#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1brz n LYS 3 N 0.00 0.00 -0.17 -0.67 4.81 -1.26 -4.82 118.16 116.05 1brz n LYS 3 Ca 0.00 0.00 0.11 0.00 -0.87 0.00 0.00 58.31 57.55 1brz n LYS 3 Cb 0.00 -1.14 0.28 0.00 0.02 0.00 0.00 35.03 34.19 1brz n LYS 3 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1brz s LYS 5 N -1.56 0.61 -0.15 0.00 0.00 -1.26 -0.23 119.74 117.15 1brz s LYS 5 Ca 0.36 -0.58 -0.08 0.00 0.00 0.00 0.00 55.97 55.67 1brz s LYS 5 Cb 0.20 0.25 0.06 0.00 0.00 0.00 0.00 37.83 38.34 1brz s LYS 5 CO 0.28 -0.16 0.35 -1.59 0.00 0.00 0.00 175.35 174.23 1brz s LYS 6 N -2.22 0.32 0.51 1.78 -2.85 -0.34 -4.97 119.74 111.97 1brz s LYS 6 Ca -0.08 0.72 -0.22 0.00 -1.00 0.00 0.00 55.97 55.39 1brz s LYS 6 Cb -0.03 -0.04 -0.06 0.00 -2.06 0.00 0.00 37.83 35.65 1brz s LYS 6 CO -0.02 -0.17 1.28 0.14 0.10 0.00 0.00 175.35 176.68 1brz s VAL 7 N 1.48 2.49 -1.23 1.79 -7.23 -1.26 -1.24 120.40 115.20 1brz s VAL 7 Ca -0.08 0.37 -0.12 0.00 -1.81 0.00 0.00 61.98 60.33 1brz s VAL 7 Cb -0.09 -3.19 0.17 0.00 0.56 0.00 0.00 36.38 33.83 1brz s VAL 7 CO -0.11 -0.00 1.57 0.00 -0.31 0.00 0.00 175.10 176.24 1brz n TYR 8 N -0.79 4.34 -1.65 2.82 4.19 -0.56 -4.88 117.16 120.63 1brz n TYR 8 Ca 0.09 -3.19 -0.16 0.00 3.31 0.00 0.00 57.90 57.95 1brz n TYR 8 Cb 0.46 -2.11 -0.10 0.00 0.49 0.00 0.00 39.34 38.09 1brz n TYR 8 CO 0.00 0.00 0.00 -1.83 0.91 0.00 0.00 176.86 175.94 1brz s GLU 9 N 1.15 1.40 0.00 2.98 -1.05 -1.26 -1.21 118.70 120.71 1brz s GLU 9 Ca 0.42 -0.31 0.00 0.00 -0.15 0.00 0.00 54.97 54.92 1brz s GLU 9 Cb 0.01 -4.97 0.00 0.00 -0.44 0.00 0.00 34.13 28.73 1brz s GLU 9 CO 0.00 -5.12 0.00 -1.71 0.95 0.00 0.00 175.26 169.38 1brz n ASN 10 N 18.92 0.00 -4.67 0.83 2.85 -1.26 -5.14 115.26 126.78 1brz n ASN 10 Ca 0.43 0.00 -0.46 0.00 -0.11 0.00 0.00 54.58 54.44 1brz n ASN 10 Cb 0.46 0.00 -0.04 0.00 1.24 0.00 0.00 39.78 41.44 1brz n ASN 10 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1brz n TYR 11 N 0.00 2.33 0.00 1.20 9.36 -0.35 -4.77 117.16 124.94 1brz n TYR 11 Ca 0.00 0.23 0.00 0.00 3.32 0.00 0.00 57.90 61.45 1brz n TYR 11 Cb 0.00 -2.56 0.00 0.00 -0.63 0.00 0.00 39.34 36.15 1brz n TYR 11 CO 0.00 0.00 0.00 -2.30 0.22 0.00 0.00 176.86 174.78 1brz n PRO 12 N 3.66 0.00 -0.05 2.98 -0.02 -1.26 -4.77 135.00 135.54 1brz n PRO 12 Ca 0.17 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.65 1brz n PRO 12 Cb 0.29 -1.49 0.00 0.00 -0.02 0.00 0.00 33.50 32.29 1brz n PRO 12 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1brz n VAL 13 N 2.55 0.00 0.00 -1.45 0.31 -1.26 -4.61 118.33 113.87 1brz n VAL 13 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1brz n VAL 13 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 1brz n VAL 13 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1brz n SER 14 N 0.20 0.00 -4.64 4.52 3.41 -1.26 -5.10 113.62 110.74 1brz n SER 14 Ca 0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.19 1brz n SER 14 Cb 