#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 -1.25 -0.15 -0.67 5.02 -1.26 -4.92 118.16 114.94 1brz n LYS 3 Ca 0.00 1.06 0.10 0.00 -2.02 0.00 0.00 58.31 57.45 1brz n LYS 3 Cb 0.00 -1.22 0.16 0.00 -0.02 0.00 0.00 35.03 33.96 1brz n LYS 3 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1brz s LYS 5 N -2.87 0.27 -0.07 0.00 0.00 -1.26 -1.18 119.74 114.64 1brz s LYS 5 Ca 0.34 0.22 -0.04 0.00 0.00 0.00 0.00 55.97 56.49 1brz s LYS 5 Cb 0.29 0.13 0.03 0.00 0.00 0.00 0.00 37.83 38.28 1brz s LYS 5 CO 0.04 -0.04 0.16 0.15 0.00 0.00 0.00 175.35 175.67 1brz s LYS 6 N -0.05 0.15 0.22 1.78 -0.14 -0.22 -4.96 119.74 116.53 1brz s LYS 6 Ca -0.02 0.32 -0.31 0.00 -1.36 0.00 0.00 55.97 54.60 1brz s LYS 6 Cb -0.02 -0.05 -0.11 0.00 -1.68 0.00 0.00 37.83 35.97 1brz s LYS 6 CO 0.00 -0.10 1.64 0.14 -0.76 0.00 0.00 175.35 176.27 1brz s VAL 7 N 0.68 2.20 -1.70 3.17 -7.23 -1.26 -1.28 120.40 114.98 1brz s VAL 7 Ca -0.05 0.15 0.11 0.00 -1.81 0.00 0.00 61.98 60.39 1brz s VAL 7 Cb -0.07 -3.10 0.25 0.00 0.56 0.00 0.00 36.38 34.03 1brz s VAL 7 CO -0.03 0.02 1.18 0.00 -0.31 0.00 0.00 175.10 175.95 1brz n TYR 8 N 3.40 0.00 0.00 2.82 4.19 0.13 -4.88 117.16 122.82 1brz n TYR 8 Ca 0.13 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.34 1brz n TYR 8 Cb 0.37 -0.15 0.00 0.00 0.49 0.00 0.00 39.34 40.05 1brz n TYR 8 CO 0.00 0.00 0.00 0.39 0.91 0.00 0.00 176.86 178.16 1brz n GLU 9 N -1.15 0.00 0.00 2.98 1.02 -1.26 -4.81 120.64 117.41 1brz n GLU 9 Ca 0.07 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.21 1brz n GLU 9 Cb 0.06 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.48 1brz n GLU 9 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1brz n ASN 10 N 3.97 0.00 0.00 1.62 4.13 -1.26 -4.64 115.26 119.07 1brz n ASN 10 Ca 0.00 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.26 1brz n ASN 10 Cb 0.00 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.24 1brz n ASN 10 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1brz n TYR 11 N 0.00 0.00 -2.30 3.10 9.36 -1.26 -4.54 117.16 121.51 1brz n TYR 11 Ca 0.00 0.00 -0.34 0.00 3.32 0.00 0.00 57.90 60.88 1brz n TYR 11 Cb 0.00 0.00 -0.04 0.00 -0.63 0.00 0.00 39.34 38.67 1brz n TYR 11 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 1brz s PRO 12 N -5.02 3.14 -0.46 2.98 0.04 -1.26 -4.92 135.00 129.50 1brz s PRO 12 Ca 0.00 -1.22 -0.32 0.00 0.04 0.00 0.00 61.00 59.50 1brz s PRO 12 Cb 0.00 -5.31 -0.11 0.00 0.04 0.00 0.00 34.50 29.12 1brz s PRO 12 CO 0.00 -3.04 2.32 0.28 0.04 0.00 0.00 177.00 176.59 1brz n VAL 13 N 7.25 0.11 0.00 -0.36 0.31 -1.26 -4.22 118.33 120.17 1brz n VAL 13 Ca 0.43 -0.38 0.00 0.00 -0.01 0.00 0.00 64.34 64.38 1brz n VAL 13 Cb 0.47 -1.87 0.00 0.00 -0.91 0.00 0.00 33.84 31.53 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 11.61 0.00 0.24 4.52 3.41 -1.26 -4.93 113.62 127.20 1brz n SER 14 Ca 0.42 0.00 0.16 0.00 -0.26 0.00 0.00 58.87 59.20 1brz n SER 