#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ron s PRO 2 N 0.00 0.95 -1.10 -0.72 0.04 -1.26 -3.93 135.00 128.97 1ron s PRO 2 Ca 0.00 0.66 -0.01 0.00 0.04 0.00 0.00 61.00 61.69 1ron s PRO 2 Cb 0.00 -1.79 -0.01 0.00 0.04 0.00 0.00 34.50 32.75 1ron s PRO 2 CO 0.00 -2.41 0.93 0.43 0.04 0.00 0.00 177.00 175.98 1ron n SER 3 N -3.98 -2.56 -3.05 6.66 7.64 -1.26 -4.33 113.62 112.74 1ron n SER 3 Ca 0.06 -0.59 -0.10 0.00 1.01 0.00 0.00 58.87 59.25 1ron n SER 3 Cb 0.56 -4.84 0.01 0.00 -1.01 0.00 0.00 64.21 58.93 1ron n SER 3 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1ron n LYS 4 N -3.83 -2.01 -0.86 1.43 4.76 -1.26 -4.78 118.16 111.61 1ron n LYS 4 Ca -0.25 1.79 -0.14 0.00 -2.87 0.00 0.00 58.31 56.84 1ron n LYS 4 Cb 0.65 -3.46 -0.12 0.00 -1.84 0.00 0.00 35.03 30.26 1ron n LYS 4 CO 0.00 0.00 0.00 -0.35 -1.37 0.00 0.00 177.40 175.68 1ron n PRO 5 N 0.49 1.89 0.00 1.97 -0.04 -1.25 -4.92 135.00 133.14 1ron n PRO 5 Ca 0.01 -1.02 0.00 0.00 -0.04 0.00 0.00 63.50 62.45 1ron n PRO 5 Cb 0.38 -2.05 0.00 0.00 -0.04 0.00 0.00 33.50 31.79 1ron n PRO 5 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1ron n ASP 6 N 2.84 -4.46 0.08 3.54 8.00 -1.26 -3.81 116.55 121.48 1ron n ASP 6 Ca 0.40 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.77 1ron n ASP 6 Cb 0.64 0.00 -0.07 0.00 -0.02 0.00 0.00 41.12 41.67 1ron n ASP 6 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1ron h ASN 7 N 0.00 0.43 0.00 -2.24 -1.07 -2.03 -3.33 115.58 107.33 1ron h ASN 7 Ca 0.00 -0.38 -0.25 0.00 0.07 0.00 0.00 56.30 55.73 1ron h ASN 7 Cb 0.00 -0.13 -0.05 0.00 -2.07 0.00 0.00 38.32 36.06 1ron h ASN 7 CO 0.00 1.22 0.24 -0.81 0.07 0.00 0.00 177.43 178.15 1ron n PRO 8 N -3.65 2.18 0.24 4.14 -0.04 -1.26 -4.66 135.00 131.95 1ron n PRO 8 Ca -0.07 -1.14 0.16 0.00 -0.04 0.00 0.00 63.50 62.42 1ron n PRO 8 Cb 0.90 -2.10 0.73 0.00 -0.04 0.00 0.00 33.50 32.98 1ron n PRO 8 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1ron h GLY 9 N 5.33 0.00 -4.78 0.55 0.00 -1.68 -3.41 103.07 99.08 1ron h GLY 9 Ca 0.28 0.00 0.03 0.00 0.00 0.00 0.00 47.33 47.65 1ron h GLY 9 CO 0.46 0.00 0.40 -1.83 0.00 0.00 0.00 176.54 175.57 1ron s GLU 10 N -4.26 0.67 0.00 4.80 1.03 -1.26 -4.59 118.70 115.09 1ron s GLU 10 Ca -0.03 0.43 0.23 0.00 0.03 0.00 0.00 54.97 55.63 1ron s GLU 10 Cb 0.10 0.32 0.18 0.00 -0.80 0.00 0.00 34.13 33.94 1ron s GLU 10 CO 0.35 -0.15 1.23 -0.25 -1.33 0.00 0.00 175.26 175.10 1ron n ASP 11 N 1.53 2.91 -1.82 0.83 9.92 -1.26 -4.56 116.55 124.10 1ron n ASP 11 Ca -0.13 -1.96 0.07 0.00 -0.53 0.00 0.00 54.79 52.25 1ron n ASP 11 Cb 0.57 -0.00 0.40 0.00 -0.64 0.00 0.00 41.12 41.44 1ron n ASP 11 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1ron n ALA 12 N 1.29 3.80 1.10 2.24 0.00 -1.26 -4.64 120.51 123.04 1ron n ALA 12 Ca 0.13 -1.94 0.14 0.00 0.00 0.00 0.00 53.44 51.77 1ron n ALA 12 Cb 0.57 -1.09 0.62 0.00 0.00 0.00 0.00 19.45 19.55 1ron n ALA 12 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1ron n PRO 13 N 0.57 0.12 0.27 0.00 -0.04 -1.26 -1.76 135.00 132.91 1ron n PRO 13 Ca 0.27 -0.01 0.14 0.00 -0.04 0.00 0.00 63.50 63.86 1ron n PRO 13 Cb 1.17 -1.50 