#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2knx n SER 2 N 0.00 -6.04 -0.95 1.61 7.64 -1.26 -4.66 113.62 109.96 2knx n SER 2 Ca 0.00 -0.18 0.00 0.00 1.01 0.00 0.00 58.87 59.70 2knx n SER 2 Cb 0.00 -4.93 0.00 0.00 -1.01 0.00 0.00 64.21 58.27 2knx n SER 2 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 2knx n GLU 3 N -3.60 0.00 -2.17 1.43 2.13 -1.26 -4.18 120.64 113.00 2knx n GLU 3 Ca -0.17 0.00 -0.30 0.00 0.66 0.00 0.00 57.16 57.35 2knx n GLU 3 Cb 0.65 0.00 -0.05 0.00 0.27 0.00 0.00 31.44 32.31 2knx n GLU 3 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 2knx s GLY 4 N -5.83 0.44 -0.05 8.31 0.00 -1.26 -4.60 107.32 104.34 2knx s GLY 4 Ca 0.00 -1.83 0.22 0.00 0.00 0.00 0.00 44.72 43.11 2knx s GLY 4 CO 0.00 3.32 1.18 1.17 0.00 0.00 0.00 173.10 178.77 2knx n LYS 5 N 8.73 0.36 0.00 2.90 4.81 -1.26 -4.90 118.16 128.81 2knx n LYS 5 Ca 0.40 -2.28 0.00 0.00 -0.87 0.00 0.00 58.31 55.56 2knx n LYS 5 Cb 0.48 -0.37 0.00 0.00 0.02 0.00 0.00 35.03 35.15 2knx n LYS 5 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 2knx n THR 6 N 0.13 0.00 -0.03 3.15 -2.24 -1.26 -4.89 114.28 109.14 2knx n THR 6 Ca 0.09 0.03 -0.03 0.00 -2.27 0.00 0.00 64.05 61.88 2knx n THR 6 Cb 1.04 -0.99 -0.01 0.00 -2.10 0.00 0.00 70.33 68.28 2knx n THR 6 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2knx n GLY 8 N 1.51 -1.73 0.27 0.00 0.00 -1.26 -3.57 105.19 100.41 2knx n GLY 8 Ca -0.04 -1.19 0.01 0.00 0.00 0.00 0.00 46.02 44.80 2knx n GLY 8 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2knx h PRO 9 N 0.00 0.64 -4.00 1.61 0.13 -1.99 -3.33 132.00 125.07 2knx h PRO 9 Ca 0.02 -0.04 -0.75 0.00 -0.87 0.00 0.00 66.00 64.35 2knx h PRO 9 Cb 0.73 -0.15 -0.27 0.00 0.13 0.00 0.00 31.00 31.44 2knx h PRO 9 CO 0.01 0.43 -0.18 -1.54 -0.23 0.00 0.00 178.00 176.48 2knx s SER 10 N -5.55 6.14 -0.02 1.44 1.04 -1.26 -5.03 113.70 110.47 2knx s SER 10 Ca -0.13 -2.25 -0.08 0.00 0.48 0.00 0.00 55.95 53.97 2knx s SER 10 Cb 0.18 -2.12 0.01 0.00 0.10 0.00 0.00 66.02 64.19 2knx s SER 10 CO 0.77 -0.66 0.17 -0.94 0.98 0.00 0.00 173.24 173.55 2knx s SER 11 N 2.53 -0.06 0.10 7.02 1.04 -1.23 -3.13 113.70 119.96 2knx s SER 11 Ca 0.10 -0.02 0.04 0.00 0.48 0.00 0.00 55.95 56.55 2knx s SER 11 Cb -0.21 0.27 -0.04 0.00 0.10 0.00 0.00 66.02 66.13 2knx s SER 11 CO -0.03 -0.30 0.04 0.12 0.98 0.00 0.00 173.24 174.05 2knx s PHE 12 N -1.00 3.06 -0.22 5.02 5.36 0.27 -4.86 117.98 125.62 2knx s PHE 12 Ca -0.11 0.00 -0.07 0.00 -0.96 0.00 0.00 56.93 55.80 2knx s PHE 12 Cb -0.06 -1.55 -0.03 0.00 -0.34 0.00 0.00 43.02 41.04 2knx s PHE 12 CO 0.02 0.50 0.05 -1.54 -1.46 0.00 0.00 175.22 172.78 2knx s SER 13 N -2.43 5.19 0.39 6.13 1.04 -1.26 -1.56 113.70 121.21 2knx s SER 13 Ca 0.27 -0.13 -0.24 0.00 0.48 0.00 0.00 55.95 56.34 2knx s SER 13 Cb -0.12 -1.91 -0.10 0.00 0.10 0.00 0.00 