -0.44 -0.49 0.00 0.00 -0.55 0.00 0.00 66.41 64.93 2jq8 h THR 33 Cb 1.19 1.29 0.00 0.00 -1.73 0.00 0.00 68.15 68.90 2jq8 h THR 33 CO 0.62 0.12 0.00 0.47 -0.25 0.00 0.00 175.52 176.48 2jq8 n ASP 34 N -3.94 1.79 -0.07 5.36 9.92 -1.26 -4.16 116.55 124.19 2jq8 n ASP 34 Ca -0.02 -1.86 -0.10 0.00 -0.53 0.00 0.00 54.79 52.27 2jq8 n ASP 34 Cb 0.22 -0.18 -0.03 0.00 -0.64 0.00 0.00 41.12 40.49 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 2.14 0.35 -0.04 1.24 3.20 -1.60 0.17 116.97 122.44 2jq8 h TYR 35 Ca 0.00 -0.02 -0.17 0.00 3.14 0.00 0.00 58.73 61.68 2jq8 h TYR 35 Cb 0.48 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.63 2jq8 h TYR 35 CO 0.18 0.35 -0.73 1.79 -1.64 0.00 0.00 178.16 178.10 2jq8 h THR 36 N 0.25 1.43 0.02 1.81 1.35 -1.80 0.18 112.91 116.16 2jq8 h THR 36 Ca 0.08 -2.27 -0.00 0.00 -0.55 0.00 0.00 66.41 63.67 2jq8 h THR 36 Cb 0.13 2.21 0.00 0.00 -1.73 0.00 0.00 68.15 68.76 2jq8 h THR 36 CO -0.01 0.67 -0.01 0.00 -0.25 0.00 0.00 175.52 175.92 2jq8 h ALA 37 N 1.08 -0.03 0.05 6.62 0.00 -1.72 -3.07 119.26 122.19 2jq8 h ALA 37 Ca -0.02 -0.27 -0.35 0.00 0.00 0.00 0.00 54.91 54.27 2jq8 h ALA 37 Cb 1.29 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 19.05 2jq8 h ALA 37 CO 0.11 -0.24 -2.04 0.39 0.00 0.00 0.00 179.25 177.47 2jq8 n GLU 38 N -4.84 0.69 -0.11 0.00 -0.58 0.58 -4.64 120.64 111.74 2jq8 n GLU 38 Ca -0.09 0.22 -0.17 0.00 -0.42 0.00 0.00 57.16 56.70 2jq8 n GLU 38 Cb 0.27 -1.68 -0.06 0.00 -0.57 0.00 0.00 31.44 29.40 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 -4.41 -3.66 -0.20 0.00 4.81 -0.13 -4.88 118.16 109.70 2jq8 n LYS 40 Ca -0.30 2.84 0.01 0.00 -0.87 0.00 0.00 58.31 59.99 2jq8 n LYS 40 Cb 0.63 -4.00 0.11 0.00 0.02 0.00 0.00 35.03 31.79 2jq8 n LYS 40 CO 0.00 0.00 0.00 -1.35 1.17 0.00 0.00 177.40 177.22 2jq8 h PRO 41 N 3.16 0.26 -2.70 1.64 0.11 -1.85 -3.46 132.00 129.16 2jq8 h PRO 41 Ca -0.32 -0.02 -0.42 0.00 0.11 0.00 0.00 66.00 65.36 2jq8 h PRO 41 Cb 0.72 -0.06 -0.04 0.00 0.11 0.00 0.00 31.00 31.73 2jq8 h PRO 41 CO 0.01 0.17 -0.51 1.04 -0.21 0.00 0.00 178.00 178.50 2jq8 n GLN 42 N -5.12 -1.63 -4.75 1.05 1.13 -1.26 -4.98 117.38 101.83 2jq8 n GLN 42 Ca 0.09 1.04 -0.33 0.00 -1.94 0.00 0.00 57.00 55.86 2jq8 n GLN 42 Cb 0.32 -5.66 -0.15 0.00 0.11 0.00 0.00 30.24 24.86 2jq8 n GLN 42 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 2jq8 s VAL 43 N -3.00 2.71 -0.13 5.09 0.11 -1.26 -5.11 120.40 118.81 2jq8 s VAL 43 Ca 0.00 -0.77 -0.00 0.00 -2.93 0.00 0.00 61.98 58.28 2jq8 s VAL 43 Cb 0.00 -2.12 0.02 0.00 -1.53 0.00 0.00 36.38 32.75 2jq8 s VAL 43 CO 0.00 0.53 -0.10 0.42 -3.33 0.00 0.00 175.10 172.61 2jq8 s THR 44 N 0.55 1.25 -0.77 5.04 -4.23 -1.26 -5.07 115.64 111.14 2jq8 s THR 44 Ca -0.10 -0.43 -0.25 0.00 -1.18 0.00 0.00 61.69 59.74 2jq8 s THR 44 Cb -0.16 -1.22 0.05 0.00 1.34 0.00 0.00 72.50 72.51 2jq8 s THR 44 CO 0.04 0.40 1.21 -0.60 -0.54 0.00 0.00 174.62 175.13 2jq8 s ARG 45 N 1.62 3.26 -0.04 3.99 3.52 -1.26 -4.91 118.95 125.13 2jq8 s ARG 45 Ca 0.05 -0.64 -0.04 0.00 -0.13 0.00 0.00 55.73 54.96 2jq8 s ARG 45 Cb -0.13 -4.43 -0.17 0.00 -1.56 0.00 0.00 34.95 28.66 2jq8 s ARG 45 CO -0.09 -2.04 3.15 0.41 -0.81 0.00 0.00 175.30 175.92 2jq8 n GLY 46 N 5.61 3.01 0.00 8.12 0.00 -1.26 -5.35 105.19 115.32 2jq8 n GLY 46 Ca 0.07 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 45.12 2jq8 n GLY 46 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41