#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 0.00 -1.24 -0.00 -1.26 -4.80 118.16 110.86 1brz n LYS 3 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 1brz n LYS 3 Cb 0.00 -0.04 0.00 0.00 -0.00 0.00 0.00 35.03 34.99 1brz n LYS 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1brz s LYS 5 N -0.05 0.26 -0.14 0.00 -0.14 -1.26 -0.56 119.74 117.85 1brz s LYS 5 Ca 0.00 0.10 -0.07 0.00 -1.36 0.00 0.00 55.97 54.64 1brz s LYS 5 Cb 0.00 -0.48 0.06 0.00 -1.68 0.00 0.00 37.83 35.73 1brz s LYS 5 CO 0.00 -0.15 0.32 0.15 -0.76 0.00 0.00 175.35 174.91 1brz s LYS 6 N 1.10 0.27 0.83 1.68 1.02 -0.50 -4.98 119.74 119.16 1brz s LYS 6 Ca -0.09 0.73 -0.12 0.00 0.02 0.00 0.00 55.97 56.51 1brz s LYS 6 Cb -0.13 -0.01 0.09 0.00 -0.52 0.00 0.00 37.83 37.26 1brz s LYS 6 CO -0.02 -0.20 1.15 0.14 -0.92 0.00 0.00 175.35 175.50 1brz s VAL 7 N 1.74 2.43 -0.65 3.17 -7.23 -1.26 -1.14 120.40 117.46 1brz s VAL 7 Ca -0.06 0.16 0.25 0.00 -1.81 0.00 0.00 61.98 60.52 1brz s VAL 7 Cb -0.10 -2.44 0.22 0.00 0.56 0.00 0.00 36.38 34.62 1brz s VAL 7 CO -0.10 -0.16 1.60 0.22 -0.31 0.00 0.00 175.10 176.35 1brz h TYR 8 N -1.24 0.00 -3.75 2.82 5.03 -1.11 -3.45 116.97 115.27 1brz h TYR 8 Ca -0.44 0.00 -0.14 0.00 2.58 0.00 0.00 58.73 60.73 1brz h TYR 8 Cb 1.27 0.00 0.01 0.00 1.55 0.00 0.00 36.73 39.55 1brz h TYR 8 CO 0.51 0.00 -0.40 -0.85 -1.32 0.00 0.00 178.16 176.10 1brz n GLU 9 N -2.36 -0.62 0.00 1.82 0.28 -1.26 -4.37 120.64 114.13 1brz n GLU 9 Ca 0.04 0.44 0.00 0.00 -0.16 0.00 0.00 57.16 57.48 1brz n GLU 9 Cb 0.45 -0.66 0.00 0.00 1.43 0.00 0.00 31.44 32.66 1brz n GLU 9 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1brz n ASN 10 N 0.48 0.00 -4.47 -1.84 3.02 -1.26 -5.11 115.26 106.08 1brz n ASN 10 Ca -0.04 0.00 -0.48 0.00 -0.03 0.00 0.00 54.58 54.03 1brz n ASN 10 Cb 0.23 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.33 1brz n ASN 10 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1brz n TYR 11 N 0.00 1.58 -1.86 3.10 9.36 -1.26 -4.84 117.16 123.24 1brz n TYR 11 Ca 0.00 0.22 -0.42 0.00 3.32 0.00 0.00 57.90 61.02 1brz n TYR 11 Cb 0.00 -2.56 0.00 0.00 -0.63 0.00 0.00 39.34 36.16 1brz n TYR 11 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 1brz n PRO 12 N 8.34 2.99 -1.86 2.98 -0.04 -1.26 -4.71 135.00 141.44 1brz n PRO 12 Ca 0.41 -2.78 0.00 0.00 -0.04 0.00 0.00 63.50 61.09 1brz n PRO 12 Cb 0.27 -3.24 0.00 0.00 -0.04 0.00 0.00 33.50 30.49 1brz n PRO 12 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1brz n VAL 13 N 4.86 0.00 0.46 0.52 0.31 -1.26 -4.61 118.33 118.61 1brz n VAL 13 Ca 0.50 0.00 0.05 0.00 -0.01 0.00 0.00 64.34 64.88 1brz n VAL 13 Cb 0.39 0.00 0.26 0.00 -0.91 0.00 0.00 33.84 33.58 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 0.53 0.00 0.00 4.52 3.41 -1.26 -4.77 113.62 116.04 1brz n SER 14 Ca 0.00 0.29 0.00 0.00 -0.26 0.00 0.00 58.87 58.90 1brz n SER 14 Cb 0.00 -0.38 0.00 0.00 -0.26 0.00 0.00 64.21 63.57 1brz n SER 14 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1brz n LYS 15 N -1.38 0.00 -1.07 4.33 3.00 -1.26 -5.11 118.16 116.67 1brz n LYS 15 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.35 1brz n LYS 15 Cb 0.11 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.14 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 1.32 0.00 0.00 0.00 6.02 -1.26 -5.04 117.38 118.41 1brz n GLN 17 Ca 0.00 -0.07 0.00 0.00 -0.01 0.00 0.00 57.00 56.92 1brz n GLN 17 Cb 0.04 -0.40 0.00 0.00 1.02 0.00 0.00 30.24 30.90 1brz n GLN 17 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1brz n LEU 18 N 0.00 0.00 0.00 1.08 4.77 -1.26 -5.14 117.00 116.45 1brz n LEU 18 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1brz n LEU 18 Cb 0.29 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.38 1brz n LEU 18 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.39 