0.78 0.00 -0.04 0.00 0.00 33.50 33.91 1ron n PRO 13 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ron h ALA 14 N 3.11 1.28 0.05 0.55 0.00 -1.96 0.49 119.26 122.79 1ron h ALA 14 Ca 0.00 -0.08 -0.34 0.00 0.00 0.00 0.00 54.91 54.49 1ron h ALA 14 Cb 0.45 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.19 1ron h ALA 14 CO 0.00 0.11 -1.96 0.39 0.00 0.00 0.00 179.25 177.79 1ron n GLU 15 N -3.60 0.69 -0.02 0.00 -0.58 -0.72 -2.77 120.64 113.65 1ron n GLU 15 Ca -0.02 0.24 -0.16 0.00 -0.42 0.00 0.00 57.16 56.81 1ron n GLU 15 Cb 0.21 -1.71 -0.11 0.00 -0.57 0.00 0.00 31.44 29.26 1ron n GLU 15 CO 0.00 0.00 0.00 0.22 -0.48 0.00 0.00 177.13 176.87 1ron h ASP 16 N 0.03 0.31 0.30 1.62 3.58 -1.40 0.32 116.42 121.17 1ron h ASP 16 Ca -0.39 -0.76 -0.02 0.00 0.42 0.00 0.00 57.03 56.28 1ron h ASP 16 Cb 2.03 -0.09 -0.00 0.00 1.72 0.00 0.00 39.33 42.99 1ron h ASP 16 CO 0.06 1.02 -0.09 0.00 -2.88 0.00 0.00 179.24 177.36 1ron h MET 17 N -0.37 0.00 0.28 0.28 -0.00 -0.24 0.45 114.93 115.32 1ron h MET 17 Ca -0.04 0.00 -0.01 0.00 -0.00 0.00 0.00 59.70 59.65 1ron h MET 17 Cb 1.07 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.67 1ron h MET 17 CO 0.07 0.09 -0.13 0.00 -0.00 0.00 0.00 176.91 176.93 1ron h ALA 18 N 1.91 -0.37 0.00 -3.00 0.00 -1.31 0.24 119.26 116.73 1ron h ALA 18 Ca -0.00 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1ron h ALA 18 Cb 0.26 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1ron h ALA 18 CO 0.01 -0.53 0.00 0.54 0.00 0.00 0.00 179.25 179.27 1ron n ARG 19 N -5.11 0.00 -0.08 0.00 1.74 0.11 -0.98 116.66 112.36 1ron n ARG 19 Ca -0.09 0.00 -0.12 0.00 -0.77 0.00 0.00 57.85 56.86 1ron n ARG 19 Cb 0.26 -1.37 -0.15 0.00 -1.02 0.00 0.00 32.46 30.18 1ron n ARG 19 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1ron n TYR 20 N -0.85 0.36 0.41 -1.55 4.02 0.11 0.12 117.16 119.78 1ron n TYR 20 Ca 0.00 0.11 0.05 0.00 -0.01 0.00 0.00 57.90 58.06 1ron n TYR 20 Cb 0.00 -1.06 0.25 0.00 -0.02 0.00 0.00 39.34 38.51 1ron n TYR 20 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 1ron n TYR 21 N -2.99 0.00 -0.09 -0.72 4.01 -0.15 0.68 117.16 117.91 1ron n TYR 21 Ca -0.31 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.24 1ron n TYR 21 Cb 1.09 -0.47 -0.07 0.00 -0.31 0.00 0.00 39.34 39.58 1ron n TYR 21 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1ron n SER 22 N -1.47 1.50 0.20 7.72 2.88 -1.23 -4.10 113.62 119.12 1ron n SER 22 Ca 0.03 0.17 -0.15 0.00 -1.33 0.00 0.00 58.87 57.59 1ron n SER 22 Cb 0.13 -0.49 -0.08 0.00 -0.75 0.00 0.00 64.21 63.02 1ron n SER 22 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ron h ALA 23 N -0.54 -0.45 -0.43 -1.46 0.00 0.19 0.91 119.26 117.48 1ron h ALA 23 Ca -0.45 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.24 1ron h ALA 23 Cb 1.43 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.38 1ron h ALA 23 CO -0.24 -0.72 -0.12 -0.07 0.00 0.00 0.00 179.25 178.10 1ron h LEU 24 N -0.52 0.85 0.02 0.00 -0.00 0.02 0.72 115.31 116.40 1ron h LEU 24 Ca -0.05 -0.37 0.00 0.00 -0.00 0.00 0.00 57.88 57.47 1ron h LEU 24 Cb 0.39 -0.23 -0.01 0.00 -0.00 0.00 0.00 40.66 40.81 