#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1brz s LYS 3 N 0.00 2.76 0.00 0.11 -0.14 -1.26 -4.90 119.74 116.31 1brz s LYS 3 Ca 0.00 -2.30 0.00 0.00 -1.36 0.00 0.00 55.97 52.31 1brz s LYS 3 Cb 0.00 -3.93 0.00 0.00 -1.68 0.00 0.00 37.83 32.22 1brz s LYS 3 CO 0.00 -1.20 0.80 0.00 -0.76 0.00 0.00 175.35 174.19 1brz s LYS 5 N -1.81 4.03 -0.04 0.00 1.02 -1.26 -1.31 119.74 120.36 1brz s LYS 5 Ca 0.00 -0.07 -0.00 0.00 0.02 0.00 0.00 55.97 55.91 1brz s LYS 5 Cb 0.00 -3.62 0.03 0.00 -0.52 0.00 0.00 37.83 33.71 1brz s LYS 5 CO 0.00 -0.17 -0.00 0.15 -0.92 0.00 0.00 175.35 174.41 1brz s LYS 6 N 1.74 0.45 0.61 1.68 1.02 -0.41 -4.93 119.74 119.90 1brz s LYS 6 Ca 0.12 0.08 -0.19 0.00 0.02 0.00 0.00 55.97 56.01 1brz s LYS 6 Cb -0.15 -0.69 -0.03 0.00 -0.52 0.00 0.00 37.83 36.44 1brz s LYS 6 CO 0.09 -0.19 1.27 0.14 -0.92 0.00 0.00 175.35 175.74 1brz s VAL 7 N 1.37 2.28 0.00 3.17 -7.23 -1.26 -1.26 120.40 117.48 1brz s VAL 7 Ca -0.05 0.18 0.00 0.00 -1.81 0.00 0.00 61.98 60.30 1brz s VAL 7 Cb -0.13 -3.07 0.00 0.00 0.56 0.00 0.00 36.38 33.73 1brz s VAL 7 CO -0.02 -0.03 0.00 0.00 -0.31 0.00 0.00 175.10 174.73 1brz n TYR 8 N -1.66 0.00 0.00 2.82 4.19 -0.06 -4.85 117.16 117.61 1brz n TYR 8 Ca 0.14 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.35 1brz n TYR 8 Cb 0.48 0.00 0.00 0.00 0.49 0.00 0.00 39.34 40.31 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 0.00 0.00 -0.10 2.98 -0.58 -1.26 -4.98 120.64 116.70 1brz n GLU 9 Ca 0.00 0.00 -0.00 0.00 -0.42 0.00 0.00 57.16 56.74 1brz n GLU 9 Cb 0.00 0.00 -0.00 0.00 -0.57 0.00 0.00 31.44 30.87 1brz n GLU 9 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1brz n ASN 10 N 0.00 -0.01 -4.58 1.62 5.15 -1.26 -5.12 115.26 111.06 1brz n ASN 10 Ca 0.00 -0.11 -0.47 0.00 -0.60 0.00 0.00 54.58 53.40 1brz n ASN 10 Cb 0.00 0.00 -0.05 0.00 -0.53 0.00 0.00 39.78 39.21 1brz n ASN 10 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1brz n TYR 11 N 0.00 2.00 -1.51 1.20 9.36 -1.26 -4.77 117.16 122.18 1brz n TYR 11 Ca -0.00 0.00 -0.38 0.00 3.32 0.00 0.00 57.90 60.84 1brz n TYR 11 Cb 0.08 -2.66 -0.13 0.00 -0.63 0.00 0.00 39.34 36.00 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 7.93 0.25 -1.54 2.98 -0.02 -1.26 -4.72 135.00 138.62 1brz n PRO 12 Ca 0.30 -0.02 -0.20 0.00 -2.02 0.00 0.00 63.50 61.56 1brz n PRO 12 Cb 0.34 -1.97 -0.11 0.00 -0.02 0.00 0.00 33.50 31.74 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 7.53 -0.01 -3.59 -1.45 0.31 -1.26 -4.75 118.33 115.10 1brz n VAL 13 Ca 0.59 -0.51 0.01 0.00 -0.01 0.00 0.00 64.34 64.42 1brz n VAL 13 Cb 0.16 -1.51 -0.06 0.00 -0.91 0.00 0.00 33.84 31.52 1brz n VAL 13 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1brz s SER 14 N 8.25 -0.22 0.00 4.52 1.04 -1.26 -4.95 113.70 121.08 1brz s SER 14 Ca 1.06 0.35 0.00 0.00 0.48 0.00 0.00 55.95 57.84 1brz s SER 14 Cb -0.39 1.12 0.00 0.00 0.10 0.00 