#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ron h PRO 2 N 0.00 0.00 -7.44 -0.72 0.13 -2.07 -3.46 132.00 118.44 1ron h PRO 2 Ca 0.00 0.00 -0.45 0.00 -0.87 0.00 0.00 66.00 64.68 1ron h PRO 2 Cb 0.00 0.00 0.15 0.00 0.13 0.00 0.00 31.00 31.28 1ron h PRO 2 CO 0.00 0.00 0.23 -1.54 -0.23 0.00 0.00 178.00 176.46 1ron s SER 3 N -4.72 2.64 -0.10 1.44 1.04 -1.26 -4.89 113.70 107.85 1ron s SER 3 Ca 0.04 0.94 -0.41 0.00 0.48 0.00 0.00 55.95 57.00 1ron s SER 3 Cb 0.09 -1.46 -0.19 0.00 0.10 0.00 0.00 66.02 64.56 1ron s SER 3 CO 0.45 -3.09 1.24 0.29 0.98 0.00 0.00 173.24 173.12 1ron n LYS 4 N -4.12 0.21 -0.49 4.02 5.02 -1.26 -4.93 118.16 116.61 1ron n LYS 4 Ca 0.08 0.08 -0.11 0.00 -2.02 0.00 0.00 58.31 56.33 1ron n LYS 4 Cb 0.59 -1.61 0.09 0.00 -0.02 0.00 0.00 35.03 34.08 1ron n LYS 4 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1ron n PRO 5 N 2.31 -1.33 -3.17 1.97 -0.04 -1.26 -4.45 135.00 129.03 1ron n PRO 5 Ca 0.22 -0.68 -0.21 0.00 -0.04 0.00 0.00 63.50 62.79 1ron n PRO 5 Cb 0.07 -0.57 0.05 0.00 -0.04 0.00 0.00 33.50 33.01 1ron n PRO 5 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1ron n ASP 6 N -3.55 -5.90 -4.89 3.54 2.03 -1.26 -5.00 116.55 101.51 1ron n ASP 6 Ca 0.06 -0.35 -0.32 0.00 0.52 0.00 0.00 54.79 54.70 1ron n ASP 6 Cb 0.21 -4.65 -0.05 0.00 -0.72 0.00 0.00 41.12 35.92 1ron n ASP 6 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1ron s ASN 7 N -2.94 6.53 0.00 1.67 2.20 -1.26 -4.96 114.94 116.18 1ron s ASN 7 Ca 0.38 0.68 0.00 0.00 -0.94 0.00 0.00 52.86 52.97 1ron s ASN 7 Cb -0.17 -2.13 0.00 0.00 -2.00 0.00 0.00 41.25 36.96 1ron s ASN 7 CO 0.47 0.03 0.44 -0.81 -2.94 0.00 0.00 177.10 174.28 1ron n PRO 8 N 0.07 0.57 0.06 3.55 -0.04 -1.26 -3.74 135.00 134.20 1ron n PRO 8 Ca -0.02 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.33 1ron n PRO 8 Cb 0.52 -1.25 -0.13 0.00 -0.04 0.00 0.00 33.50 32.60 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 3.20 0.13 0.00 0.55 0.00 -2.02 -3.50 103.07 101.43 1ron h GLY 9 Ca 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 47.33 46.99 1ron h GLY 9 CO 0.00 0.30 0.00 -2.21 0.00 0.00 0.00 176.54 174.63 1ron n GLU 10 N -3.37 0.00 0.00 4.80 2.13 -1.25 -4.98 120.64 117.98 1ron n GLU 10 Ca -0.08 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.74 1ron n GLU 10 Cb 1.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.71 1ron n GLU 10 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1ron n ASP 11 N -1.28 0.61 -1.95 4.31 9.92 -1.26 -4.85 116.55 122.05 1ron n ASP 11 Ca 0.00 -1.18 -0.10 0.00 -0.53 0.00 0.00 54.79 52.99 1ron n ASP 11 Cb 0.00 0.00 0.27 0.00 -0.64 0.00 0.00 41.12 40.75 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 -0.09 4.76 0.87 2.24 0.00 -1.26 -4.67 120.51 122.37 1ron n ALA 12 Ca 0.00 -2.55 0.13 0.00 0.00 0.00 0.00 53.44 51.02 1ron n ALA 12 Cb 0.24 -1.24 0.55 0.00 0.00 0.00 0.00 19.45 19.00 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 -0.50 0.04 0.21 0.00 -0.04 -1.26 -1.55 135.00 131.90 1ron n PRO 13 Ca 0.44 0.07 0.17 0.00 -0.04 0.00 0.00 63.50 64.14 1ron n