#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 -2.31 0.11 7.27 -1.26 -5.05 117.38 116.13 2jq8 n GLN 2 Ca 0.00 -0.05 -0.35 0.00 0.07 0.00 0.00 57.00 56.67 2jq8 n GLN 2 Cb 0.00 -0.03 -0.03 0.00 2.41 0.00 0.00 30.24 32.59 2jq8 n GLN 2 CO 0.00 0.00 0.00 -1.21 0.07 0.00 0.00 177.06 175.92 2jq8 s GLU 3 N 0.00 3.17 0.12 3.69 8.01 -1.26 -4.94 118.70 127.49 2jq8 s GLU 3 Ca 0.00 -1.24 -0.30 0.00 0.01 0.00 0.00 54.97 53.44 2jq8 s GLU 3 Cb 0.00 -5.32 -0.07 0.00 -4.31 0.00 0.00 34.13 24.43 2jq8 s GLU 3 CO 0.00 -3.00 1.19 -1.12 0.01 0.00 0.00 175.26 172.33 2jq8 s SER 4 N 5.81 7.11 0.52 -0.19 0.01 -1.26 -4.77 113.70 120.93 2jq8 s SER 4 Ca 0.60 2.10 -0.20 0.00 1.31 0.00 0.00 55.95 59.76 2jq8 s SER 4 Cb -0.00 -2.59 -0.07 0.00 0.21 0.00 0.00 66.02 63.57 2jq8 s SER 4 CO 0.04 -0.40 1.11 0.00 0.41 0.00 0.00 173.24 174.40 2jq8 n LYS 6 N -1.10 0.00 -0.83 0.00 5.02 -1.26 -4.84 118.16 115.15 2jq8 n LYS 6 Ca 0.10 0.00 -0.16 0.00 -2.02 0.00 0.00 58.31 56.24 2jq8 n LYS 6 Cb 0.51 0.00 0.05 0.00 -0.02 0.00 0.00 35.03 35.57 2jq8 n LYS 6 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jq8 n GLY 7 N 0.00 3.91 0.17 0.72 0.00 -1.26 -4.19 105.19 104.54 2jq8 n GLY 7 Ca 0.00 -0.98 0.04 0.00 0.00 0.00 0.00 46.02 45.08 2jq8 n GLY 7 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2jq8 h ARG 8 N 1.24 0.00 0.00 1.61 2.47 -1.92 -3.08 114.38 114.70 2jq8 h ARG 8 Ca 0.30 0.00 -0.05 0.00 -1.26 0.00 0.00 59.98 58.97 2jq8 h ARG 8 Cb 1.16 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.47 2jq8 h ARG 8 CO 0.72 0.45 -0.24 0.00 0.56 0.00 0.00 179.97 181.46 2jq8 h THR 10 N 0.00 0.82 -0.19 0.00 1.35 -1.83 -3.36 112.91 109.70 2jq8 h THR 10 Ca -0.00 -2.56 -0.13 0.00 -0.55 0.00 0.00 66.41 63.17 2jq8 h THR 10 Cb 0.82 2.55 0.00 0.00 -1.73 0.00 0.00 68.15 69.80 2jq8 h THR 10 CO 0.03 0.76 -0.37 -0.33 -0.25 0.00 0.00 175.52 175.36 2jq8 h GLU 11 N 0.05 0.59 0.00 4.72 5.08 -1.44 -3.50 114.58 120.08 2jq8 h GLU 11 Ca -0.34 -0.38 0.00 0.00 -1.00 0.00 0.00 59.36 57.64 2jq8 h GLU 11 Cb 2.03 0.05 0.00 0.00 0.50 0.00 0.00 28.75 31.32 2jq8 h GLU 11 CO 0.11 0.99 0.00 0.41 -1.00 0.00 0.00 179.01 179.52 2jq8 n GLY 12 N 0.40 1.70 3.59 -3.84 0.00 -0.12 -4.97 105.19 101.94 2jq8 n GLY 12 Ca -0.06 -2.24 -0.42 0.00 0.00 0.00 0.00 46.02 43.30 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 -1.50 2.37 -0.59 1.61 2.19 -1.26 -4.75 117.98 116.06 2jq8 s PHE 13 Ca 0.00 0.58 -0.20 0.00 0.33 0.00 0.00 56.93 57.65 2jq8 s PHE 13 Cb 0.00 -4.36 0.09 0.00 -1.31 0.00 0.00 43.02 37.44 2jq8 s PHE 13 CO 0.00 -1.92 0.75 -0.80 1.83 0.00 0.00 175.22 175.08 2jq8 s ASN 14 N 4.07 6.19 -0.32 6.13 -0.87 -1.26 -4.94 114.94 123.95 2jq8 s ASN 14 Ca 0.56 -1.27 -0.06 0.00 -1.57 0.00 0.00 52.86 50.52 2jq8 s ASN 14 Cb -0.12 -2.33 -0.20 0.00 -0.02 0.00 0.00 41.25 38.59 2jq8 s ASN 14 CO 0.29 -1.15 3.11 0.52 -2.57 0.00 0.00 177.10 177.30 2jq8 n VAL 15 N 5.64 2.87 0.00 1.60 0.31 -1.26 -2.37 118.33 125.13 2jq8 n VAL 15 Ca -0.08 -1.52 0.00 0.00 -0.01 0.00 0.00 64.34 62.73 2jq8 n VAL 15 Cb 0.43 -2.06 0.00 0.00 -0.91 0.00 0.00 33.84 31.31 2jq8 n VAL 15 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 2jq8 n ASP 16 N 2.83 0.00 -4.84 4.52 5.75 -1.26 -5.12 116.55 118.44 2jq8 n ASP 16 Ca 0.45 0.00 -0.30 0.00 -0.01 0.00 0.00 54.79 54.92 2jq8 n ASP 16 Cb 0.67 0.00 0.06 0.00 -1.03 0.00 0.00 41.12 40.82 2jq8 n ASP 16 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 2jq8 s LYS 17 N -1.00 2.61 -0.06 0.11 -0.14 -1.00 -5.03 119.74 115.24 2jq8 s LYS 17 Ca 0.00 0.65 -0.03 0.00 -1.36 0.00 0.00 55.97 55.23 2jq8 s LYS 17 Cb 0.00 -1.98 -0.02 0.00 -1.68 0.00 0.00 37.83 34.15 2jq8 s LYS 17 CO 0.00 -1.25 0.17 0.87 -0.76 0.00 0.00 175.35 174.38 2jq8 h LYS 18 N -0.82 -0.11 -5.77 1.68 1.79 -1.99 -3.45 116.57 107.90 2jq8 h LYS 18 Ca -0.46 0.01 -0.63 0.00 -2.18 0.00 0.00 60.65 57.39 2jq8 h LYS 18 Cb 1.25 0.03 -0.07 0.00 -1.58 0.00 0.00 32.23 31.85 2jq8 h LYS 18 CO 0.61 -0.07 -0.35 0.00 -1.08 0.00 0.00 179.45 178.55 2jq8 s GLN 20 N -0.84 0.92 -0.09 0.00 2.00 -1.13 -4.98 119.66 115.53 2jq8 s GLN 20 Ca 0.19 -0.58 -0.02 0.00 -2.00 0.00 0.00 55.36 52.95 2jq8 s GLN 20 Cb -0.14 -0.90 0.03 0.00 0.80 0.00 0.00 33.01 32.81 2jq8 s GLN 20 CO 0.08 0.23 0.01 0.00 -0.50 0.00 0.00 175.29 175.11 2jq8 s ASP 22 N 1.97 0.48 0.42 0.00 2.15 -1.26 -2.06 116.67 118.37 2jq8 s ASP 22 Ca 0.04 -1.32 0.21 0.00 0.43 0.00 0.00 52.55 51.91 2jq8 s ASP 22 Cb -0.13 0.75 0.90 0.00 -0.30 0.00 0.00 42.92 44.15 2jq8 s ASP 22 CO -0.06 -1.48 1.84 1.05 -0.17 0.00 0.00 175.17 176.35 2jq8 h GLU 23 N 2.05 0.00 -0.44 4.34 4.11 -1.97 -2.57 114.58 120.11 2jq8 h GLU 23 Ca -0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.13 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 0.39 0.29 0.00 1.28 0.07 0.00 0.00 179.01 181.04 2jq8 n LEU 24 N -3.60 0.59 -0.06 3.06 4.32 -1.26 -4.12 117.00 115.94 2jq8 n LEU 24 Ca -0.01 -0.30 -0.11 0.00 -0.02 0.00 0.00 56.01 55.58 2jq8 n LEU 24 Cb 0.42 -0.23 -0.04 