0.00 66.02 66.85 1brz s SER 14 CO 0.25 -0.05 0.00 1.17 0.98 0.00 0.00 173.24 175.59 1brz n LYS 15 N 3.51 0.00 -0.97 4.02 3.00 -1.26 -4.96 118.16 121.51 1brz n LYS 15 Ca -0.16 0.00 -0.43 0.00 -0.00 0.00 0.00 58.31 57.72 1brz n LYS 15 Cb 0.56 -0.49 -0.08 0.00 0.00 0.00 0.00 35.03 35.02 1brz n LYS 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1brz n GLN 17 N 7.43 2.32 -3.83 0.00 3.00 -1.26 -4.93 117.38 120.10 1brz n GLN 17 Ca 0.48 -0.03 -0.07 0.00 -0.01 0.00 0.00 57.00 57.37 1brz n GLN 17 Cb 0.41 -0.98 0.01 0.00 0.00 0.00 0.00 30.24 29.68 1brz n GLN 17 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.06 176.58 1brz s LEU 18 N -2.92 -0.06 0.00 1.08 0.05 -1.26 -5.11 118.68 110.45 1brz s LEU 18 Ca -0.00 -0.89 0.00 0.00 0.05 0.00 0.00 54.13 53.29 1brz s LEU 18 Cb 0.04 2.63 0.00 0.00 -2.05 0.00 0.00 46.19 46.81 1brz s LEU 18 CO 0.25 -1.43 0.00 0.00 -0.55 0.00 0.00 176.35 174.62 1brz n ALA 19 N -0.54 0.00 -0.86 1.48 0.00 -1.26 -4.31 120.51 115.02 1brz n ALA 19 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 1brz n ALA 19 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.05 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 0.00 0.00 0.00 0.00 4.05 -1.26 -4.15 115.26 113.90 1brz n ASN 20 Ca 0.00 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.03 1brz n ASN 20 Cb 0.00 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.01 1brz n ASN 20 CO 0.00 0.00 0.00 1.67 -3.05 0.00 0.00 177.26 175.88 1brz n GLN 21 N 0.00 0.00 -0.30 1.20 -0.06 -1.26 0.93 117.38 117.89 1brz n GLN 21 Ca 0.00 0.60 -0.03 0.00 -2.00 0.00 0.00 57.00 55.57 1brz n GLN 21 Cb 0.00 -1.13 0.09 0.00 -4.06 0.00 0.00 30.24 25.14 1brz n GLN 21 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1brz n ASN 23 N -4.54 0.00 -0.35 0.00 5.15 -0.87 -0.49 115.26 114.16 1brz n ASN 23 Ca 0.09 0.79 0.16 0.00 -0.60 0.00 0.00 54.58 55.02 1brz n ASN 23 Cb 0.05 -0.29 0.36 0.00 -0.53 0.00 0.00 39.78 39.37 1brz n ASN 23 CO 0.00 0.00 0.00 0.22 1.40 0.00 0.00 177.26 178.88 1brz h TYR 24 N 0.00 1.02 0.29 1.20 3.20 0.52 0.79 116.97 123.99 1brz h TYR 24 Ca 0.00 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.90 1brz h TYR 24 Cb 0.00 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 37.97 1brz h TYR 24 CO -0.10 0.11 -0.25 -0.44 -1.64 0.00 0.00 178.16 175.84 1brz h ASP 25 N 0.63 -0.68 -0.75 -2.11 5.19 -0.87 -2.33 116.42 115.49 1brz h ASP 25 Ca 0.62 0.05 0.09 0.00 -0.62 0.00 0.00 57.03 57.18 1brz h ASP 25 Cb 1.12 0.22 -0.05 0.00 0.18 0.00 0.00 39.33 40.80 1brz h ASP 25 CO -0.45 -0.35 0.49 0.00 -3.12 0.00 0.00 179.24 175.81 1brz n LYS 27 N -4.50 0.00 0.00 0.00 4.81 0.22 0.02 118.16 118.71 1brz n LYS 27 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.56 1brz n LYS 27 Cb 0.33 -1.38 0.00 0.00 0.02 0.00 0.00 35.03 34.00 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 -0.88 0.00 0.12 3.14 7.94 0.25 -4.59 