#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 0.84 0.00 1.61 7.64 -1.26 -5.04 113.62 117.41 2knx n SER 2 Ca 0.00 -2.05 0.00 0.00 1.01 0.00 0.00 58.87 57.83 2knx n SER 2 Cb 0.00 -0.22 0.00 0.00 -1.01 0.00 0.00 64.21 62.98 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 -0.54 0.00 0.00 1.43 2.13 -1.26 -4.56 120.64 117.84 2knx n GLU 3 Ca 0.01 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.83 2knx n GLU 3 Cb 0.87 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.58 2knx n GLU 3 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2knx n GLY 4 N 0.00 4.04 2.67 8.31 0.00 -1.26 -5.14 105.19 113.81 2knx n GLY 4 Ca 0.00 -0.79 -0.03 0.00 0.00 0.00 0.00 46.02 45.20 2knx n GLY 4 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2knx n LYS 5 N 0.00 0.08 0.01 1.61 3.00 -1.26 -5.06 118.16 116.55 2knx n LYS 5 Ca 0.00 -0.72 -0.01 0.00 -0.00 0.00 0.00 58.31 57.57 2knx n LYS 5 Cb 0.00 0.16 -0.00 0.00 0.00 0.00 0.00 35.03 35.18 2knx n LYS 5 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81 2knx n THR 6 N 2.45 0.56 0.00 3.15 -1.04 -1.26 -5.06 114.28 113.08 2knx n THR 6 Ca 0.10 0.15 0.00 0.00 -2.04 0.00 0.00 64.05 62.26 2knx n THR 6 Cb 0.66 -1.56 0.00 0.00 -1.82 0.00 0.00 70.33 67.61 2knx n THR 6 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2knx n GLY 8 N -0.72 0.88 3.70 0.00 0.00 -1.26 -3.80 105.19 104.00 2knx n GLY 8 Ca 0.00 -0.84 -0.37 0.00 0.00 0.00 0.00 46.02 44.81 2knx n GLY 8 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2knx n PRO 9 N -0.01 1.04 -3.50 1.61 -0.04 -1.26 -3.16 135.00 129.68 2knx n PRO 9 Ca 0.00 0.41 -0.21 0.00 -0.04 0.00 0.00 63.50 63.66 2knx n PRO 9 Cb 0.00 -2.46 0.08 0.00 -0.04 0.00 0.00 33.50 31.08 2knx n PRO 9 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2knx n SER 10 N -1.73 -5.34 -4.91 3.54 7.64 -1.26 -4.46 113.62 107.09 2knx n SER 10 Ca 0.16 -0.52 -0.27 0.00 1.01 0.00 0.00 58.87 59.24 2knx n SER 10 Cb 0.48 -4.78 0.07 0.00 -1.01 0.00 0.00 64.21 58.97 2knx n SER 10 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2knx s SER 11 N -3.49 4.87 -0.02 6.43 1.04 -1.19 -2.52 113.70 118.82 2knx s SER 11 Ca 0.45 0.67 0.01 0.00 0.48 0.00 0.00 55.95 57.55 2knx s SER 11 Cb -0.20 -1.32 0.02 0.00 0.10 0.00 0.00 66.02 64.62 2knx s SER 11 CO 0.68 -1.61 -0.01 0.12 0.98 0.00 0.00 173.24 173.40 2knx s PHE 12 N -3.34 0.31 0.15 5.02 5.36 0.78 -4.90 117.98 121.36 2knx s PHE 12 Ca 0.60 -0.02 -0.06 0.00 -0.96 0.00 0.00 56.93 56.49 2knx s PHE 12 Cb -0.11 -0.34 -0.06 0.00 -0.34 0.00 0.00 43.02 42.17 2knx s PHE 12 CO 0.47 -0.09 0.40 -1.54 -1.46 0.00 0.00 175.22 173.00 2knx s SER 13 N 0.66 6.52 0.06 6.13 1.04 -1.26 -1.16 113.70 125.68 2knx s SER 13 Ca -0.07 0.65 -0.20 0.00 0.48 0.00 0.00 55.95 56.82 2knx s SER 13 Cb -0.10 -2.12 -0.06 0.00 0.10 0.00 0.00 66.02 63.84 2knx s SER 13 CO -0.01 0.04 0.59 0.00 0.98 0.00 0.00 173.24 174.84 2knx n PRO 15 N 2.00 2.47 0.00 0.00 -0.04 -1.26 -2.38 135.00 135.79 2knx n PRO 15 Ca -0.09 0.89 0.00 0.00 -0.04 0.00 0.00 63.50 64.25 2knx n PRO 15 Cb 0.51 -2.66 0.00 0.00 -0.04 0.00 0.00 33.50 31.31 2knx n PRO 15 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2knx n GLY 16 N 2.88 2.43 3.91 0.55 0.00 -1.26 -4.97 105.19 108.73 2knx n GLY 16 Ca 0.13 -0.55 -0.25 0.00 0.00 0.00 0.00 46.02 45.35 2knx n GLY 16 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2knx s THR 17 N -0.37 1.80 -0.46 2.61 -1.32 -1.00 -5.06 115.64 111.83 2knx s THR 17 Ca 0.00 -1.43 0.04 0.00 -1.21 0.00 0.00 61.69 59.09 2knx s THR 17 Cb 0.00 -2.23 0.42 0.00 -1.51 0.00 0.00 72.50 69.18 2knx s THR 17 CO 0.00 0.00 1.25 1.41 -2.21 0.00 0.00 174.62 175.07 2knx n HIS 18 N -1.78 3.25 -1.50 9.09 -0.00 -1.26 -4.26 115.22 118.76 2knx n HIS 18 Ca 0.01 -2.88 -0.23 0.00 -0.00 0.00 0.00 57.72 54.62 2knx n HIS 18 Cb 0.64 -0.28 0.17 0.00 -0.00 0.00 0.00 29.99 30.52 2knx n HIS 18 CO 0.00 0.00 0.00 1.33 -0.00 0.00 0.00 176.34 177.67 2knx n VAL 19 N -0.54 0.00 -3.65 1.59 0.24 -1.26 -4.94 118.33 109.77 2knx n VAL 19 Ca 0.42 -0.65 -0.13 0.00 -2.04 0.00 0.00 64.34 61.94 2knx n VAL 19 Cb 0.67 -1.51 -0.13 0.00 -1.47 0.00 0.00 33.84 31.40 2knx n VAL 19 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2knx s VAL 21 N 2.44 1.81 0.36 0.00 0.11 -0.31 -4.34 120.40 120.48 2knx s VAL 21 Ca 0.01 -0.95 -0.26 0.00 -2.93 0.00 0.00 61.98 57.86 2knx s VAL 21 Cb -0.12 -1.53 -0.09 0.00 -1.53 0.00 0.00 36.38 33.11 2knx s VAL 21 CO -0.09 0.51 1.06 -2.16 -3.33 0.00 0.00 175.10 171.09 2knx s PRO 22 N -0.24 4.32 0.41 1.54 0.04 -1.25 -0.15 135.00 139.66 2knx s PRO 22 Ca 0.01 1.61 0.21 0.00 0.04 0.00 0.00 61.00 62.87 2knx s PRO 22 Cb -0.11 -2.75 1.19 0.00 0.04 0.00 0.00 34.50 32.86 2knx s PRO 22 CO 0.02 -0.03 1.74 0.93 0.04 0.00 0.00 177.00 179.70 2knx h GLU 23 N 2.93 0.30 -0.01 4.56 5.08 -1.69 1.20 114.58 126.95 2knx h GLU 23 Ca -0.48 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 57.85 2knx h GLU 23 Cb 1.21 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 30.39 2knx h GLU 23 CO 0.64 0.20 -0.04 0.07 -1.00 0.00 0.00 179.01 178.88 2knx h ARG 24 N 0.31 0.02 0.00 2.33 0.11 -1.91 -1.54 114.38 113.70 2knx h ARG 24 Ca 0.64 -0.00 -0.19 0.00 0.10 0.00 0.00 59.98 60.54 2knx h ARG 24 Cb 1.76 -0.00 -0.03 0.00 1.11 0.00 0.00 29.97 32.81 2knx h ARG 24 CO -0.32 0.06 -1.27 -1.49 0.10 0.00 0.00 179.97 177.06 2knx h TRP 25 N 0.02 0.00 -0.71 4.08 4.06 0.10 -3.43 115.95 120.07 2knx h TRP 25 Ca 0.00 0.00 -0.62 0.00 2.06 0.00 0.00 58.89 60.34 2knx h TRP 25 Cb 0.09 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 28.21 2knx h TRP 25 CO 