PRO 13 Cb 1.42 -1.56 0.82 0.00 -0.04 0.00 0.00 33.50 34.15 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 2.85 1.82 0.04 0.55 0.00 -1.97 1.12 119.26 123.67 1ron h ALA 14 Ca 0.00 -0.01 -0.31 0.00 0.00 0.00 0.00 54.91 54.59 1ron h ALA 14 Cb 0.50 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 1ron h ALA 14 CO 0.00 -0.27 -1.73 -1.91 0.00 0.00 0.00 179.25 175.33 1ron n GLU 15 N -3.86 0.63 -0.05 0.00 0.00 -0.60 -3.09 120.64 113.68 1ron n GLU 15 Ca 0.01 0.42 -0.13 0.00 0.00 0.00 0.00 57.16 57.46 1ron n GLU 15 Cb 0.31 -1.69 -0.07 0.00 0.00 0.00 0.00 31.44 29.99 1ron n GLU 15 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.13 177.35 1ron h ASP 16 N -0.62 0.38 -0.04 4.31 3.58 -1.34 0.28 116.42 122.96 1ron h ASP 16 Ca -0.44 -0.49 0.01 0.00 0.42 0.00 0.00 57.03 56.53 1ron h ASP 16 Cb 1.60 -0.11 -0.00 0.00 1.72 0.00 0.00 39.33 42.54 1ron h ASP 16 CO -0.15 0.79 0.05 0.00 -2.88 0.00 0.00 179.24 177.06 1ron h MET 17 N -0.03 0.00 0.31 0.28 -0.00 0.11 1.19 114.93 116.78 1ron h MET 17 Ca 0.02 0.00 -0.02 0.00 -0.00 0.00 0.00 59.70 59.70 1ron h MET 17 Cb 0.69 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.30 1ron h MET 17 CO 0.04 0.00 -0.15 0.00 -0.00 0.00 0.00 176.91 176.80 1ron h ALA 18 N 1.94 -0.42 0.00 -3.00 0.00 -1.35 -0.92 119.26 115.51 1ron h ALA 18 Ca 0.02 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1ron h ALA 18 Cb 0.12 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1ron h ALA 18 CO -0.00 -0.48 0.01 0.54 0.00 0.00 0.00 179.25 179.32 1ron n ARG 19 N -5.08 0.00 -0.04 0.00 1.74 0.17 -0.92 116.66 112.53 1ron n ARG 19 Ca -0.08 0.06 -0.10 0.00 -0.77 0.00 0.00 57.85 56.96 1ron n ARG 19 Cb 0.26 -1.51 -0.14 0.00 -1.02 0.00 0.00 32.46 30.05 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 -1.02 0.77 0.26 -1.55 4.02 0.36 0.72 117.16 120.72 1ron n TYR 20 Ca 0.00 0.27 0.10 0.00 -0.01 0.00 0.00 57.90 58.26 1ron n TYR 20 Cb 0.01 -1.14 0.46 0.00 -0.02 0.00 0.00 39.34 38.65 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 -3.00 0.62 -0.12 -0.72 4.01 -0.10 0.95 117.16 118.80 1ron n TYR 21 Ca -0.22 0.28 -0.25 0.00 -0.16 0.00 0.00 57.90 57.56 1ron n TYR 21 Cb 1.08 -0.96 -0.08 0.00 -0.31 0.00 0.00 39.34 39.07 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 -2.10 1.64 0.25 7.72 2.88 -1.22 -3.88 113.62 118.90 1ron n SER 22 Ca 0.00 0.27 -0.17 0.00 -1.33 0.00 0.00 58.87 57.65 1ron n SER 22 Cb 0.12 -0.67 -0.09 0.00 -0.75 0.00 0.00 64.21 62.82 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 -0.81 -0.94 -0.52 -1.46 0.00 0.15 0.96 119.26 116.64 1ron h ALA 23 Ca -0.59 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.09 1ron h ALA 23 Cb 1.52 0.64 -0.02 0.00 0.00 0.00 0.00 17.79 19.93 1ron h ALA 23 CO -0.35 -1.07 0.00 -0.07 0.00 0.00 0.00 179.25 177.76 1ron h LEU 24 N -0.86 0.90 -0.25 0.00 -0.00 0.33 0.70 115.31 116.14 1ron h LEU 24 Ca -0.04 -0.30 0.02 0.00 -0.00 0.00 0.00 57.88 57.56 1ron h LEU 24 Cb 0.77 -0.24 -0.02 0.00 -0.00 0.00 0.00 40.66 41.17 1ron h LEU 24 CO -0.08 0.99 0.12 -0.09 -0.00 0.00 0.00 178.44 179.37 1ron h ARG 25 N 