117.00 122.98 1brz n LEU 28 Ca 0.00 0.00 0.11 0.00 -1.11 0.00 0.00 56.01 55.01 1brz n LEU 28 Cb 0.00 0.00 0.48 0.00 0.53 0.00 0.00 43.42 44.43 1brz n LEU 28 CO 0.00 0.00 0.83 0.47 -1.11 0.00 0.00 177.39 177.58 1brz n ASP 29 N -0.96 0.58 -0.35 1.96 9.92 1.18 -2.86 116.55 126.02 1brz n ASP 29 Ca 0.00 0.67 0.00 0.00 -0.53 0.00 0.00 54.79 54.93 1brz n ASP 29 Cb 0.00 -0.78 0.00 0.00 -0.64 0.00 0.00 41.12 39.70 1brz n ASP 29 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1brz n LYS 30 N -2.16 0.00 -2.34 -1.24 5.02 -1.21 -4.96 118.16 111.27 1brz n LYS 30 Ca 0.01 -0.79 -0.14 0.00 -2.02 0.00 0.00 58.31 55.38 1brz n LYS 30 Cb 0.18 -0.47 -0.01 0.00 -0.02 0.00 0.00 35.03 34.72 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 0.00 -1.25 -2.01 2.13 8.25 -1.14 -4.95 115.22 116.26 1brz n HIS 31 Ca 0.00 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.31 1brz n HIS 31 Cb 0.63 -2.95 0.09 0.00 1.12 0.00 0.00 29.99 28.88 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 -1.94 -0.36 -0.13 -1.41 0.00 0.10 -4.91 120.51 111.86 1brz n ALA 32 Ca -0.16 -1.07 -0.28 0.00 0.00 0.00 0.00 53.44 51.93 1brz n ALA 32 Cb 0.61 0.07 -0.10 0.00 0.00 0.00 0.00 19.45 20.03 1brz n ALA 32 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1brz n ARG 33 N -2.33 0.58 -2.76 0.00 1.74 -0.08 -4.24 116.66 109.57 1brz n ARG 33 Ca 0.10 0.31 -0.07 0.00 -0.77 0.00 0.00 57.85 57.42 1brz n ARG 33 Cb 0.34 -1.53 -0.03 0.00 -1.02 0.00 0.00 32.46 30.22 1brz n ARG 33 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1brz n SER 34 N -4.29 -0.30 -3.65 0.55 3.41 -0.51 -4.55 113.62 104.27 1brz n SER 34 Ca -0.50 -1.79 -0.04 0.00 -0.26 0.00 0.00 58.87 56.28 1brz n SER 34 Cb 0.84 0.67 -0.01 0.00 -0.26 0.00 0.00 64.21 65.45 1brz n SER 34 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1brz s GLY 35 N -1.85 -0.33 -0.28 5.00 0.00 -1.26 -0.39 107.32 108.22 1brz s GLY 35 Ca 0.14 0.53 -0.28 0.00 0.00 0.00 0.00 44.72 45.12 1brz s GLY 35 CO 0.10 0.14 1.33 -0.54 0.00 0.00 0.00 173.10 174.13 1brz s GLU 36 N -3.10 0.14 -0.02 2.90 2.02 -0.02 -3.92 118.70 116.70 1brz s GLU 36 Ca 0.10 0.07 -0.15 0.00 0.02 0.00 0.00 54.97 55.01 1brz s GLU 36 Cb -0.01 0.07 -0.06 0.00 0.10 0.00 0.00 34.13 34.24 1brz s GLU 36 CO -0.02 -0.04 0.42 0.00 0.02 0.00 0.00 175.26 175.64 1brz s PHE 38 N -0.82 0.15 0.49 0.00 0.08 -0.50 -4.79 117.98 112.60 1brz s PHE 38 Ca 0.24 -0.52 -0.14 0.00 0.12 0.00 0.00 56.93 56.63 1brz s PHE 38 Cb -0.16 -0.08 -0.07 0.00 -0.57 0.00 0.00 43.02 42.14 1brz s PHE 38 CO 0.13 -0.49 0.92 0.71 -0.10 0.00 0.00 175.22 176.40 1brz s TYR 39 N -3.39 3.48 -0.44 0.36 1.51 -1.26 0.12 117.35 117.72 1brz s TYR 39 Ca 0.01 1.31 0.06 0.00 -1.01 0.00 0.00 57.07 57.45 1brz s TYR 39 Cb 0.03 -2.67 0.33 0.00 -0.11 0.00 0.00 41.96 39.53 1brz s TYR 39 CO -0.08 -0.33 1.17 -0.40 -1.11 0.00 0.00 175.55 174.80 1brz n ASP 40 N -1.64 -2.19 0.00 2.29 