#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iwc n GLY 2 N 0.00 1.68 1.55 3.17 0.00 -1.26 -5.14 105.19 105.20 1iwc n GLY 2 Ca 0.00 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 44.97 1iwc n GLY 2 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1iwc n LYS 3 N -0.79 -3.27 0.00 1.61 4.76 -1.26 -5.03 118.16 114.18 1iwc n LYS 3 Ca 0.00 2.53 0.00 0.00 -2.87 0.00 0.00 58.31 57.97 1iwc n LYS 3 Cb 0.00 -2.70 0.00 0.00 -1.84 0.00 0.00 35.03 30.49 1iwc n LYS 3 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1iwc n ALA 4 N 1.12 0.00 0.03 7.82 0.00 -1.26 -4.88 120.51 123.34 1iwc n ALA 4 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 1iwc n ALA 4 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 1iwc n ALA 4 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1iwc h GLU 5 N 0.00 -0.09 0.00 0.00 4.81 -2.00 -3.08 114.58 114.22 1iwc h GLU 5 Ca 0.00 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 1iwc h GLU 5 Cb 0.00 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.40 1iwc h GLU 5 CO 0.00 -0.06 -0.15 -0.91 -0.73 0.00 0.00 179.01 177.16 1iwc h ASN 6 N -0.23 0.00 0.24 1.04 4.21 -1.95 -2.06 115.58 116.84 1iwc h ASN 6 Ca -0.01 0.00 -0.01 0.00 1.21 0.00 0.00 56.30 57.49 1iwc h ASN 6 Cb 0.07 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.27 1iwc h ASN 6 CO 0.02 0.15 -0.17 0.22 -1.29 0.00 0.00 177.43 176.36 1iwc h TYR 7 N 0.00 -0.45 -0.72 1.19 3.20 -1.90 0.17 116.97 118.47 1iwc h TYR 7 Ca -0.00 -0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.80 1iwc h TYR 7 Cb 0.46 0.16 -0.03 0.00 1.54 0.00 0.00 36.73 38.86 1iwc h TYR 7 CO 0.00 -0.24 0.20 0.93 -1.64 0.00 0.00 178.16 177.41 1iwc h GLU 8 N -0.38 1.12 0.00 1.82 5.08 -1.55 -1.13 114.58 119.54 1iwc h GLU 8 Ca -0.03 -0.25 0.00 0.00 -1.00 0.00 0.00 59.36 58.08 1iwc h GLU 8 Cb 0.31 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.41 1iwc h GLU 8 CO 0.02 0.97 0.00 -0.11 -1.00 0.00 0.00 179.01 178.89 1iwc n LEU 9 N -4.24 0.12 -0.06 1.33 0.00 -0.78 -2.57 117.00 110.81 1iwc n LEU 9 Ca 0.06 0.55 -0.03 0.00 0.00 0.00 0.00 56.01 56.58 1iwc n LEU 9 Cb 0.24 -0.55 -0.01 0.00 0.00 0.00 0.00 43.42 43.11 1iwc n LEU 9 CO 0.42 -0.48 -0.21 0.22 0.00 0.00 0.00 177.39 177.34 1iwc h TYR 10 N 0.00 0.00 -0.07 1.96 3.20 0.67 -2.75 116.97 119.97 1iwc h TYR 10 Ca 0.00 0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.89 1iwc h TYR 10 Cb 0.11 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.38 1iwc h TYR 10 CO 0.00 0.01 0.23 -0.56 -1.64 0.00 0.00 178.16 176.20 1iwc h GLN 11 N -1.00 0.00 0.01 1.82 3.07 -1.45 0.44 115.11 118.00 1iwc h GLN 11 Ca -0.00 0.00 -0.29 0.00 0.09 0.00 0.00 58.65 58.45 1iwc h GLN 11 Cb 0.32 0.00 -0.04 0.00 0.08 0.00 0.00 27.48 27.84 1iwc h GLN 11 CO -0.00 0.00 -1.64 -0.24 0.09 0.00 0.00 178.83 177.04 1iwc h VAL 12 N 0.00 0.94 0.00 1.86 3.04 -1.62 -3.33 116.25 117.14 1iwc h VAL 12 Ca 0.04 -2.76 -0.07 0.00 -1.01 0.00 0.00 66.70 62.89 1iwc h VAL 12 Cb 0.49 2.49 -0.01 0.00 -2.01 0.00 0.00 31.29 32.25 1iwc h VAL 12 CO -0.00 0.58 -0.33 -0.08 -1.01 0.00 0.00 177.57 176.73 1iwc h GLU 13 N 0.01 0.00 -0.86 4.17 4.81 -0.60 -2.59 114.58 119.53 1iwc h GLU 13 Ca -0.26 0.00 0.25 0.00 -0.13 0.00 0.00 59.36 59.22 1iwc h GLU 13 Cb 1.99 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 31.33 1iwc h GLU 13 CO 0.09 0.33 0.76 -0.07 -0.73 0.00 0.00 179.01 179.39 1iwc h LEU 14 N 0.00 0.00-10.08 1.64 3.38 -1.59 -3.40 115.31 105.27 1iwc h LEU 14 Ca -0.00 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.43 1iwc h LEU 14 Cb 0.59 0.00 0.13 0.00 0.09 0.00 0.00 40.66 41.47 1iwc h LEU 14 CO 0.04 0.00 0.53 -0.83 0.09 0.00 0.00 178.44 178.27 1iwc s GLY 15 N -3.83 2.83 0.00 0.83 0.00 -0.98 -4.99 107.32 101.18 1iwc s GLY 15 Ca -0.04 1.17 0.00 0.00 0.00 0.00 0.00 44.72 45.84 1iwc s GLY 15 CO 0.64 1.61 0.04 -1.55 0.00 0.00 0.00 173.10 173.85 1iwc n PRO 16 N -1.39 0.00 0.00 2.90 -0.04 -1.26 -5.09 135.00 130.12 1iwc n PRO 16 Ca 0.13 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.59 1iwc n PRO 16 Cb 0.48 -0.47 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 1iwc n PRO 16 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1iwc n GLY 17 N 2.28 4.37 2.76 0.55 0.00 -1.26 -5.03 105.19 108.86 1iwc n GLY 17 Ca 0.00 -0.74 -0.42 0.00 0.00 0.00 0.00 46.02 44.87 1iwc n GLY 17 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1iwc n PRO 18 N 0.00 2.71 -2.70 1.61 -0.04 -1.26 -4.38 135.00 130.94 1iwc n PRO 18 Ca 0.00 -2.48 -0.07 0.00 -0.04 0.00 0.00 63.50 60.91 1iwc n PRO 18 Cb 0.00 -3.21 0.09 0.00 -0.04 0.00 0.00 33.50 30.34 1iwc n PRO 18 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1iwc n SER 19 N 6.15 -1.89 0.00 3.54 7.64 -1.26 -4.95 113.62 122.85 1iwc n SER 19 Ca 0.53 -2.66 0.00 0.00 1.01 0.00 0.00 58.87 57.75 1iwc n SER 19 Cb 0.38 1.27 0.00 0.00 -1.01 0.00 0.00 64.21 64.86 1iwc n SER 19 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1iwc n GLY 20 N -0.26 0.57 2.73 0.23 0.00 -1.26 -5.00 105.19 102.19 1iwc n GLY 20 Ca -0.04 -0.01 -0.34 0.00 0.00 0.00 0.00 46.02 45.64 1iwc n GLY 20 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1iwc n ASP 21 N 0.00 6.07 0.00 1.61 8.00 -1.26 -4.75 116.55 126.22 1iwc n ASP 21 Ca 0.00 -3.75 0.00 0.00 0.71 0.00 0.00 54.79 51.75 1iwc n ASP 21 Cb 0.00 -0.80 0.00 0.00 -0.02 0.00 0.00 41.12 40.30 1iwc n ASP 21 CO 0.00 0.00 0.00 0.80 -0.39 0.00 0.00 177.20 177.61 1iwc n MET 22 N -0.40 0.00 0.14 -1.24 0.00 -1.26 -4.06 117.12 110.30 1iwc n MET 22 Ca 0.44 0.00 0.12 0.00 -0.00 0.00 0.00 57.70 58.27 1iwc n MET 22 Cb 0.41 -0.03 0.49 0.00 0.00 0.00 0.00 33.22 34.08 1iwc n MET 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1iwc h ALA 23 N -2.00 1.00 -0.01 -5.12 0.00 -2.01 -3.15 119.26 107.96 1iwc h ALA 23 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.92 