#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ron n PRO 2 N 0.00 0.00 -2.68 -0.72 -0.04 -1.26 -4.97 135.00 125.33 1ron n PRO 2 Ca 0.00 0.00 -0.05 0.00 -0.04 0.00 0.00 63.50 63.41 1ron n PRO 2 Cb 0.00 -0.20 0.05 0.00 -0.04 0.00 0.00 33.50 33.31 1ron n PRO 2 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1ron n SER 3 N 0.00 -1.52 -4.81 3.54 2.88 -1.26 -5.15 113.62 107.30 1ron n SER 3 Ca 0.00 -2.10 -0.36 0.00 -1.33 0.00 0.00 58.87 55.08 1ron n SER 3 Cb 0.00 1.06 -0.06 0.00 -0.75 0.00 0.00 64.21 64.46 1ron n SER 3 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 1ron s LYS 4 N 0.11 4.30 0.00 -1.46 1.02 -1.26 -4.95 119.74 117.50 1ron s LYS 4 Ca 0.13 0.92 -0.02 0.00 0.02 0.00 0.00 55.97 57.02 1ron s LYS 4 Cb 0.23 -2.91 -0.09 0.00 -0.52 0.00 0.00 37.83 34.54 1ron s LYS 4 CO -0.06 0.40 2.35 -0.35 -0.92 0.00 0.00 175.35 176.78 1ron n PRO 5 N 0.80 1.23 -0.48 -1.68 -0.04 -1.26 -3.24 135.00 130.33 1ron n PRO 5 Ca -0.02 -0.34 0.00 0.00 -0.04 0.00 0.00 63.50 63.10 1ron n PRO 5 Cb 0.51 -1.39 0.00 0.00 -0.04 0.00 0.00 33.50 32.58 1ron n PRO 5 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1ron n ASP 6 N 1.93 0.00 -2.71 3.54 5.68 -1.26 -4.99 116.55 118.74 1ron n ASP 6 Ca 0.14 -1.06 -0.08 0.00 -0.50 0.00 0.00 54.79 53.30 1ron n ASP 6 Cb 0.59 -0.01 0.11 0.00 -1.14 0.00 0.00 41.12 40.66 1ron n ASP 6 CO 0.00 0.00 0.00 -0.46 -1.33 0.00 0.00 177.20 175.41 1ron n ASN 7 N 0.00 -2.04 -2.33 -1.12 6.94 -1.20 -5.04 115.26 110.47 1ron n ASN 7 Ca 0.00 -2.84 -0.06 0.00 -0.02 0.00 0.00 54.58 51.66 1ron n ASN 7 Cb 0.51 1.30 -0.07 0.00 -2.36 0.00 0.00 39.78 39.16 1ron n ASN 7 CO 0.00 0.00 0.00 -0.81 -1.03 0.00 0.00 177.26 175.42 1ron n PRO 8 N -0.30 0.98 0.00 -0.53 -0.04 -1.26 -4.80 135.00 129.04 1ron n PRO 8 Ca -0.00 -0.52 0.00 0.00 -0.04 0.00 0.00 63.50 62.93 1ron n PRO 8 Cb 0.80 -1.78 0.00 0.00 -0.04 0.00 0.00 33.50 32.49 1ron n PRO 8 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ron n GLY 9 N 2.84 1.60 3.63 0.55 0.00 -1.26 -4.62 105.19 107.93 1ron n GLY 9 Ca 0.21 0.31 -0.02 0.00 0.00 0.00 0.00 46.02 46.51 1ron n GLY 9 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1ron s GLU 10 N 0.00 0.38 0.00 1.61 -1.05 -1.26 -5.04 118.70 113.34 1ron s GLU 10 Ca 0.00 0.66 0.00 0.00 -0.15 0.00 0.00 54.97 55.48 1ron s GLU 10 Cb 0.00 0.10 0.00 0.00 -0.44 0.00 0.00 34.13 33.79 1ron s GLU 10 CO 0.00 -0.08 0.38 -0.25 0.95 0.00 0.00 175.26 176.26 1ron n ASP 11 N 3.77 0.76 -2.25 0.83 9.92 -1.26 -4.80 116.55 123.52 1ron n ASP 11 Ca -0.18 -0.89 -0.31 0.00 -0.53 0.00 0.00 54.79 52.88 1ron n ASP 11 Cb 0.57 0.19 0.10 0.00 -0.64 0.00 0.00 41.12 41.35 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 -0.19 6.02 -0.12 2.24 0.00 -1.26 -4.72 120.51 122.48 1ron n ALA 12 Ca 0.00 -3.35 -0.12 0.00 0.00 0.00 0.00 53.44 49.97 1ron n ALA 12 Cb 0.01 -1.57 -0.00 0.00 0.00 0.00 0.00 19.45 17.88 1ron n ALA 12 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1ron h PRO 13 N 1.73 0.93 -0.15 0.00 0.13 -2.00 0.46 132.00 133.11 1ron h PRO 13 Ca 0.59 -0.46 0.04 0.00 -0.87 0.00 0.00 66.00 65.30 1ron h PRO 13 Cb 