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 1brz n SER 14 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1brz s LYS 15 N 0.74 3.89 0.00 4.33 2.20 -1.26 -4.52 119.74 125.12 1brz s LYS 15 Ca 0.00 2.20 0.00 0.00 -0.36 0.00 0.00 55.97 57.81 1brz s LYS 15 Cb 0.00 -4.13 0.00 0.00 -1.51 0.00 0.00 37.83 32.19 1brz s LYS 15 CO 0.00 -1.21 0.00 0.00 -0.36 0.00 0.00 175.35 173.78 1brz n GLN 17 N 0.00 1.03 -3.38 0.00 1.13 -1.26 -4.59 117.38 110.31 1brz n GLN 17 Ca 0.00 -0.06 0.02 0.00 -1.94 0.00 0.00 57.00 55.02 1brz n GLN 17 Cb 0.00 -1.02 -0.03 0.00 0.11 0.00 0.00 30.24 29.29 1brz n GLN 17 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1brz s LEU 18 N -0.07 -0.80 -0.58 1.08 1.43 -1.26 -5.10 118.68 113.38 1brz s LEU 18 Ca 0.01 0.89 -0.27 0.00 -1.03 0.00 0.00 54.13 53.74 1brz s LEU 18 Cb 0.01 1.83 -0.10 0.00 0.03 0.00 0.00 46.19 47.96 1brz s LEU 18 CO 0.00 -0.15 2.46 0.00 0.23 0.00 0.00 176.35 178.89 1brz n ALA 19 N 5.22 0.69 -1.00 4.21 0.00 -1.26 -4.22 120.51 124.15 1brz n ALA 19 Ca -0.08 -0.86 0.00 0.00 0.00 0.00 0.00 53.44 52.50 1brz n ALA 19 Cb 0.52 -3.07 0.00 0.00 0.00 0.00 0.00 19.45 16.90 1brz n ALA 19 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1brz n ASN 20 N 15.18 0.00 -0.14 0.00 4.05 -1.26 -4.92 115.26 128.16 1brz n ASN 20 Ca 0.42 0.00 -0.12 0.00 0.45 0.00 0.00 54.58 55.33 1brz n ASN 20 Cb 0.46 0.00 -0.09 0.00 1.23 0.00 0.00 39.78 41.38 1brz n ASN 20 CO 0.00 0.00 0.00 -0.61 -3.05 0.00 0.00 177.26 173.60 1brz h GLN 21 N 0.00 -0.33 0.32 1.20 5.75 -1.94 0.43 115.11 120.54 1brz h GLN 21 Ca 0.00 0.02 -0.01 0.00 -0.15 0.00 0.00 58.65 58.52 1brz h GLN 21 Cb 0.00 0.07 -0.01 0.00 1.07 0.00 0.00 27.48 28.61 1brz h GLN 21 CO 0.00 -0.22 -0.24 0.00 -2.65 0.00 0.00 178.83 175.72 1brz h ASN 23 N -0.56 -1.06 -0.55 0.00 -1.24 -1.66 0.94 115.58 111.46 1brz h ASN 23 Ca -0.03 0.11 0.11 0.00 0.71 0.00 0.00 56.30 57.20 1brz h ASN 23 Cb 0.48 0.39 -0.09 0.00 0.73 0.00 0.00 38.32 39.84 1brz h ASN 23 CO 0.00 -0.37 0.04 0.22 -1.29 0.00 0.00 177.43 176.03 1brz h TYR 24 N -0.50 0.04 0.07 0.67 3.20 -0.14 0.10 116.97 120.41 1brz h TYR 24 Ca -0.00 0.04 0.01 0.00 3.14 0.00 0.00 58.73 61.91 1brz h TYR 24 Cb 0.50 0.06 -0.04 0.00 1.54 0.00 0.00 36.73 38.80 1brz h TYR 24 CO -0.41 -0.09 -0.40 -0.44 -1.64 0.00 0.00 178.16 175.18 1brz h ASP 25 N 0.16 -1.20 -0.91 -2.11 3.32 0.06 -1.04 116.42 114.70 1brz h ASP 25 Ca 0.28 0.13 0.13 0.00 0.02 0.00 0.00 57.03 57.59 1brz h ASP 25 Cb 0.43 0.45 -0.09 0.00 0.22 0.00 0.00 39.33 40.34 1brz h ASP 25 CO -0.43 -0.41 0.53 0.00 -1.72 0.00 0.00 179.24 177.21 1brz n LYS 27 N -4.74 0.00 0.00 0.00 3.00 0.32 -0.95 118.16 115.79 1brz n LYS 27 Ca 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.48 1brz n LYS 27 Cb 0.37 -1.12 0.00 0.00 0.00 0.00 0.00 35.03 34.29 1brz n LYS 27 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.40 177.29 1brz n LEU 28 N -0.62 0.00 0.14 3.14 -0.00 0.74 -4.78 117.00 115.62 1brz n LEU 28 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 