1iwc h ALA 23 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1iwc h ALA 23 CO 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 179.25 179.20 1iwc h ALA 24 N 2.29 -0.04 -0.66 0.00 0.00 -1.85 -0.74 119.26 118.25 1iwc h ALA 24 Ca 0.00 0.01 0.16 0.00 0.00 0.00 0.00 54.91 55.08 1iwc h ALA 24 Cb 0.44 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 1iwc h ALA 24 CO 0.00 -0.54 0.46 0.87 0.00 0.00 0.00 179.25 180.04 1iwc h LYS 25 N -0.09 0.16 -0.06 0.00 1.79 -1.69 0.23 116.57 116.91 1iwc h LYS 25 Ca 0.03 -0.01 -0.16 0.00 -2.18 0.00 0.00 60.65 58.33 1iwc h LYS 25 Cb 0.13 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 30.73 1iwc h LYS 25 CO -0.07 0.11 -0.68 0.52 -1.08 0.00 0.00 179.45 178.25 1iwc h MET 26 N 0.17 0.27 0.00 3.15 2.86 -1.32 -2.72 114.93 117.34 1iwc h MET 26 Ca 0.32 -0.21 0.00 0.00 -2.06 0.00 0.00 59.70 57.75 1iwc h MET 26 Cb 1.03 0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.73 1iwc h MET 26 CO -0.05 0.85 0.00 0.45 1.06 0.00 0.00 176.91 179.21 1iwc n SER 27 N -3.83 0.37 -0.08 1.22 2.88 0.72 -0.90 113.62 114.00 1iwc n SER 27 Ca -0.03 0.56 -0.13 0.00 -1.33 0.00 0.00 58.87 57.94 1iwc n SER 27 Cb 0.67 -0.65 -0.09 0.00 -0.75 0.00 0.00 64.21 63.39 1iwc n SER 27 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 1iwc h LYS 28 N 0.00 0.00 0.00 -1.46 1.79 -1.05 -3.42 116.57 112.44 1iwc h LYS 28 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1iwc h LYS 28 Cb 0.49 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.14 1iwc h LYS 28 CO 0.00 0.73 0.00 1.17 -1.08 0.00 0.00 179.45 180.27 1iwc n LYS 29 N -4.59 0.00 -2.30 3.15 3.00 -1.15 -4.86 118.16 111.42 1iwc n LYS 29 Ca -0.15 0.06 -0.03 0.00 -0.00 0.00 0.00 58.31 58.20 1iwc n LYS 29 Cb 0.44 -1.04 0.03 0.00 0.00 0.00 0.00 35.03 34.46 1iwc n LYS 29 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.40 177.76 1iwc n LYS 30 N -0.63 0.42 0.36 1.64 2.85 -1.21 -4.85 118.16 116.73 1iwc n LYS 30 Ca 0.00 -0.68 -0.19 0.00 -1.05 0.00 0.00 58.31 56.39 1iwc n LYS 30 Cb 0.00 0.06 -0.10 0.00 -0.65 0.00 0.00 35.03 34.34 1iwc n LYS 30 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1iwc h ALA 31 N 0.85 -1.21 -0.28 0.58 0.00 -1.28 -3.17 119.26 114.75 1iwc h ALA 31 Ca -0.35 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1iwc h ALA 31 Cb 1.18 0.68 0.00 0.00 0.00 0.00 0.00 17.79 19.65 1iwc h ALA 31 CO -0.13 -1.21 0.00 0.41 0.00 0.00 0.00 179.25 178.33 1iwc n GLY 32 N -1.59 3.70 2.42 0.00 0.00 -1.26 -5.03 105.19 103.43 1iwc n GLY 32 Ca -0.13 -0.87 -0.04 0.00 0.00 0.00 0.00 46.02 44.99 1iwc n GLY 32 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1iwc n ARG 33 N -0.24 -3.55 0.00 1.61 3.00 -1.20 -5.21 116.66 111.07 1iwc n ARG 33 Ca 0.19 2.79 0.01 0.00 -0.00 0.00 0.00 57.85 60.85 1iwc n ARG 33 Cb 0.77 -4.42 0.01 0.00 0.00 0.00 0.00 32.46 28.82 1iwc n ARG 33 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04