#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 -4.78 -0.72 0.13 -2.07 -3.45 132.00 121.12 1ron h PRO 2 Ca 0.00 0.00 -0.29 0.00 -0.87 0.00 0.00 66.00 64.84 1ron h PRO 2 Cb 0.00 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 30.98 1ron h PRO 2 CO 0.00 0.20 -0.66 -1.54 -0.23 0.00 0.00 178.00 175.78 1ron s SER 3 N -6.15 1.12 -0.13 1.44 1.04 -1.26 -5.10 113.70 104.66 1ron s SER 3 Ca 0.00 -1.20 -0.09 0.00 0.48 0.00 0.00 55.95 55.14 1ron s SER 3 Cb 0.10 0.14 -0.06 0.00 0.10 0.00 0.00 66.02 66.31 1ron s SER 3 CO 0.62 -0.60 0.02 0.50 0.98 0.00 0.00 173.24 174.76 1ron h LYS 4 N 2.67 0.00 -7.65 4.02 1.63 -2.06 -3.46 116.57 111.72 1ron h LYS 4 Ca -0.37 0.00 -0.47 0.00 -0.85 0.00 0.00 60.65 58.97 1ron h LYS 4 Cb 1.21 0.00 0.11 0.00 -0.60 0.00 0.00 32.23 32.95 1ron h LYS 4 CO 0.62 0.21 0.41 -1.25 -3.45 0.00 0.00 179.45 175.99 1ron s PRO 5 N -2.00 1.73 -0.07 1.90 0.04 -1.26 -5.11 135.00 130.23 1ron s PRO 5 Ca -0.11 0.01 0.02 0.00 0.04 0.00 0.00 61.00 60.96 1ron s PRO 5 Cb 0.01 -1.93 0.01 0.00 0.04 0.00 0.00 34.50 32.63 1ron s PRO 5 CO 0.22 -1.74 -0.13 0.16 0.04 0.00 0.00 177.00 175.55 1ron s ASP 6 N -4.63 1.86 0.01 6.66 -4.77 -1.26 -5.04 116.67 109.49 1ron s ASP 6 Ca 0.64 -0.32 -0.23 0.00 -3.30 0.00 0.00 52.55 49.35 1ron s ASP 6 Cb -0.10 -0.86 0.05 0.00 -1.09 0.00 0.00 42.92 40.92 1ron s ASP 6 CO 0.50 0.04 0.51 0.54 0.70 0.00 0.00 175.17 177.46 1ron s ASN 7 N 0.65 -0.43 0.00 2.11 4.22 -1.26 -5.05 114.94 115.17 1ron s ASN 7 Ca -0.15 0.29 0.00 0.00 -2.14 0.00 0.00 52.86 50.87 1ron s ASN 7 Cb -0.16 0.46 0.00 0.00 1.28 0.00 0.00 41.25 42.83 1ron s ASN 7 CO 0.04 -0.63 0.63 -0.81 -2.04 0.00 0.00 177.10 174.29 1ron n PRO 8 N 0.74 0.54 0.00 3.55 -0.04 -1.26 -4.78 135.00 133.74 1ron n PRO 8 Ca -0.19 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.27 1ron n PRO 8 Cb 0.58 -1.23 0.00 0.00 -0.04 0.00 0.00 33.50 32.81 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 0.90 0.65 1.02 0.55 0.00 -1.26 -4.75 105.19 102.30 1ron n GLY 9 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1ron n GLY 9 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1ron n GLU 10 N 0.00 0.29 0.00 1.61 2.13 -1.26 -3.88 120.64 119.53 1ron n GLU 10 Ca 0.00 0.00 0.13 0.00 0.66 0.00 0.00 57.16 57.95 1ron n GLU 10 Cb 0.00 -1.35 0.48 0.00 0.27 0.00 0.00 31.44 30.84 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 0.88 0.57 -2.10 4.31 9.92 -1.26 -4.16 116.55 124.70 1ron n ASP 11 Ca 0.00 -0.48 -0.21 0.00 -0.53 0.00 0.00 54.79 53.57 1ron n ASP 11 Cb 0.15 -0.00 0.19 0.00 -0.64 0.00 0.00 41.12 40.81 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 -1.04 5.42 1.47 2.24 0.00 -1.25 -4.71 120.51 122.64 1ron n ALA 12 Ca 0.11 -2.90 0.14 0.00 0.00 0.00 0.00 53.44 50.80 1ron n ALA 12 Cb 0.31 -1.36 0.76 0.00 0.00 0.00 0.00 19.45 19.16 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 -1.10 0.54 0.25 0.00 -0.04 -1.26 -1.21 135.00 132.18 1ron n PRO 13 Ca 0.56 0.01 0.09 0.00 -0.04 0.00 0.00 63.50 64.12 1ron n PRO 13 Cb 1.59 -1.50 0.63 0.00 -0.04 0.00 