1.38 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.51 1ron h PRO 13 CO 1.39 1.12 0.70 0.00 -0.23 0.00 0.00 178.00 180.98 1ron h ALA 14 N 0.83 1.84 0.03 -0.56 0.00 -1.98 1.34 119.26 120.76 1ron h ALA 14 Ca 0.07 -0.01 -0.32 0.00 0.00 0.00 0.00 54.91 54.66 1ron h ALA 14 Cb 0.92 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.68 1ron h ALA 14 CO 0.09 -0.77 -1.90 0.39 0.00 0.00 0.00 179.25 177.05 1ron n GLU 15 N -2.85 0.67 -0.02 0.00 -0.58 0.15 -2.57 120.64 115.43 1ron n GLU 15 Ca 0.02 0.24 -0.17 0.00 -0.42 0.00 0.00 57.16 56.83 1ron n GLU 15 Cb 0.77 -1.72 -0.14 0.00 -0.57 0.00 0.00 31.44 29.78 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 0.01 0.21 -0.67 1.62 3.58 0.16 0.17 116.42 121.50 1ron h ASP 16 Ca -0.37 -0.93 0.07 0.00 0.42 0.00 0.00 57.03 56.22 1ron h ASP 16 Cb 2.05 -0.07 -0.04 0.00 1.72 0.00 0.00 39.33 42.99 1ron h ASP 16 CO 0.07 1.23 0.44 0.24 -2.88 0.00 0.00 179.24 178.34 1ron h MET 17 N -0.71 0.61 0.74 0.28 0.00 -0.57 1.08 114.93 116.36 1ron h MET 17 Ca -0.10 -0.04 -0.03 0.00 0.00 0.00 0.00 59.70 59.53 1ron h MET 17 Cb 1.32 -0.14 -0.01 0.00 0.00 0.00 0.00 31.60 32.78 1ron h MET 17 CO 0.05 0.41 -0.48 0.00 0.00 0.00 0.00 176.91 176.88 1ron h ALA 18 N 1.65 -1.22 0.00 6.32 0.00 -1.42 0.27 119.26 124.86 1ron h ALA 18 Ca 0.29 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1ron h ALA 18 Cb 0.33 0.61 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1ron h ALA 18 CO -0.09 -1.20 0.24 0.00 0.00 0.00 0.00 179.25 178.19 1ron h ARG 19 N -1.16 0.00 0.02 0.00 3.08 0.25 0.18 114.38 116.76 1ron h ARG 19 Ca -0.10 0.00 -0.28 0.00 0.07 0.00 0.00 59.98 59.67 1ron h ARG 19 Cb 0.94 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.95 1ron h ARG 19 CO 0.08 0.00 -1.55 1.88 -1.07 0.00 0.00 179.97 179.31 1ron h TYR 20 N 0.00 0.09 0.00 3.04 -1.99 0.44 1.30 116.97 119.85 1ron h TYR 20 Ca 0.00 -0.07 0.00 0.00 2.00 0.00 0.00 58.73 60.66 1ron h TYR 20 Cb 0.48 -0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.20 1ron h TYR 20 CO 0.00 1.10 0.00 0.66 -0.00 0.00 0.00 178.16 179.92 1ron n TYR 21 N -3.19 0.21 -0.11 4.88 4.01 0.61 0.68 117.16 124.26 1ron n TYR 21 Ca -0.14 0.09 -0.17 0.00 -0.16 0.00 0.00 57.90 57.51 1ron n TYR 21 Cb 1.03 -0.64 -0.10 0.00 -0.31 0.00 0.00 39.34 39.32 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 -1.70 2.18 -0.03 7.72 2.88 -1.14 -4.02 113.62 119.51 1ron n SER 22 Ca 0.03 -0.03 -0.13 0.00 -1.33 0.00 0.00 58.87 57.40 1ron n SER 22 Cb 0.17 -0.41 -0.11 0.00 -0.75 0.00 0.00 64.21 63.11 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 -0.17 -0.02 -0.31 -1.46 0.00 0.24 0.85 119.26 118.40 1ron h ALA 23 Ca -0.50 -0.33 -0.13 0.00 0.00 0.00 0.00 54.91 53.95 1ron h ALA 23 Cb 1.70 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.49 1ron h ALA 23 CO -0.13 -0.17 -0.34 -0.07 0.00 0.00 0.00 179.25 178.53 1ron h LEU 24 N -0.69 0.71 0.01 0.00 -0.00 0.02 1.01 115.31 116.37 1ron h LEU 24 Ca -0.00 -0.29 -0.00 0.00 -0.00 0.00 0.00 57.88 57.58 1ron h LEU 24 Cb 0.66 -0.20 0.00 0.00 -0.00 0.00 0.00 40.66 41.13 1ron h LEU 24 CO 0.00 0.99 -0.01 -0.09 -0.00 0.00 0.00 178.44 179.33 1ron h ARG 25 N 0.57 -0.02 -0.43 1.13 2.43 -1.58 0.25 114.38 116.74 1ron h ARG 25 Ca 0.06 0.00 0.04 0.00 -0.81 0.00 0.00 59.98 59.27 1ron h ARG 25 Cb 0.85 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.38 1ron h ARG 25 CO 0.07 0.13 0.29 1.25 -1.51 0.00 0.00 179.97 180.20 1ron h HIS 26 N -0.16 0.41 0.66 2.20 2.76 0.17 -1.60 115.15 119.59 1ron h HIS 26 Ca -0.00 0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 58.15 1ron h HIS 26 Cb 0.16 -0.13 0.01 0.00 1.55 0.00 0.00 27.41 28.99 1ron h HIS 26 CO -0.03 0.23 -0.32 1.88 -1.30 0.00 0.00 177.93 178.39 1ron h TYR 27 N 0.42 -0.83 -0.68 5.26 0.05 0.22 -1.24 116.97 120.17 1ron h TYR 27 Ca 0.18 -0.02 0.20 0.00 0.05 0.00 0.00 58.73 59.14 1ron h TYR 27 Cb 0.19 0.27 -0.03 0.00 1.01 0.00 0.00 36.73 38.18 1ron h TYR 27 CO -0.00 -0.50 0.52 0.97 -1.05 0.00 0.00 178.16 178.09 1ron h ILE 28 N -0.93 0.59 -0.02 -2.88 6.09 0.40 0.84 117.51 121.60 1ron h ILE 28 Ca -0.09 0.00 -0.18 0.00 -1.37 0.00 0.00 64.86 63.21 1ron h ILE 28 Cb 0.70 0.63 -0.01 0.00 0.47 0.00 0.00 36.82 38.61 1ron h ILE 28 CO 0.15 0.00 -0.80 0.78 -3.07 0.00 0.00 178.15 175.21 1ron h ASN 29 N 0.00 0.28 0.21 2.19 2.35 -0.79 -2.08 115.58 117.74 1ron h ASN 29 Ca 0.32 -0.21 -0.19 0.00 -0.55 0.00 0.00 56.30 55.67 1ron h ASN 29 Cb 1.35 -0.08 -0.04 0.00 0.05 0.00 0.00 38.32 39.60 1ron h ASN 29 CO -0.00 0.97 -1.97 -0.11 -1.65 0.00 0.00 177.43 174.66 1ron n LEU 30 N -3.73 0.26 -0.02 1.61 -0.00 -0.20 -4.21 117.00 110.71 1ron n LEU 30 Ca -0.03 0.11 -0.14 0.00 -0.00 0.00 0.00 56.01 55.95 1ron n LEU 30 Cb 0.75 0.22 -0.03 0.00 -0.00 0.00 0.00 43.42 44.36 1ron n LEU 30 CO 0.47 0.24 0.36 -0.29 -0.00 0.00 0.00 177.39 178.16 1ron h ILE 31 N 0.00 1.30 -1.11 1.96 2.10 0.56 -2.68 117.51 119.65 1ron h ILE 31 Ca -0.26 -1.91 0.32 0.00 1.08 0.00 0.00 64.86 64.09 1ron h ILE 31 Cb 1.66 1.88 -0.04 0.00 -1.09 0.00 0.00 36.82 39.23 1ron h ILE 31 CO 0.03 0.60 0.85 0.00 -1.08 0.00 0.00 178.15 178.54 1ron h THR 32 N 0.52 0.37 0.03 2.19 1.03 -1.54 0.62 112.91 116.11 1ron h THR 32 Ca -0.02 0.00 -0.00 0.00 -0.01 0.00 0.00 66.41 66.38 1ron h THR 32 Cb 1.28 0.40 0.00 0.00 -1.07 0.00 0.00 68.15 68.76 1ron h THR 32 CO 0.14 0.00 -0.01 0.03 -0.01 0.00 0.00 175.52 175.66 1ron h ARG 33 N 0.00 -0.03 -0.97 0.00 3.08 -1.70 -3.28 114.38 111.47 1ron h ARG 33 Ca 0.53 0.00 0.22 0.00 0.07 0.00 0.00 59.98 60.80 1ron h ARG 33 Cb 2.21 0.01 -0.18 0.00 0.08 0.00 0.00 29.97 32.09 1ron h ARG 33 CO -0.01 0.61 -0.14 1.96 -1.07 0.00 0.00 179.97 181.33 1ron h GLN 34 N -0.73 0.01 -1.01 0.04 1.08 0.36 0.75 115.11 115.61 1ron h GLN 34 Ca -0.00 -0.00 0.23 0.00 -1.45 0.00 0.00 58.65 57.42 1ron h GLN 34 Cb 0.66 -0.00 -0.12 0.00 -0.05 0.00 0.00 27.48 27.97 1ron h GLN 34 CO 0.01 0.00 0.60 0.00 -0.95 0.00 0.00 178.83 178.49 1ron h ARG 35 N 0.01 0.62 -0.01 1.46 3.08 -1.40 -3.52 114.38 114.63 1ron h ARG 35 Ca 0.51 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.53 1ron h ARG 35 Cb 0.90 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.81 1ron h ARG 35 CO -0.96 0.41 0.00 0.66 -1.07 0.00 0.00 179.97 179.01