56.01 55.88 1brz n LEU 28 Cb 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 43.42 43.34 1brz n LEU 28 CO 0.00 -0.00 0.54 0.44 -0.00 0.00 0.00 177.39 178.37 1brz h ASP 29 N 0.00 -0.31 -0.88 1.96 3.32 0.65 -3.22 116.42 117.93 1brz h ASP 29 Ca 0.00 -0.20 -0.46 0.00 0.02 0.00 0.00 57.03 56.39 1brz h ASP 29 Cb 0.00 0.08 -0.27 0.00 0.22 0.00 0.00 39.33 39.36 1brz h ASP 29 CO 0.00 0.06 0.52 0.29 -1.72 0.00 0.00 179.24 178.40 1brz n LYS 30 N -5.10 2.20 -3.42 3.56 4.76 -1.20 -4.92 118.16 114.04 1brz n LYS 30 Ca -0.09 -3.04 -0.27 0.00 -2.87 0.00 0.00 58.31 52.03 1brz n LYS 30 Cb 0.26 -2.12 -0.05 0.00 -1.84 0.00 0.00 35.03 31.28 1brz n LYS 30 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 1brz n HIS 31 N -1.13 -0.78 -2.23 2.13 8.25 -1.18 -4.86 115.22 115.42 1brz n HIS 31 Ca 0.55 0.43 -0.16 0.00 -0.26 0.00 0.00 57.72 58.29 1brz n HIS 31 Cb 1.56 -1.19 0.09 0.00 1.12 0.00 0.00 29.99 31.57 1brz n HIS 31 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1brz n ALA 32 N -2.78 -0.17 -0.03 -1.41 0.00 -0.13 -4.95 120.51 111.04 1brz n ALA 32 Ca 0.08 -1.19 -0.01 0.00 0.00 0.00 0.00 53.44 52.31 1brz n ALA 32 Cb 0.30 0.13 -0.13 0.00 0.00 0.00 0.00 19.45 19.75 1brz n ALA 32 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1brz n ARG 33 N -2.33 0.65 0.00 0.00 0.63 0.12 -4.42 116.66 111.32 1brz n ARG 33 Ca 0.10 0.05 0.00 0.00 -0.92 0.00 0.00 57.85 57.08 1brz n ARG 33 Cb 0.37 -1.64 0.00 0.00 0.45 0.00 0.00 32.46 31.64 1brz n ARG 33 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 1brz n SER 34 N -2.70 0.00 0.00 6.15 3.41 -0.44 -4.84 113.62 115.20 1brz n SER 34 Ca -0.17 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.44 1brz n SER 34 Cb 0.90 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.85 1brz n SER 34 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1brz n GLY 35 N 0.00 -1.59 0.00 5.00 0.00 -1.26 0.95 105.19 108.30 1brz n GLY 35 Ca 0.00 -1.15 0.00 0.00 0.00 0.00 0.00 46.02 44.87 1brz n GLY 35 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1brz n GLU 36 N -0.15 0.00 -3.73 1.61 2.13 0.20 -4.43 120.64 116.26 1brz n GLU 36 Ca 0.00 0.00 -0.12 0.00 0.66 0.00 0.00 57.16 57.70 1brz n GLU 36 Cb 0.00 0.00 -0.11 0.00 0.27 0.00 0.00 31.44 31.60 1brz n GLU 36 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1brz n PHE 38 N 3.73 -1.35 -1.71 0.00 3.72 0.03 -4.92 117.46 116.96 1brz n PHE 38 Ca -0.20 -1.91 0.00 0.00 -0.05 0.00 0.00 57.45 55.29 1brz n PHE 38 Cb 0.55 0.48 0.00 0.00 -0.94 0.00 0.00 39.48 39.58 1brz n PHE 38 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1brz n TYR 39 N -0.48 -2.37 -3.88 1.38 4.02 -1.26 -0.85 117.16 113.73 1brz n TYR 39 Ca -0.00 0.00 0.01 0.00 -0.01 0.00 0.00 57.90 57.90 1brz n TYR 39 Cb 0.49 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.81 1brz n TYR 39 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 176.86 175.45 1brz n ASP 40 N -2.04 -0.38 0.00 7.72 5.68 -1.25 -4.84 116.55 121.44 