0.00 0.69 1.51 1.28 -3.56 0.00 0.00 178.44 178.36 2knx n LEU 26 N -3.02 1.47 -3.48 -4.49 7.99 -0.23 -1.90 117.00 113.34 2knx n LEU 26 Ca -0.08 0.27 -0.17 0.00 -0.01 0.00 0.00 56.01 56.01 2knx n LEU 26 Cb 0.87 -1.17 0.01 0.00 -0.11 0.00 0.00 43.42 43.03 2knx n LEU 26 CO 0.43 -0.86 0.03 0.00 -1.51 0.00 0.00 177.39 175.48 2knx n ASP 28 N -2.33 1.55 0.00 0.00 5.75 -0.80 -4.98 116.55 115.74 2knx n ASP 28 Ca -0.14 -1.28 0.00 0.00 -0.01 0.00 0.00 54.79 53.37 2knx n ASP 28 Cb 0.59 0.42 0.00 0.00 -1.03 0.00 0.00 41.12 41.11 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 1.04 0.92 3.78 6.12 0.00 -1.26 -5.09 105.19 110.70 2knx n GLY 29 Ca 0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 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 -1.18 5.71 -0.92 1.61 1.01 -1.26 -5.05 116.67 116.58 2knx s ASP 30 Ca 0.00 0.17 -0.22 0.00 0.71 0.00 0.00 52.55 53.21 2knx s ASP 30 Cb 0.00 -1.66 0.07 0.00 1.01 0.00 0.00 42.92 42.35 2knx s ASP 30 CO 0.00 0.29 1.29 -0.54 0.21 0.00 0.00 175.17 176.42 2knx s LYS 31 N -1.63 3.49 0.01 8.23 1.02 -1.26 -4.77 119.74 124.84 2knx s LYS 31 Ca 0.22 -1.17 0.11 0.00 0.02 0.00 0.00 55.97 55.15 2knx s LYS 31 Cb -0.12 -4.97 -0.21 0.00 -0.52 0.00 0.00 37.83 32.00 2knx s LYS 31 CO 0.12 -2.04 0.86 0.38 -0.92 0.00 0.00 175.35 173.76 2knx h ASP 32 N 9.53 0.00 -4.23 2.83 2.03 -1.93 -3.46 116.42 121.18 2knx h ASP 32 Ca 0.08 0.00 -0.47 0.00 -0.73 0.00 0.00 57.03 55.91 2knx h ASP 32 Cb 1.03 0.00 0.13 0.00 -0.83 0.00 0.00 39.33 39.65 2knx h ASP 32 CO 1.29 0.97 0.30 0.00 -1.03 0.00 0.00 179.24 180.78 2knx h ALA 34 N -1.39 0.71 0.00 0.00 0.00 -1.97 -3.13 119.26 113.48 2knx h ALA 34 Ca -0.50 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.29 2knx h ALA 34 Cb 1.31 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 2knx h ALA 34 CO 0.61 0.26 -0.51 -0.40 0.00 0.00 0.00 179.25 179.21 2knx n ASP 35 N -4.58 1.70 -1.53 0.00 5.75 -1.26 -4.94 116.55 111.69 2knx n ASP 35 Ca 0.03 -3.82 -0.18 0.00 -0.01 0.00 0.00 54.79 50.81 2knx n ASP 35 Cb 0.11 -0.52 -0.06 0.00 -1.03 0.00 0.00 41.12 39.62 2knx n ASP 35 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2knx n GLY 36 N -1.07 1.14 0.28 6.12 0.00 -1.18 -4.87 105.19 105.61 2knx n GLY 36 Ca 0.18 -0.17 0.08 0.00 0.00 0.00 0.00 46.02 46.11 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 0.24 1.07 -0.01 4.61 0.00 -1.92 0.84 119.26 124.09 2knx h ALA 37 Ca -0.38 0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.71 2knx h ALA 37 Cb 1.19 0.22 -0.00 0.00 0.00 0.00 0.00 17.79 19.19 2knx h ALA 37 CO 0.52 -0.34 0.03 0.38 0.00 0.00 0.00 179.25 179.84 2knx h ASP 38 N 0.30 0.00 -0.46 0.00 3.04 -1.94 0.11 116.42 117.47 2knx h ASP 38 Ca 0.45 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.24 2knx h ASP 38 Cb 