66.02 64.00 2knx s SER 13 CO 0.20 0.05 1.00 0.00 0.98 0.00 0.00 173.24 175.47 2knx s PRO 15 N -2.57 4.37 -1.14 0.00 0.04 -1.26 -3.16 135.00 131.28 2knx s PRO 15 Ca 0.57 2.15 -0.03 0.00 0.04 0.00 0.00 61.00 63.73 2knx s PRO 15 Cb -0.18 -3.13 0.00 0.00 0.04 0.00 0.00 34.50 31.23 2knx s PRO 15 CO 0.23 -0.23 0.38 0.41 0.04 0.00 0.00 177.00 177.83 2knx n GLY 16 N 1.71 -0.19 0.00 0.56 0.00 -1.26 -4.98 105.19 101.03 2knx n GLY 16 Ca 0.04 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.91 2knx n GLY 16 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2knx n THR 17 N -4.14 0.00 1.34 2.61 5.66 -1.19 -5.01 114.28 113.55 2knx n THR 17 Ca -0.09 0.00 0.12 0.00 -3.05 0.00 0.00 64.05 61.02 2knx n THR 17 Cb 0.59 0.00 0.44 0.00 -1.55 0.00 0.00 70.33 69.81 2knx n THR 17 CO 0.00 0.00 0.00 1.57 -3.05 0.00 0.00 175.07 173.59 2knx n HIS 18 N -0.02 0.13 -1.68 1.09 -0.00 -1.26 -4.13 115.22 109.35 2knx n HIS 18 Ca 0.00 -0.06 -0.45 0.00 0.46 0.00 0.00 57.72 57.67 2knx n HIS 18 Cb 0.00 0.00 -0.04 0.00 -0.12 0.00 0.00 29.99 29.83 2knx n HIS 18 CO 0.00 0.00 0.00 1.55 0.46 0.00 0.00 176.34 178.35 2knx n VAL 19 N 0.25 0.46 -3.83 3.57 3.14 -1.26 -4.84 118.33 115.82 2knx n VAL 19 Ca 0.17 -0.08 -0.21 0.00 -2.96 0.00 0.00 64.34 61.26 2knx n VAL 19 Cb 0.34 -1.98 -0.03 0.00 -1.06 0.00 0.00 33.84 31.11 2knx n VAL 19 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2knx s VAL 21 N -2.15 -0.01 0.46 0.00 0.11 -0.60 -4.83 120.40 113.37 2knx s VAL 21 Ca 0.38 0.03 -0.23 0.00 -2.93 0.00 0.00 61.98 59.24 2knx s VAL 21 Cb -0.08 -0.76 -0.08 0.00 -1.53 0.00 0.00 36.38 33.93 2knx s VAL 21 CO 0.28 0.01 1.13 -2.16 -3.33 0.00 0.00 175.10 171.03 2knx s PRO 22 N 1.02 3.79 0.34 1.54 0.04 -1.24 0.98 135.00 141.47 2knx s PRO 22 Ca -0.06 1.67 0.11 0.00 0.04 0.00 0.00 61.00 62.76 2knx s PRO 22 Cb -0.06 -2.36 0.91 0.00 0.04 0.00 0.00 34.50 33.04 2knx s PRO 22 CO -0.09 -0.50 1.75 1.49 0.04 0.00 0.00 177.00 179.69 2knx h GLU 23 N 2.00 0.55 -0.17 4.56 4.81 -1.90 0.79 114.58 125.23 2knx h GLU 23 Ca -0.49 -0.03 0.05 0.00 -0.13 0.00 0.00 59.36 58.75 2knx h GLU 23 Cb 1.24 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.49 2knx h GLU 23 CO 0.60 0.36 0.12 0.07 -0.73 0.00 0.00 179.01 179.44 2knx h ARG 24 N 0.57 0.00 0.00 1.92 0.11 -1.91 -0.35 114.38 114.72 2knx h ARG 24 Ca 0.62 0.00 -0.17 0.00 0.10 0.00 0.00 59.98 60.54 2knx h ARG 24 Cb 1.24 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 32.29 2knx h ARG 24 CO -0.42 0.00 -1.32 -1.49 0.10 0.00 0.00 179.97 176.84 2knx h TRP 25 N 0.00 0.00 -1.80 4.08 4.06 0.16 -3.42 115.95 119.03 2knx h TRP 25 Ca 0.08 0.00 -0.61 0.00 2.06 0.00 0.00 58.89 60.42 2knx h TRP 25 Cb 0.33 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.49 2knx h TRP 25 CO 0.00 0.59 1.36 1.28 -3.56 0.00 0.00 178.44 178.11 2knx n LEU 26 N -2.94 3.11 -3.53 -4.49 7.99 -0.11 -2.07 117.00 114.96 2knx n LEU 26 Ca -0.08 0.51 -0.20 0.00 -0.01 0.00 0.00 56.01 56.22 2knx n LEU 26 Cb 0.84 -1.44 0.06 0.00 -0.11 0.00 0.00 43.42 42.77 2knx n LEU 26 CO 0.43 -0.46 -0.00 0.00 -1.51 0.00 0.00 177.39 175.85 2knx n ASP 28 N -3.06 1.30 0.00 0.00 5.75 -0.88 -4.99 116.55 114.66 2knx n ASP 28 Ca -0.22 -0.16 0.00 0.00 -0.01 0.00 0.00 54.79 54.40 2knx n ASP 28 Cb 0.65 1.58 0.00 0.00 -1.03 0.00 0.00 41.12 42.32 2knx n ASP 28 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2knx n GLY 29 N 1.57 1.82 3.27 6.12 0.00 -1.26 -5.08 105.19 111.63 2knx n GLY 29 Ca -0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.61 2knx n GLY 29 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2knx s ASP 30 N -1.86 5.49 -0.90 1.61 1.01 -1.26 -5.01 116.67 115.73 2knx s ASP 30 Ca 0.00 -1.33 -0.26 0.00 0.71 0.00 0.00 52.55 51.68 2knx s ASP 30 Cb 0.00 -1.93 -0.18 0.00 1.01 0.00 0.00 42.92 41.82 2knx s ASP 30 CO 0.00 -0.43 2.27 0.29 0.21 0.00 0.00 175.17 177.50 2knx n LYS 31 N 4.86 0.34 0.17 8.23 5.02 -1.26 -4.68 118.16 130.85 2knx n LYS 31 Ca -0.11 -1.17 0.04 0.00 -2.02 0.00 0.00 58.31 55.05 2knx n LYS 31 Cb 0.44 -3.70 0.26 0.00 -0.02 0.00 0.00 35.03 32.01 2knx n LYS 31 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 2knx h ASP 32 N 12.18 0.00 -3.98 4.39 3.32 -1.93 -3.45 116.42 126.94 2knx h ASP 32 Ca 0.00 0.00 -0.48 0.00 0.02 0.00 0.00 57.03 56.57 2knx h ASP 32 Cb 1.00 0.00 0.06 0.00 0.22 0.00 0.00 39.33 40.62 2knx h ASP 32 CO 1.02 0.43 0.27 0.00 -1.72 0.00 0.00 179.24 179.24 2knx h ALA 34 N -0.35 1.34 0.00 0.00 0.00 -1.98 -2.98 119.26 115.28 2knx h ALA 34 Ca -0.45 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.30 2knx h ALA 34 Cb 1.25 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.83 2knx h ALA 34 CO 0.62 0.49 -0.01 -0.25 0.00 0.00 0.00 179.25 180.09 2knx n ASP 35 N -4.32 2.22 -1.41 0.00 8.00 -1.26 -4.97 116.55 114.81 2knx n ASP 35 Ca 0.04 -2.85 -0.14 0.00 0.71 0.00 0.00 54.79 52.55 2knx n ASP 35 Cb 0.18 -0.34 -0.03 0.00 -0.02 0.00 0.00 41.12 40.90 2knx n ASP 35 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2knx n GLY 36 N -1.22 0.49 0.37 0.44 0.00 -1.13 -4.88 105.19 99.26 2knx n GLY 36 Ca 0.13 -0.31 0.15 0.00 0.00 0.00 0.00 46.02 45.98 2knx n GLY 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2knx h ALA 37 N 0.40 1.87 0.00 4.61 0.00 -1.93 0.59 119.26 124.80 2knx h ALA 37 Ca -0.32 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.64 2knx h ALA 37 Cb 1.12 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 2knx h ALA 37 CO 0.41 -0.21 -0.01 0.38 0.00 0.00 0.00 179.25 179.82 2knx h ASP 38 N 0.64 0.00 -0.56 0.00 3.04 -1.94 -0.01 116.42 117.59 2knx h ASP 38 Ca 0.54 0.00 -0.01 0.00 -3.24 0.00 0.00 57.03 54.31 2knx h ASP 38 Cb 1.00 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 