0.00 33.50 34.18 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 3.47 1.57 0.07 0.55 0.00 -1.94 0.59 119.26 123.57 1ron h ALA 14 Ca 0.00 -0.12 -0.34 0.00 0.00 0.00 0.00 54.91 54.45 1ron h ALA 14 Cb 0.20 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 1ron h ALA 14 CO 0.00 0.17 -1.91 -1.91 0.00 0.00 0.00 179.25 175.59 1ron n GLU 15 N -4.07 0.69 0.01 0.00 4.07 -0.35 -3.25 120.64 117.74 1ron n GLU 15 Ca -0.02 0.33 -0.12 0.00 -0.06 0.00 0.00 57.16 57.29 1ron n GLU 15 Cb 0.21 -1.68 0.01 0.00 -0.06 0.00 0.00 31.44 29.92 1ron n GLU 15 CO 0.00 0.00 0.00 0.22 -0.06 0.00 0.00 177.13 177.29 1ron h ASP 16 N -0.27 0.65 0.49 4.31 3.58 -1.43 0.27 116.42 124.02 1ron h ASP 16 Ca -0.44 -0.40 -0.03 0.00 0.42 0.00 0.00 57.03 56.58 1ron h ASP 16 Cb 1.81 -0.19 -0.00 0.00 1.72 0.00 0.00 39.33 42.67 1ron h ASP 16 CO -0.04 1.15 -0.13 0.00 -2.88 0.00 0.00 179.24 177.35 1ron h MET 17 N 0.40 0.00 0.17 0.28 -0.00 -0.00 0.53 114.93 116.31 1ron h MET 17 Ca -0.02 0.00 -0.01 0.00 -0.00 0.00 0.00 59.70 59.67 1ron h MET 17 Cb 1.26 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.86 1ron h MET 17 CO 0.13 0.13 -0.08 0.00 -0.00 0.00 0.00 176.91 177.08 1ron h ALA 18 N 1.87 -0.23 0.00 -3.00 0.00 -1.42 -0.20 119.26 116.29 1ron h ALA 18 Ca -0.00 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1ron h ALA 18 Cb 0.40 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1ron h ALA 18 CO 0.02 -0.37 0.00 0.54 0.00 0.00 0.00 179.25 179.44 1ron n ARG 19 N -4.97 0.22 -0.09 0.00 1.74 0.92 -1.51 116.66 112.96 1ron n ARG 19 Ca -0.08 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 56.89 1ron n ARG 19 Cb 0.26 -1.03 -0.12 0.00 -1.02 0.00 0.00 32.46 30.56 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 -0.29 0.00 0.35 -1.55 4.02 0.15 0.74 117.16 120.58 1ron n TYR 20 Ca 0.00 0.00 0.05 0.00 -0.01 0.00 0.00 57.90 57.94 1ron n TYR 20 Cb 0.01 -0.83 0.22 0.00 -0.02 0.00 0.00 39.34 38.72 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 -2.78 0.00 -0.07 -0.72 4.01 -0.57 0.10 117.16 117.13 1ron n TYR 21 Ca -0.31 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.30 1ron n TYR 21 Cb 1.00 -0.49 -0.05 0.00 -0.31 0.00 0.00 39.34 39.49 1ron n TYR 21 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 1ron n SER 22 N -1.49 1.33 0.26 7.72 3.41 -1.24 -3.98 113.62 119.63 1ron n SER 22 Ca 0.03 0.22 -0.16 0.00 -0.26 0.00 0.00 58.87 58.70 1ron n SER 22 Cb 0.12 -0.52 -0.08 0.00 -0.26 0.00 0.00 64.21 63.46 1ron n SER 22 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ron h ALA 23 N -0.60 -0.76 -0.40 7.33 0.00 0.12 0.76 119.26 125.70 1ron h ALA 23 Ca -0.28 -0.14 -0.13 0.00 0.00 0.00 0.00 54.91 54.36 1ron h ALA 23 Cb 1.11 0.43 -0.01 0.00 0.00 0.00 0.00 17.79 19.32 1ron h ALA 23 CO -0.17 -0.95 -0.27 -0.07 0.00 0.00 0.00 179.25 177.79 1ron h LEU 24 N -0.75 0.88 0.00 0.00 -0.00 0.44 0.58 115.31 116.46 1ron h LEU 24 Ca -0.04 -0.35 0.01 0.00 -0.00 0.00 0.00 57.88 57.50 1ron h LEU 24 Cb 0.64 -0.24 -0.01 0.00 -0.00 0.00 0.00 40.66 41.05 1ron h LEU 24 CO 0.00 1.09 -0.03 -0.09 -0.00 0.00 0.00 178.44 179.42 1ron h ARG 25 N 0.73 -0.05 -0.62 1.13 2.43 -1.39 0.30 114.38 116.90 1ron h ARG 25 Ca 0.09 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 1ron h ARG 25 Cb 0.81 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.35 1ron h ARG 25 CO 0.07 -0.04 0.40 1.25 -1.51 0.00 0.00 179.97 180.14 1ron h HIS 26 N -0.06 0.79 0.46 2.20 2.76 0.99 -1.24 115.15 121.06 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 -0.27 -0.01 0.00 1.55 0.00 0.00 27.41 28.75 1ron h HIS 26 CO -0.11 0.51 -0.34 1.88 -1.30 0.00 0.00 177.93 178.57 1ron h TYR 27 N 0.85 -0.92 -0.99 5.26 -1.99 0.14 -0.62 116.97 118.70 1ron h TYR 27 Ca 0.23 -0.00 0.28 0.00 2.00 0.00 0.00 58.73 61.24 1ron h TYR 27 Cb -0.08 0.34 -0.04 0.00 2.00 0.00 0.00 36.73 38.95 1ron h TYR 27 CO 0.00 -0.51 0.71 0.82 -0.00 0.00 0.00 178.16 179.18 1ron h ILE 28 N -0.79 0.51 -0.04 -2.88 5.03 0.72 0.92 117.51 120.98 1ron h ILE 28 Ca -0.05 -0.01 -0.18 0.00 -0.12 0.00 0.00 64.86 64.50 1ron h ILE 28 Cb 0.67 0.47 -0.01 0.00 -3.03 0.00 0.00 36.82 34.93 1ron h ILE 28 CO 0.01 0.01 -0.75 0.78 -0.68 0.00 0.00 178.15 177.51 1ron h ASN 29 N 0.03 0.35 0.19 1.72 2.35 -0.59 -1.78 115.58 117.86 1ron h ASN 29 Ca 0.48 -0.24 -0.23 0.00 -0.55 0.00 0.00 56.30 55.75 1ron h ASN 29 Cb 1.85 -0.10 -0.04 0.00 0.05 0.00 0.00 38.32 40.07 1ron h ASN 29 CO -0.03 0.98 -2.03 -0.11 -1.65 0.00 0.00 177.43 174.59 1ron n LEU 30 N -3.78 0.26 0.00 1.61 -0.00 -0.08 -4.23 117.00 110.78 1ron n LEU 30 Ca -0.04 0.12 -0.15 0.00 -0.00 0.00 0.00 56.01 55.94 1ron n LEU 30 Cb 0.72 0.27 -0.04 0.00 -0.00 0.00 0.00 43.42 44.37 1ron n LEU 30 CO 0.47 0.30 0.29 -0.29 -0.00 0.00 0.00 177.39 178.16 1ron h ILE 31 N 0.00 1.31 -0.34 1.96 2.10 0.73 -2.42 117.51 120.84 1ron h ILE 31 Ca -0.32 -2.04 0.10 0.00 1.08 0.00 0.00 64.86 63.68 1ron h ILE 31 Cb 1.80 2.04 -0.01 0.00 -1.09 0.00 0.00 36.82 39.55 1ron h ILE 31 CO 0.03 0.64 0.45 0.00 -1.08 0.00 0.00 178.15 178.19 1ron h THR 32 N 0.45 0.28 0.08 2.19 1.03 -1.49 0.32 112.91 115.77 1ron h THR 32 Ca -0.05 0.00 -0.00 0.00 -0.01 0.00 0.00 66.41 66.35 1ron h THR 32 Cb 1.39 0.62 0.00 0.00 -1.07 0.00 0.00 68.15 69.09 1ron h THR 32 CO 0.15 0.00 -0.04 0.03 -0.01 0.00 0.00 175.52 175.65 1ron h ARG 33 N 0.00 -0.11 -0.93 0.00 3.08 -1.65 -3.30 114.38 111.47 1ron h ARG 33 Ca 0.16 0.01 0.24 0.00 0.07 0.00 0.00 59.98 60.46 1ron h ARG 33 Cb 1.07 0.02 -0.17 0.00 0.08 0.00 0.00 29.97 30.97 1ron h ARG 33 CO -0.00 0.40 -0.05 1.04 -1.07 0.00 0.00 179.97 180.30 1ron n GLN 34 N -4.81 -0.08 -0.25 0.04 1.13 0.10 0.99 117.38 114.50 1ron n GLN 34 Ca -0.07 1.40 0.06 0.00 -1.94 0.00 0.00 57.00 56.45 1ron n GLN 34 Cb 0.28 -2.19 0.19 0.00 0.11 0.00 0.00 30.24 28.62 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 0.22 0.00 -1.09 3.08 -1.38 -3.51 114.38 111.69 1ron h ARG 35 Ca 0.53 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.57 1ron h ARG 35 Cb 1.03 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 31.03 1ron h ARG 35 CO -0.89 0.14 0.00 0.66 -1.07 0.00 0.00 179.97 178.81