14 Cb 0.30 0.00 0.75 0.00 -0.26 0.00 0.00 64.21 65.00 1brz n SER 14 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1brz h LYS 15 N 0.00 0.00 -5.39 4.33 1.57 -2.03 -3.39 116.57 111.66 1brz h LYS 15 Ca 0.00 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.61 1brz h LYS 15 Cb 0.00 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 1brz h LYS 15 CO 0.00 0.00 0.49 0.00 -0.57 0.00 0.00 179.45 179.37 1brz n GLN 17 N 8.46 2.69 -3.69 0.00 1.13 -1.26 -4.98 117.38 119.73 1brz n GLN 17 Ca 0.43 0.00 -0.06 0.00 -1.94 0.00 0.00 57.00 55.44 1brz n GLN 17 Cb 0.46 -0.25 -0.02 0.00 0.11 0.00 0.00 30.24 30.55 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 -0.76 -0.25 0.31 1.08 1.43 -1.26 -5.07 118.68 114.15 1brz s LEU 18 Ca 0.00 -0.31 -0.29 0.00 -1.03 0.00 0.00 54.13 52.49 1brz s LEU 18 Cb 0.00 2.23 -0.12 0.00 0.03 0.00 0.00 46.19 48.33 1brz s LEU 18 CO 0.00 -0.90 1.45 0.00 0.23 0.00 0.00 176.35 177.13 1brz n ALA 19 N -0.41 1.80 0.00 4.21 0.00 -1.26 -4.50 120.51 120.34 1brz n ALA 19 Ca -0.07 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.74 1brz n ALA 19 Cb 0.61 -2.35 0.00 0.00 0.00 0.00 0.00 19.45 17.71 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 1.51 0.00 -0.05 0.00 4.05 -1.26 -4.94 115.26 114.58 1brz n ASN 20 Ca 0.07 0.00 -0.10 0.00 0.45 0.00 0.00 54.58 55.00 1brz n ASN 20 Cb 0.35 0.00 -0.04 0.00 1.23 0.00 0.00 39.78 41.33 1brz n ASN 20 CO 0.00 0.00 0.00 1.56 -3.05 0.00 0.00 177.26 175.77 1brz h GLN 21 N 0.00 -0.34 0.43 1.20 1.08 -1.95 0.37 115.11 115.90 1brz h GLN 21 Ca 0.00 0.02 -0.02 0.00 -1.45 0.00 0.00 58.65 57.21 1brz h GLN 21 Cb 0.00 0.08 0.00 0.00 -0.05 0.00 0.00 27.48 27.51 1brz h GLN 21 CO 0.00 -0.23 -0.23 0.00 -0.95 0.00 0.00 178.83 177.42 1brz h ASN 23 N -0.62 -0.34 -0.67 0.00 -1.24 -1.65 0.56 115.58 111.64 1brz h ASN 23 Ca -0.05 0.03 0.14 0.00 0.71 0.00 0.00 56.30 57.13 1brz h ASN 23 Cb 0.49 0.12 -0.10 0.00 0.73 0.00 0.00 38.32 39.56 1brz h ASN 23 CO 0.08 -0.13 0.12 0.22 -1.29 0.00 0.00 177.43 176.43 1brz h TYR 24 N -0.18 0.18 -0.06 0.67 3.20 -0.33 0.74 116.97 121.19 1brz h TYR 24 Ca -0.00 0.04 0.02 0.00 3.14 0.00 0.00 58.73 61.93 1brz h TYR 24 Cb 0.17 0.02 -0.05 0.00 1.54 0.00 0.00 36.73 38.41 1brz h TYR 24 CO -0.27 -0.09 -0.48 -0.44 -1.64 0.00 0.00 178.16 175.25 1brz h ASP 25 N 0.23 -1.49 -0.80 -2.11 3.32 0.02 -0.30 116.42 115.29 1brz h ASP 25 Ca 0.36 0.17 0.09 0.00 0.02 0.00 0.00 57.03 57.68 1brz h ASP 25 Cb 0.59 0.57 -0.07 0.00 0.22 0.00 0.00 39.33 40.64 1brz h ASP 25 CO -0.48 -0.44 0.45 0.00 -1.72 0.00 0.00 179.24 177.04 1brz n LYS 27 N -4.77 0.01 0.00 0.00 4.81 0.19 -0.80 118.16 117.60 1brz n LYS 27 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.57 1brz n LYS 27 Cb 0.28 -1.10 0.00 0.00 0.02 0.00 0.00 35.03 34.22 1brz n LYS 27 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 1brz n LEU 28 N -0.60 0.00 0.16 3.14 7.94 0.28 -4.66 117.00 123.26 1brz n LEU 28 Ca 