0.00 -1.62 0.00 0.00 43.42 41.95 2jq8 n LEU 24 CO 0.35 0.14 0.85 0.00 -1.22 0.00 0.00 177.39 177.50 2jq8 h SER 26 N 0.16 0.00 -0.71 0.00 0.02 -1.84 0.49 113.55 111.67 2jq8 h SER 26 Ca 0.06 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.97 2jq8 h SER 26 Cb 0.19 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.70 2jq8 h SER 26 CO -0.00 0.19 0.27 0.22 -1.14 0.00 0.00 176.83 176.36 2jq8 h TYR 27 N 0.00 1.11 0.00 3.45 3.20 -1.69 -3.15 116.97 119.89 2jq8 h TYR 27 Ca -0.00 -0.09 0.00 0.00 3.14 0.00 0.00 58.73 61.78 2jq8 h TYR 27 Cb 0.48 -0.33 0.00 0.00 1.54 0.00 0.00 36.73 38.42 2jq8 h TYR 27 CO 0.00 0.85 -1.39 0.66 -1.64 0.00 0.00 178.16 176.64 2jq8 n TYR 28 N -4.28 0.00 -3.53 -3.82 4.01 -1.00 -4.99 117.16 103.54 2jq8 n TYR 28 Ca 0.06 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.55 2jq8 n TYR 28 Cb 0.19 -0.24 0.06 0.00 -0.31 0.00 0.00 39.34 39.04 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 -1.82 -6.65 -2.36 -0.72 1.13 0.17 -4.91 117.38 102.21 2jq8 n GLN 29 Ca -0.01 0.78 -0.16 0.00 -1.94 0.00 0.00 57.00 55.68 2jq8 n GLN 29 Cb 0.36 -5.75 0.03 0.00 0.11 0.00 0.00 30.24 24.99 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 -2.85 3.63 -4.90 1.08 7.64 -1.20 -5.04 113.62 111.97 2jq8 n SER 30 Ca -0.01 -3.13 -0.31 0.00 1.01 0.00 0.00 58.87 56.43 2jq8 n SER 30 Cb 0.56 -0.41 -0.04 0.00 -1.01 0.00 0.00 64.21 63.31 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 0.50 1.19 -0.62 0.00 1.35 -1.97 -2.29 112.91 111.07 2jq8 h THR 33 Ca -0.47 -0.35 -0.42 0.00 -0.55 0.00 0.00 66.41 64.62 2jq8 h THR 33 Cb 1.23 0.08 -0.18 0.00 -1.73 0.00 0.00 68.15 67.55 2jq8 h THR 33 CO 0.57 0.18 0.53 0.47 -0.25 0.00 0.00 175.52 177.03 2jq8 n ASP 34 N -4.42 6.79 -0.07 5.36 8.00 -1.26 -4.34 116.55 126.60 2jq8 n ASP 34 Ca 0.08 -3.25 -0.14 0.00 0.71 0.00 0.00 54.79 52.19 2jq8 n ASP 34 Cb 0.04 -1.04 -0.06 0.00 -0.02 0.00 0.00 41.12 40.04 2jq8 n ASP 34 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 2jq8 h TYR 35 N 1.64 0.81 -0.12 1.24 3.20 -1.79 -3.10 116.97 118.85 2jq8 h TYR 35 Ca 0.37 -0.28 -0.07 0.00 3.14 0.00 0.00 58.73 61.90 2jq8 h TYR 35 Cb 0.88 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.98 2jq8 h TYR 35 CO 0.97 1.03 -0.23 1.79 -1.64 0.00 0.00 178.16 180.09 2jq8 h THR 36 N 0.36 1.22 -0.33 1.81 1.35 -1.85 0.83 112.91 116.31 2jq8 h THR 36 Ca 0.02 -1.02 -0.08 0.00 -0.55 0.00 0.00 66.41 64.78 2jq8 h THR 36 Cb 0.95 1.39 -0.01 0.00 -1.73 0.00 0.00 68.15 68.76 