1ron h LEU 24 CO 0.07 1.03 -0.03 -0.09 -0.00 0.00 0.00 178.44 179.42 1ron h ARG 25 N 0.67 -0.06 -0.54 1.13 2.43 -1.50 0.30 114.38 116.81 1ron h ARG 25 Ca 0.11 0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.31 1ron h ARG 25 Cb 0.66 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.20 1ron h ARG 25 CO 0.05 -0.04 0.36 1.25 -1.51 0.00 0.00 179.97 180.07 1ron h HIS 26 N -0.06 0.59 0.27 2.20 2.76 0.13 -0.48 115.15 120.56 1ron h HIS 26 Ca 0.01 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.18 1ron h HIS 26 Cb 0.07 -0.20 -0.00 0.00 1.55 0.00 0.00 27.41 28.83 1ron h HIS 26 CO -0.10 0.35 -0.15 1.88 -1.30 0.00 0.00 177.93 178.61 1ron h TYR 27 N 0.62 -0.39 -0.58 5.26 0.05 0.22 0.11 116.97 122.26 1ron h TYR 27 Ca 0.22 -0.01 0.17 0.00 0.05 0.00 0.00 58.73 59.16 1ron h TYR 27 Cb 0.10 0.14 -0.02 0.00 1.01 0.00 0.00 36.73 37.95 1ron h TYR 27 CO -0.00 -0.24 0.46 0.97 -1.05 0.00 0.00 178.16 178.30 1ron h ILE 28 N -0.39 0.57 0.05 -2.88 2.10 0.12 0.92 117.51 117.98 1ron h ILE 28 Ca -0.03 0.00 -0.23 0.00 1.08 0.00 0.00 64.86 65.68 1ron h ILE 28 Cb 0.32 0.66 -0.02 0.00 -1.09 0.00 0.00 36.82 36.70 1ron h ILE 28 CO 0.04 0.00 -1.08 0.78 -1.08 0.00 0.00 178.15 176.81 1ron h ASN 29 N 0.00 0.16 0.57 2.19 2.35 -0.51 -2.38 115.58 117.97 1ron h ASN 29 Ca 0.27 -0.17 0.00 0.00 -0.55 0.00 0.00 56.30 55.85 1ron h ASN 29 Cb 1.20 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 39.51 1ron h ASN 29 CO -0.00 1.12 -1.32 -0.11 -1.65 0.00 0.00 177.43 175.46 1ron n LEU 30 N -3.44 0.54 0.07 1.61 -0.00 0.23 -4.15 117.00 111.85 1ron n LEU 30 Ca -0.03 0.16 -0.17 0.00 -0.00 0.00 0.00 56.01 55.97 1ron n LEU 30 Cb 0.96 -0.05 -0.14 0.00 -0.00 0.00 0.00 43.42 44.19 1ron n LEU 30 CO 0.49 -0.09 -0.32 -0.29 -0.00 0.00 0.00 177.39 177.19 1ron h ILE 31 N 0.00 1.17 -1.05 1.96 2.10 0.68 -3.27 117.51 119.10 1ron h ILE 31 Ca 0.00 -2.80 0.27 0.00 1.08 0.00 0.00 64.86 63.41 1ron h ILE 31 Cb 0.95 2.78 -0.10 0.00 -1.09 0.00 0.00 36.82 39.36 1ron h ILE 31 CO 0.00 0.82 0.67 0.00 -1.08 0.00 0.00 178.15 178.56 1ron h THR 32 N 0.07 0.51 -0.36 2.19 1.03 -1.58 0.90 112.91 115.66 1ron h THR 32 Ca -0.24 -0.14 -0.01 0.00 -0.01 0.00 0.00 66.41 66.01 1ron h THR 32 Cb 2.02 0.08 -0.02 0.00 -1.07 0.00 0.00 68.15 69.16 1ron h THR 32 CO 0.17 0.07 0.19 0.03 -0.01 0.00 0.00 175.52 175.97 1ron h ARG 33 N 0.40 0.51 0.28 0.00 2.47 -1.77 -2.94 114.38 113.33 1ron h ARG 33 Ca 0.61 -0.06 -0.01 0.00 -1.26 0.00 0.00 59.98 59.25 1ron h ARG 33 Cb 1.52 -0.10 0.00 0.00 -1.65 0.00 0.00 29.97 29.74 1ron h ARG 33 CO -0.32 0.43 -0.13 1.96 0.56 0.00 0.00 179.97 182.46 1ron h GLN 34 N 0.46 -0.36 -0.82 0.04 1.08 0.59 -3.27 115.11 112.82 1ron h GLN 34 Ca 0.13 0.02 0.22 0.00 -1.45 0.00 0.00 58.65 57.57 1ron h GLN 34 Cb 0.07 0.08 -0.04 0.00 -0.05 0.00 0.00 27.48 27.54 1ron h GLN 34 CO -0.02 -0.24 0.57 0.07 -0.95 0.00 0.00 178.83 178.26 1ron h ARG 35 N -0.41 0.14 -0.03 1.46 0.11 -0.74 -3.51 114.38 111.39 1ron h ARG 35 Ca -0.04 -0.01 0.00 0.00 0.10 0.00 0.00 59.98 60.03 1ron h ARG 35 Cb 0.29 -0.03 0.00 0.00 1.11 0.00 0.00 29.97 31.34 1ron h ARG 35 CO 0.06 0.09 0.00 0.66 0.10 0.00 0.00 179.97 180.88