0.00 0.00 -0.07 0.00 -1.11 0.00 0.00 56.01 54.83 1brz n LEU 28 Cb 0.00 0.00 -0.03 0.00 0.53 0.00 0.00 43.42 43.92 1brz n LEU 28 CO 0.00 0.00 0.31 0.44 -1.11 0.00 0.00 177.39 177.03 1brz h ASP 29 N 0.00 -0.37 -0.67 1.96 5.19 0.75 -3.33 116.42 119.95 1brz h ASP 29 Ca 0.00 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.42 1brz h ASP 29 Cb 0.00 0.10 0.00 0.00 0.18 0.00 0.00 39.33 39.61 1brz h ASP 29 CO 0.00 -0.15 0.00 0.29 -3.12 0.00 0.00 179.24 176.26 1brz n LYS 30 N -3.81 3.28 -3.08 3.56 5.02 -1.25 -4.93 118.16 116.94 1brz n LYS 30 Ca -0.05 -2.77 -0.14 0.00 -2.02 0.00 0.00 58.31 53.33 1brz n LYS 30 Cb 0.17 -1.73 0.04 0.00 -0.02 0.00 0.00 35.03 33.49 1brz n LYS 30 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1brz n HIS 31 N 1.29 -1.63 -2.19 2.13 8.25 -1.23 -5.03 115.22 116.82 1brz n HIS 31 Ca 0.25 0.56 -0.18 0.00 -0.26 0.00 0.00 57.72 58.08 1brz n HIS 31 Cb 0.76 -3.33 0.11 0.00 1.12 0.00 0.00 29.99 28.65 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 -3.82 -0.33 -0.06 -1.41 0.00 0.02 -4.92 120.51 109.99 1brz n ALA 32 Ca -0.00 -1.35 -0.17 0.00 0.00 0.00 0.00 53.44 51.91 1brz n ALA 32 Cb 0.54 0.12 -0.13 0.00 0.00 0.00 0.00 19.45 19.98 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 -2.60 0.70 0.00 0.00 0.00 0.10 -4.30 116.66 110.56 1brz n ARG 33 Ca 0.12 0.20 0.00 0.00 -0.00 0.00 0.00 57.85 58.17 1brz n ARG 33 Cb 0.42 -1.63 0.00 0.00 0.00 0.00 0.00 32.46 31.25 1brz n ARG 33 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.63 176.50 1brz n SER 34 N -3.28 0.57 0.00 6.15 3.41 -0.76 -4.70 113.62 115.02 1brz n SER 34 Ca -0.35 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.26 1brz n SER 34 Cb 1.04 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.99 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 0.63 3.67 5.00 0.00 -1.26 0.39 105.19 113.62 1brz n GLY 35 Ca 0.00 -2.18 0.02 0.00 0.00 0.00 0.00 46.02 43.86 1brz n GLY 35 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1brz s GLU 36 N -0.45 0.30 -0.06 1.61 -6.30 0.19 -4.35 118.70 109.64 1brz s GLU 36 Ca 0.00 -0.17 -0.20 0.00 -2.50 0.00 0.00 54.97 52.09 1brz s GLU 36 Cb 0.00 0.10 -0.04 0.00 0.00 0.00 0.00 34.13 34.18 1brz s GLU 36 CO 0.00 -0.14 0.58 0.00 0.02 0.00 0.00 175.26 175.72 1brz n PHE 38 N 3.36 -0.60 -3.36 0.00 3.72 -0.12 -4.91 117.46 115.54 1brz n PHE 38 Ca -0.05 -0.29 -0.37 0.00 -0.05 0.00 0.00 57.45 56.69 1brz n PHE 38 Cb 0.51 0.07 -0.06 0.00 -0.94 0.00 0.00 39.48 39.07 1brz n PHE 38 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 176.76 177.42 1brz s TYR 39 N -5.00 3.72 0.46 1.38 1.51 -1.26 -0.09 117.35 118.07 1brz s TYR 39 Ca 0.03 1.13 0.08 0.00 -1.01 0.00 0.00 57.07 57.30 1brz s TYR 39 Cb -0.00 -2.40 0.02 0.00 -0.11 0.00 0.00 41.96 39.47 1brz s TYR 39 CO 0.02 0.55 0.62 0.16 -1.11 0.00 0.00 175.55 175.80 1brz s ASP 40 N -1.30 5.54 0.00 2.29 -4.77 -1.26 -4.90 116.67 112.26 1brz s ASP 40 Ca 0.30 -0.44 0.00 