0.80 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.09 2knx h ASP 38 CO -0.52 0.00 0.00 -0.62 -2.04 0.00 0.00 179.24 176.06 2knx n GLU 39 N -3.41 3.56 -3.90 4.15 -0.58 0.29 0.10 120.64 120.85 2knx n GLU 39 Ca -0.03 -2.28 -0.21 0.00 -0.42 0.00 0.00 57.16 54.22 2knx n GLU 39 Cb 0.11 -1.93 -0.05 0.00 -0.57 0.00 0.00 31.44 28.99 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 0.61 1.92 0.18 1.62 2.88 0.38 -4.94 113.62 116.28 2knx n SER 40 Ca 0.20 -2.66 0.04 0.00 -1.33 0.00 0.00 58.87 55.12 2knx n SER 40 Cb 0.85 0.58 0.32 0.00 -0.75 0.00 0.00 64.21 65.21 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 1.39 1.01 -0.74 2.46 5.03 -1.78 -2.48 117.51 122.40 2knx h ILE 41 Ca -0.27 -1.58 0.18 0.00 -0.12 0.00 0.00 64.86 63.08 2knx h ILE 41 Cb 0.94 1.93 -0.04 0.00 -3.03 0.00 0.00 36.82 36.62 2knx h ILE 41 CO 0.44 0.40 0.51 0.00 -0.68 0.00 0.00 178.15 178.82 2knx h ALA 42 N 1.59 2.42 0.00 1.87 0.00 -1.87 0.30 119.26 123.57 2knx h ALA 42 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2knx h ALA 42 Cb 0.89 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.69 2knx h ALA 42 CO 0.05 -0.63 -0.74 0.00 0.00 0.00 0.00 179.25 177.93 2knx n ALA 43 N -2.60 3.08 0.00 0.00 0.00 -1.15 -4.94 120.51 114.91 2knx n ALA 43 Ca 0.15 -0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.29 2knx n ALA 43 Cb 0.68 -1.11 0.00 0.00 0.00 0.00 0.00 19.45 19.02 2knx n ALA 43 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2knx n GLY 44 N 1.35 1.78 3.28 0.00 0.00 0.11 -5.03 105.19 106.68 2knx n GLY 44 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 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 4.94 4.16 0.07 0.00 4.77 -1.26 -3.09 117.00 126.59 2knx n LEU 46 Ca -0.10 -3.96 0.12 0.00 -0.03 0.00 0.00 56.01 52.04 2knx n LEU 46 Cb 0.43 -0.60 0.46 0.00 -2.33 0.00 0.00 43.42 41.38 2knx n LEU 46 CO 0.39 1.41 0.86 0.00 -1.33 0.00 0.00 177.39 178.73 2knx n TYR 47 N -1.07 0.52 0.00 -1.77 4.11 -1.26 -4.90 117.16 112.79 2knx n TYR 47 Ca 0.34 0.17 0.00 0.00 -0.00 0.00 0.00 57.90 58.41 2knx n TYR 47 Cb 0.95 -0.78 0.00 0.00 -0.00 0.00 0.00 39.34 39.51 2knx n TYR 47 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.86 176.95 2knx n ASN 48 N -1.95 0.00 -1.03 9.48 3.02 -1.26 -4.85 115.26 118.67 2knx n ASN 48 Ca 0.04 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.59 2knx n ASN 48 Cb 0.30 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.47 2knx n ASN 48 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 2knx n SER 49 N 1.32 -5.88 0.00 6.41 2.88 -1.26 -5.19 113.62 111.91 2knx n SER 49 Ca 0.00 0.85 0.03 0.00 -1.33 0.00 0.00 58.87 58.42 2knx n SER 49 Cb 0.00 -2.78 0.18 0.00 -0.75 0.00 0.00 64.21 60.86 2knx n SER 49 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22