5.75 -1.26 -4.91 116.55 114.59 1brz n ASP 40 Ca 0.05 -3.39 0.00 0.00 -0.01 0.00 0.00 54.79 51.45 1brz n ASP 40 Cb 0.54 1.75 0.00 0.00 -1.03 0.00 0.00 41.12 42.38 1brz n ASP 40 CO 0.00 0.00 0.00 1.21 -0.11 0.00 0.00 177.20 178.30 1brz n GLU 41 N 0.24 0.00 0.00 0.11 4.07 -1.26 -4.83 120.64 118.97 1brz n GLU 41 Ca 0.04 0.00 0.11 0.00 -0.06 0.00 0.00 57.16 57.25 1brz n GLU 41 Cb 0.72 -0.39 0.06 0.00 -0.06 0.00 0.00 31.44 31.78 1brz n GLU 41 CO 0.00 0.00 0.00 1.17 -0.06 0.00 0.00 177.13 178.24 1brz n LYS 42 N -2.00 0.52 -4.52 5.31 3.00 -1.26 -4.95 118.16 114.26 1brz n LYS 42 Ca 0.00 -0.40 -0.42 0.00 -0.00 0.00 0.00 58.31 57.49 1brz n LYS 42 Cb 0.00 -1.49 -0.08 0.00 0.00 0.00 0.00 35.03 33.46 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 -0.89 -0.78 0.00 1.64 3.00 -1.26 -4.65 116.66 113.71 1brz n ARG 43 Ca 0.07 0.14 0.00 0.00 -0.01 0.00 0.00 57.85 58.05 1brz n ARG 43 Cb 0.38 -4.72 0.00 0.00 0.00 0.00 0.00 32.46 28.11 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 -2.45 0.00 -0.66 0.55 3.02 -1.26 -5.08 115.26 109.38 1brz n ASN 44 Ca 0.12 -1.00 0.02 0.00 -0.03 0.00 0.00 54.58 53.69 1brz n ASN 44 Cb 0.45 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.61 1brz n ASN 44 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1brz n LEU 45 N 0.00 -0.65 -3.75 3.41 4.77 -1.26 -4.87 117.00 114.65 1brz n LEU 45 Ca 0.00 1.18 -0.13 0.00 -0.03 0.00 0.00 56.01 57.04 1brz n LEU 45 Cb 0.39 -0.92 -0.11 0.00 -2.33 0.00 0.00 43.42 40.44 1brz n LEU 45 CO 0.00 -0.51 -0.01 -1.58 -1.33 0.00 0.00 177.39 173.96 1brz s GLN 46 N -4.34 0.36 -0.54 3.23 2.00 0.32 -4.84 119.66 115.84 1brz s GLN 46 Ca 0.00 0.51 -0.26 0.00 -2.00 0.00 0.00 55.36 53.61 1brz s GLN 46 Cb 0.00 0.12 -0.07 0.00 0.80 0.00 0.00 33.01 33.86 1brz s GLN 46 CO 0.00 -0.08 2.34 0.00 -0.50 0.00 0.00 175.29 177.05 1brz s ILE 48 N 12.10 4.81 -0.13 0.00 -1.09 0.10 -0.88 121.20 136.11 1brz s ILE 48 Ca 0.93 0.57 -0.18 0.00 -2.23 0.00 0.00 60.65 59.74 1brz s ILE 48 Cb -0.16 -4.16 -0.04 0.00 -1.58 0.00 0.00 42.46 36.52 1brz s ILE 48 CO 0.23 -0.44 0.46 0.00 -1.23 0.00 0.00 174.94 173.96 1brz s ASP 50 N 0.62 6.34 -0.14 0.00 2.15 0.47 -1.28 116.67 124.83 1brz s ASP 50 Ca 0.25 0.39 0.19 0.00 0.43 0.00 0.00 52.55 53.80 1brz s ASP 50 Cb -0.15 -2.19 -0.26 0.00 -0.30 0.00 0.00 42.92 40.02 1brz s ASP 50 CO 0.09 -0.03 0.24 -1.22 -0.17 0.00 0.00 175.17 174.08 1brz n TYR 51 N 4.42 0.11 0.00 -5.34 4.02 -0.43 -0.90 117.16 119.04 1brz n TYR 51 Ca -0.10 0.04 0.00 0.00 -0.01 0.00 0.00 57.90 57.82 1brz n TYR 51 Cb 0.51 -0.90 0.00 0.00 -0.02 0.00 0.00 39.34 38.93 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 4.07 -1.26 -4.86 120.64 118.59 1brz n GLU 53 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 1brz n GLU 53 Cb 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.38 1brz n GLU 53 CO 0.00 0.00 0.00 0.66 -0.06 0.00 0.00 177.13 177.73