2jq8 h THR 36 CO 0.08 0.31 -0.12 0.00 -0.25 0.00 0.00 175.52 175.54 2jq8 h ALA 37 N 1.58 0.46 0.05 6.62 0.00 -1.87 -1.65 119.26 124.46 2jq8 h ALA 37 Ca 0.03 -0.32 -0.37 0.00 0.00 0.00 0.00 54.91 54.26 2jq8 h ALA 37 Cb 0.52 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.14 2jq8 h ALA 37 CO 0.04 0.33 -2.19 0.39 0.00 0.00 0.00 179.25 177.82 2jq8 n GLU 38 N -4.40 0.70 -0.06 0.00 -0.58 -1.14 -4.50 120.64 110.66 2jq8 n GLU 38 Ca -0.03 0.19 -0.17 0.00 -0.42 0.00 0.00 57.16 56.74 2jq8 n GLU 38 Cb 0.36 -1.63 -0.13 0.00 -0.57 0.00 0.00 31.44 29.47 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 -4.46 -1.13 0.00 0.00 4.81 -0.62 -4.82 118.16 111.93 2jq8 n LYS 40 Ca -0.16 0.57 0.04 0.00 -0.87 0.00 0.00 58.31 57.89 2jq8 n LYS 40 Cb 0.59 -3.74 0.23 0.00 0.02 0.00 0.00 35.03 32.14 2jq8 n LYS 40 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 2jq8 n PRO 41 N -3.78 0.74 -2.56 1.64 -0.04 -1.26 -4.87 135.00 124.86 2jq8 n PRO 41 Ca -0.12 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.28 2jq8 n PRO 41 Cb 0.59 -1.16 0.01 0.00 -0.04 0.00 0.00 33.50 32.90 2jq8 n PRO 41 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2jq8 n GLN 42 N -0.66 -1.82 -2.14 0.54 1.13 -1.26 -4.90 117.38 108.27 2jq8 n GLN 42 Ca 0.06 1.74 -0.43 0.00 -1.94 0.00 0.00 57.00 56.43 2jq8 n GLN 42 Cb 0.03 -4.76 -0.02 0.00 0.11 0.00 0.00 30.24 25.59 2jq8 n GLN 42 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 2jq8 s VAL 43 N -2.29 3.67 0.00 5.09 1.01 -1.26 -4.96 120.40 121.66 2jq8 s VAL 43 Ca 0.18 0.70 -0.01 0.00 0.00 0.00 0.00 61.98 62.85 2jq8 s VAL 43 Cb -0.05 -3.85 -0.01 0.00 0.00 0.00 0.00 36.38 32.48 2jq8 s VAL 43 CO 0.60 -0.50 0.01 -0.89 0.00 0.00 0.00 175.10 174.31 2jq8 s THR 44 N 6.04 0.05 -0.08 3.92 2.01 -1.26 -5.14 115.64 121.17 2jq8 s THR 44 Ca 0.72 -0.38 0.05 0.00 0.31 0.00 0.00 61.69 62.39 2jq8 s THR 44 Cb -0.20 -0.14 -0.01 0.00 0.01 0.00 0.00 72.50 72.16 2jq8 s THR 44 CO 0.32 -0.21 -0.24 0.00 -0.69 0.00 0.00 174.62 173.80 2jq8 s ARG 45 N -0.62 2.78 0.06 4.92 1.70 -1.26 -5.05 118.95 121.47 2jq8 s ARG 45 Ca -0.07 -0.89 -0.36 0.00 -0.47 0.00 0.00 55.73 53.95 2jq8 s ARG 45 Cb -0.04 -2.23 -0.19 0.00 -0.57 0.00 0.00 34.95 31.91 2jq8 s ARG 45 CO -0.00 0.30 1.54 0.78 -1.08 0.00 0.00 175.30 176.83 2jq8 h GLY 46 N 6.34 -1.34 0.00 3.88 0.00 -2.04 -3.57 103.07 106.34 2jq8 h GLY 46 Ca -0.26 0.51 0.00 0.00 0.00 0.00 0.00 47.33 47.58 2jq8 h GLY 46 CO 0.47 -0.48 0.00 1.34 0.00 0.00 0.00 176.54 177.87