0.79 0.24 -0.41 1.13 2.43 -1.47 0.24 114.38 117.34 1ron h ARG 25 Ca 0.15 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.29 1ron h ARG 25 Cb 0.52 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.00 1ron h ARG 25 CO 0.03 0.16 0.20 1.25 -1.51 0.00 0.00 179.97 180.09 1ron h HIS 26 N 0.25 0.55 0.62 2.20 2.76 0.15 -1.37 115.15 120.32 1ron h HIS 26 Ca 0.10 -0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 58.24 1ron h HIS 26 Cb 0.03 -0.18 -0.00 0.00 1.55 0.00 0.00 27.41 28.81 1ron h HIS 26 CO -0.10 0.41 -0.36 1.88 -1.30 0.00 0.00 177.93 178.46 1ron h TYR 27 N 0.57 -0.95 -1.10 5.26 0.05 0.22 -0.92 116.97 120.10 1ron h TYR 27 Ca 0.14 -0.01 0.31 0.00 0.05 0.00 0.00 58.73 59.22 1ron h TYR 27 Cb 0.06 0.33 -0.11 0.00 1.01 0.00 0.00 36.73 38.03 1ron h TYR 27 CO 0.00 -0.55 0.70 0.82 -1.05 0.00 0.00 178.16 178.08 1ron h ILE 28 N -0.92 0.41 -0.20 -2.88 5.03 0.48 0.93 117.51 120.37 1ron h ILE 28 Ca -0.08 -0.11 -0.14 0.00 -0.12 0.00 0.00 64.86 64.41 1ron h ILE 28 Cb 0.74 0.06 -0.01 0.00 -3.03 0.00 0.00 36.82 34.57 1ron h ILE 28 CO 0.09 0.06 -0.46 0.78 -0.68 0.00 0.00 178.15 177.94 1ron h ASN 29 N 0.32 0.54 0.46 1.72 2.35 -0.66 0.27 115.58 120.58 1ron h ASN 29 Ca 0.66 -0.26 -0.10 0.00 -0.55 0.00 0.00 56.30 56.05 1ron h ASN 29 Cb 1.76 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 39.96 1ron h ASN 29 CO -0.36 0.92 -1.64 -0.11 -1.65 0.00 0.00 177.43 174.60 1ron n LEU 30 N -4.00 0.47 0.11 1.61 -0.00 0.63 -4.23 117.00 111.59 1ron n LEU 30 Ca -0.02 0.20 -0.22 0.00 -0.00 0.00 0.00 56.01 55.96 1ron n LEU 30 Cb 0.54 0.08 -0.15 0.00 -0.00 0.00 0.00 43.42 43.89 1ron n LEU 30 CO 0.45 0.07 -0.33 -0.29 -0.00 0.00 0.00 177.39 177.29 1ron h ILE 31 N 0.00 1.17 -1.00 1.96 2.10 0.71 -3.16 117.51 119.29 1ron h ILE 31 Ca -0.13 -2.69 0.25 0.00 1.08 0.00 0.00 64.86 63.38 1ron h ILE 31 Cb 1.36 2.91 -0.07 0.00 -1.09 0.00 0.00 36.82 39.93 1ron h ILE 31 CO 0.02 0.84 0.67 0.00 -1.08 0.00 0.00 178.15 178.59 1ron h THR 32 N 0.12 0.56 0.42 2.19 1.03 -1.11 0.36 112.91 116.48 1ron h THR 32 Ca -0.27 -0.11 -0.02 0.00 -0.01 0.00 0.00 66.41 66.00 1ron h THR 32 Cb 2.12 0.22 0.00 0.00 -1.07 0.00 0.00 68.15 69.42 1ron h THR 32 CO 0.23 0.06 -0.20 0.03 -0.01 0.00 0.00 175.52 175.62 1ron h ARG 33 N 0.31 -0.54 -0.99 0.00 3.08 -1.75 -3.06 114.38 111.42 1ron h ARG 33 Ca 0.54 0.04 0.28 0.00 0.07 0.00 0.00 59.98 60.90 1ron h ARG 33 Cb 1.51 0.12 -0.19 0.00 0.08 0.00 0.00 29.97 31.50 1ron h ARG 33 CO -0.20 -0.27 0.05 1.04 -1.07 0.00 0.00 179.97 179.53 1ron n GLN 34 N -5.26 -0.08 -0.29 0.04 1.13 0.12 0.58 117.38 113.62 1ron n GLN 34 Ca -0.11 1.48 0.11 0.00 -1.94 0.00 0.00 57.00 56.55 1ron n GLN 34 Cb 0.28 -2.37 0.28 0.00 0.11 0.00 0.00 30.24 28.53 1ron n GLN 34 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1ron h ARG 35 N 0.00 0.38 -0.00 -1.09 3.08 -1.20 -3.51 114.38 112.03 1ron h ARG 35 Ca 0.62 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.64 1ron h ARG 35 Cb 1.30 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 31.27 1ron h ARG 35 CO -0.93 0.25 0.00 0.66 -1.07 0.00 0.00 179.97 178.88