1brz n ASP 40 Ca 0.00 -1.09 0.00 0.00 -0.50 0.00 0.00 54.79 53.21 1brz n ASP 40 Cb 0.00 0.59 0.02 0.00 -1.14 0.00 0.00 41.12 40.59 1brz n ASP 40 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1brz n GLU 41 N -0.28 0.02 0.00 0.11 4.71 -1.26 0.15 120.64 124.09 1brz n GLU 41 Ca 0.01 0.13 0.11 0.00 -0.01 0.00 0.00 57.16 57.40 1brz n GLU 41 Cb 0.18 -1.50 0.07 0.00 -1.01 0.00 0.00 31.44 29.17 1brz n GLU 41 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 1brz n LYS 42 N -1.13 1.92 -0.37 3.49 4.76 -1.26 -4.94 118.16 120.64 1brz n LYS 42 Ca 0.01 -1.60 0.00 0.00 -2.87 0.00 0.00 58.31 53.84 1brz n LYS 42 Cb 0.00 -1.44 0.00 0.00 -1.84 0.00 0.00 35.03 31.75 1brz n LYS 42 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1brz n ARG 43 N 0.90 0.00 -3.47 1.97 1.74 0.12 -4.91 116.66 113.02 1brz n ARG 43 Ca 0.12 0.00 -0.24 0.00 -0.77 0.00 0.00 57.85 56.96 1brz n ARG 43 Cb 0.54 -4.28 -0.02 0.00 -1.02 0.00 0.00 32.46 27.68 1brz n ARG 43 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 1brz s ASN 44 N -1.95 6.32 -0.02 0.55 0.02 -1.26 -4.83 114.94 113.77 1brz s ASN 44 Ca 0.00 0.44 -0.22 0.00 -1.02 0.00 0.00 52.86 52.06 1brz s ASN 44 Cb 0.00 -2.02 -0.05 0.00 0.02 0.00 0.00 41.25 39.20 1brz s ASN 44 CO 0.00 -0.23 0.64 -0.76 0.02 0.00 0.00 177.10 176.77 1brz s LEU 45 N -4.09 4.38 0.06 0.60 1.43 -1.26 -3.81 118.68 115.99 1brz s LEU 45 Ca 0.40 1.19 -0.09 0.00 -1.03 0.00 0.00 54.13 54.60 1brz s LEU 45 Cb -0.10 -3.00 -0.00 0.00 0.03 0.00 0.00 46.19 43.13 1brz s LEU 45 CO 0.34 0.02 0.18 -1.10 0.23 0.00 0.00 176.35 176.02 1brz s GLN 46 N 0.15 0.75 0.70 1.70 -0.21 -0.03 -4.81 119.66 117.91 1brz s GLN 46 Ca 0.33 -0.79 -0.13 0.00 0.02 0.00 0.00 55.36 54.79 1brz s GLN 46 Cb -0.18 0.31 0.02 0.00 1.00 0.00 0.00 33.01 34.15 1brz s GLN 46 CO 0.18 -0.22 1.09 0.00 -2.12 0.00 0.00 175.29 174.22 1brz s ILE 48 N -2.63 -0.25 -0.28 0.00 -1.09 0.83 -1.49 121.20 116.29 1brz s ILE 48 Ca 0.64 -0.04 -0.18 0.00 -2.23 0.00 0.00 60.65 58.83 1brz s ILE 48 Cb -0.18 -0.58 -0.02 0.00 -1.58 0.00 0.00 42.46 40.10 1brz s ILE 48 CO 0.48 -0.16 0.53 0.00 -1.23 0.00 0.00 174.94 174.56 1brz s ASP 50 N 1.59 6.33 0.00 0.00 2.15 0.27 -1.20 116.67 125.81 1brz s ASP 50 Ca 0.21 0.60 0.00 0.00 0.43 0.00 0.00 52.55 53.79 1brz s ASP 50 Cb -0.15 -2.10 0.00 0.00 -0.30 0.00 0.00 42.92 40.37 1brz s ASP 50 CO 0.10 -0.31 0.00 -1.22 -0.17 0.00 0.00 175.17 173.57 1brz n TYR 51 N -1.60 0.00 0.00 -5.34 4.02 0.68 0.14 117.16 115.06 1brz n TYR 51 Ca -0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.86 1brz n TYR 51 Cb 0.55 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.87 1brz n TYR 51 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1brz n GLU 53 N 0.00 0.00 0.00 0.00 -0.58 -1.26 -4.94 120.64 113.86 1brz n GLU 53 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 1brz n GLU 53 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.87 1brz n GLU 53 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31