0.00 -3.30 0.00 0.00 52.55 49.12 1brz s ASP 40 Cb -0.17 -0.55 0.00 0.00 -1.09 0.00 0.00 42.92 41.11 1brz s ASP 40 CO 0.18 -0.88 0.35 1.21 0.70 0.00 0.00 175.17 176.72 1brz n GLU 41 N -1.96 0.21 0.00 2.11 2.13 -1.26 -1.19 120.64 120.68 1brz n GLU 41 Ca 0.09 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.91 1brz n GLU 41 Cb 0.59 -1.40 0.00 0.00 0.27 0.00 0.00 31.44 30.91 1brz n GLU 41 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 1brz n LYS 42 N 1.54 0.00 -3.27 5.31 3.00 -1.26 -5.04 118.16 118.44 1brz n LYS 42 Ca 0.00 -0.35 -0.15 0.00 -0.00 0.00 0.00 58.31 57.81 1brz n LYS 42 Cb 0.10 -0.42 0.07 0.00 0.00 0.00 0.00 35.03 34.78 1brz n LYS 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 1brz n ARG 43 N 0.00 -2.74 0.00 1.64 3.00 -0.33 -5.00 116.66 113.22 1brz n ARG 43 Ca 0.00 0.86 0.00 0.00 -0.01 0.00 0.00 57.85 58.70 1brz n ARG 43 Cb 0.45 -5.83 0.00 0.00 0.00 0.00 0.00 32.46 27.08 1brz n ARG 43 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 1brz n ASN 44 N -3.21 0.78 -3.67 0.55 4.13 -1.26 -4.97 115.26 107.60 1brz n ASN 44 Ca -0.10 0.00 -0.09 0.00 1.68 0.00 0.00 54.58 56.08 1brz n ASN 44 Cb 0.63 0.00 -0.09 0.00 -1.54 0.00 0.00 39.78 38.77 1brz n ASN 44 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1brz s LEU 45 N 0.00 -0.49 0.30 3.41 2.96 -1.26 -4.07 118.68 119.54 1brz s LEU 45 Ca 0.00 1.16 -0.02 0.00 -0.22 0.00 0.00 54.13 55.05 1brz s LEU 45 Cb 0.00 1.78 -0.01 0.00 0.50 0.00 0.00 46.19 48.46 1brz s LEU 45 CO 0.00 -0.21 0.38 -1.10 -1.32 0.00 0.00 176.35 174.10 1brz s GLN 46 N 1.59 1.70 -0.53 1.98 1.11 0.86 -4.88 119.66 121.50 1brz s GLN 46 Ca -0.09 -1.70 -0.19 0.00 0.01 0.00 0.00 55.36 53.39 1brz s GLN 46 Cb -0.07 0.40 0.08 0.00 -1.01 0.00 0.00 33.01 32.40 1brz s GLN 46 CO -0.16 -0.67 0.62 0.00 0.01 0.00 0.00 175.29 175.09 1brz s ILE 48 N 2.50 4.50 -0.21 0.00 -1.09 0.71 0.19 121.20 127.80 1brz s ILE 48 Ca 0.12 1.17 -0.14 0.00 -2.23 0.00 0.00 60.65 59.57 1brz s ILE 48 Cb -0.22 -4.40 -0.04 0.00 -1.58 0.00 0.00 42.46 36.22 1brz s ILE 48 CO 0.09 -0.66 0.33 0.00 -1.23 0.00 0.00 174.94 173.47 1brz s ASP 50 N 1.02 6.68 -0.13 0.00 -1.08 0.16 -1.06 116.67 122.26 1brz s ASP 50 Ca 0.16 0.83 0.18 0.00 -0.52 0.00 0.00 52.55 53.19 1brz s ASP 50 Cb -0.14 -2.19 0.43 0.00 -1.46 0.00 0.00 42.92 39.56 1brz s ASP 50 CO 0.07 0.24 1.19 -1.22 0.52 0.00 0.00 175.17 175.97 1brz n TYR 51 N 1.28 0.27 0.00 -5.34 4.01 -0.32 0.03 117.16 117.09 1brz n TYR 51 Ca -0.11 -1.19 0.00 0.00 -0.16 0.00 0.00 57.90 56.45 1brz n TYR 51 Cb 0.52 -0.21 0.00 0.00 -0.31 0.00 0.00 39.34 39.34 1brz n TYR 51 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1brz n GLU 53 N -0.95 0.00 0.00 0.00 0.00 -1.26 -5.02 120.64 113.41 1brz n GLU 53 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 1brz n GLU 53 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.44 1brz n GLU 53 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79