39.28 2knx h ASP 38 CO -0.30 0.01 0.02 -0.62 -2.04 0.00 0.00 179.24 176.31 2knx n GLU 39 N -3.50 4.62 -4.43 4.15 -0.58 0.21 -1.61 120.64 119.50 2knx n GLU 39 Ca -0.03 -2.97 -0.25 0.00 -0.42 0.00 0.00 57.16 53.48 2knx n GLU 39 Cb 0.10 -2.23 -0.07 0.00 -0.57 0.00 0.00 31.44 28.67 2knx n GLU 39 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 2knx n SER 40 N 0.54 1.13 0.32 1.62 2.88 -0.02 -4.81 113.62 115.28 2knx n SER 40 Ca 0.27 -3.20 0.20 0.00 -1.33 0.00 0.00 58.87 54.80 2knx n SER 40 Cb 1.16 1.08 1.07 0.00 -0.75 0.00 0.00 64.21 66.77 2knx n SER 40 CO 0.00 0.00 0.00 0.40 -1.23 0.00 0.00 175.04 174.21 2knx h ILE 41 N 1.71 0.18 -0.95 2.46 5.03 -1.93 -2.38 117.51 121.64 2knx h ILE 41 Ca -0.32 -0.09 0.22 0.00 -0.12 0.00 0.00 64.86 64.56 2knx h ILE 41 Cb 1.23 1.07 -0.07 0.00 -3.03 0.00 0.00 36.82 36.02 2knx h ILE 41 CO 0.50 0.01 0.62 0.00 -0.68 0.00 0.00 178.15 178.61 2knx h ALA 42 N 1.99 2.22 0.00 1.87 0.00 -1.95 0.38 119.26 123.77 2knx h ALA 42 Ca -0.00 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 2knx h ALA 42 Cb 0.07 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2knx h ALA 42 CO 0.00 -0.54 -0.67 0.00 0.00 0.00 0.00 179.25 178.04 2knx h ALA 43 N 1.61 0.71 0.00 0.00 0.00 -1.50 -3.48 119.26 116.59 2knx h ALA 43 Ca 0.51 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 55.15 2knx h ALA 43 Cb 1.27 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.10 2knx h ALA 43 CO -0.21 0.32 0.00 0.41 0.00 0.00 0.00 179.25 179.78 2knx n GLY 44 N 1.21 1.06 0.08 0.00 0.00 0.13 -5.06 105.19 102.60 2knx n GLY 44 Ca -0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 2knx n GLY 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2knx n LEU 46 N -4.23 -1.99 0.03 0.00 4.77 -1.26 -4.94 117.00 109.37 2knx n LEU 46 Ca -0.11 -0.12 -0.15 0.00 -0.03 0.00 0.00 56.01 55.60 2knx n LEU 46 Cb 0.41 -1.66 -0.14 0.00 -2.33 0.00 0.00 43.42 39.70 2knx n LEU 46 CO 0.17 0.08 -0.48 1.88 -1.33 0.00 0.00 177.39 177.71 2knx h TYR 47 N -0.57 0.32 -4.14 -1.77 0.05 -1.94 -3.49 116.97 105.44 2knx h TYR 47 Ca -0.25 -0.24 -0.28 0.00 0.05 0.00 0.00 58.73 58.02 2knx h TYR 47 Cb 1.17 -0.01 0.09 0.00 1.01 0.00 0.00 36.73 38.98 2knx h TYR 47 CO 0.25 1.36 -0.46 -1.71 -1.05 0.00 0.00 178.16 176.55 2knx n ASN 48 N -3.35 -5.01 0.00 3.88 5.15 -1.26 -4.97 115.26 109.70 2knx n ASN 48 Ca -0.20 -0.34 0.00 0.00 -0.60 0.00 0.00 54.58 53.45 2knx n ASN 48 Cb 1.04 -3.66 0.00 0.00 -0.53 0.00 0.00 39.78 36.64 2knx n ASN 48 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 2knx n SER 49 N -1.56 0.00 0.00 1.20 3.41 -1.26 -5.23 113.62 110.18 2knx n SER 49 Ca -0.01 0.72 0.00 0.00 -0.26 0.00 0.00 58.87 59.31 2knx n SER 49 Cb 0.55 -0.23 0.00 0.00 -0.26 0.00 0.00 64.21 64.27 2knx n SER 49 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95