176.06 1brz n ALA 19 N -1.50 0.00 -1.00 -1.18 0.00 -1.26 -4.56 120.51 111.01 1brz n ALA 19 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1brz n ALA 19 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 -4.94 115.26 113.11 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 -0.41 0.00 -0.37 1.20 -0.06 -1.26 0.28 117.38 116.76 1brz n GLN 21 Ca 0.00 0.70 -0.01 0.00 -2.00 0.00 0.00 57.00 55.69 1brz n GLN 21 Cb 0.00 -1.36 0.12 0.00 -4.06 0.00 0.00 30.24 24.94 1brz n GLN 21 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1brz h ASN 23 N 1.30 -0.61 -0.87 0.00 -0.73 -1.76 0.18 115.58 113.09 1brz h ASN 23 Ca 0.38 0.06 0.15 0.00 1.87 0.00 0.00 56.30 58.76 1brz h ASN 23 Cb -0.07 0.21 -0.09 0.00 0.27 0.00 0.00 38.32 38.64 1brz h ASN 23 CO -0.10 -0.25 0.46 0.22 -0.37 0.00 0.00 177.43 177.38 1brz h TYR 24 N -0.37 0.81 0.08 0.67 3.20 -0.08 0.77 116.97 122.06 1brz h TYR 24 Ca -0.02 0.03 0.01 0.00 3.14 0.00 0.00 58.73 61.90 1brz h TYR 24 Cb 0.34 -0.23 -0.05 0.00 1.54 0.00 0.00 36.73 38.33 1brz h TYR 24 CO -0.24 0.20 -0.50 -0.44 -1.64 0.00 0.00 178.16 175.54 1brz h ASP 25 N 0.65 -1.51 -0.26 -2.11 3.32 -0.29 0.19 116.42 116.41 1brz h ASP 25 Ca 0.47 0.16 0.05 0.00 0.02 0.00 0.00 57.03 57.74 1brz h ASP 25 Cb 0.67 0.56 -0.05 0.00 0.22 0.00 0.00 39.33 40.73 1brz h ASP 25 CO -0.36 -0.51 -0.06 0.00 -1.72 0.00 0.00 179.24 176.59 1brz n LYS 27 N -5.22 0.20 0.08 0.00 4.76 0.20 -0.56 118.16 117.62 1brz n LYS 27 Ca -0.01 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.43 1brz n LYS 27 Cb 0.15 -1.08 0.00 0.00 -1.84 0.00 0.00 35.03 32.26 1brz n LYS 27 CO 0.00 0.00 0.00 -0.11 -1.37 0.00 0.00 177.40 175.92 1brz n LEU 28 N 0.18 -1.44 0.05 -0.35 -0.00 0.42 -4.69 117.00 111.18 1brz n LEU 28 Ca 0.00 0.37 0.08 0.00 -0.00 0.00 0.00 56.01 56.45 1brz n LEU 28 Cb 0.04 1.59 0.34 0.00 -0.00 0.00 0.00 43.42 45.39 1brz n LEU 28 CO 0.00 -0.09 0.74 0.47 -0.00 0.00 0.00 177.39 178.51 1brz n ASP 29 N -2.80 0.24 -1.19 1.96 8.00 1.35 -2.64 116.55 121.47 1brz n ASP 29 Ca 0.00 0.57 0.03 0.00 0.71 0.00 0.00 54.79 56.10 1brz n ASP 29 Cb 0.00 -0.62 0.02 0.00 -0.02 0.00 0.00 41.12 40.51 1brz n ASP 29 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1brz n LYS 30 N -1.77 0.06 -3.48 -1.24 5.02 -1.14 -4.97 118.16 110.64 1brz n LYS 30 Ca 0.02 -1.78 -0.27 0.00 -2.02 0.00 0.00 58.31 54.26 1brz n LYS 30 Cb 0.15 -0.20 -0.05 0.00 -0.02 0.00 0.00 35.03 34.91 1brz n LYS 30 CO 0.00 0.00 0.00 -2.39 -0.52 0.00 0.00 177.40 174.49 1brz n HIS 31 N 0.29 -0.95 -2.13 2.13 -0.00 -1.08 -4.85 115.22 108.63 1brz n HIS 31 Ca 0.05 0.43 -0.28 0.00 -0.00 0.00 0.00 57.72 57.92 1brz n HIS 31 Cb 1.01 -1.27 0.15 0.00 -0.00 0.00 0.00 29.99 29.87 1brz n HIS 31 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1brz s ALA 32 N -2.48 2.74 -0.11 1.59 0.00 0.27 -4.93 121.76 118.85 1brz s ALA 32 Ca 0.53 -1.29 0.16 0.00 0.00 0.00 0.00 51.96 51.36 1brz s ALA 32 Cb -0.31 -2.56 -0.20 0.00 0.00 0.00 0.00 23.12 20.05 1brz s ALA 32 CO 0.64 -2.03 0.60 -2.13 0.00 0.00 0.00 175.76 172.84 1brz n ARG 33 N -3.41 0.64 -3.10 0.00 0.63 0.66 -4.41 116.66 107.66 1brz n ARG 33 Ca 0.14 0.17 0.00 0.00 -0.92 0.00 0.00 57.85 57.24 1brz n ARG 33 Cb 0.60 -1.73 0.00 0.00 0.45 0.00 0.00 32.46 31.78 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 -2.87 0.00 0.00 6.15 3.41 -0.49 -4.87 113.62 114.95 1brz n SER 34 Ca -0.16 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.45 1brz n SER 34 Cb 0.96 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.91 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 -1.41 3.60 5.00 0.00 -1.26 0.89 105.19 112.02 1brz n GLY 35 Ca 0.00 -1.02 -0.04 0.00 0.00 0.00 0.00 46.02 44.96 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 -1.51 0.28 -0.55 1.61 2.12 -0.11 -4.77 118.70 115.76 1brz s GLU 36 Ca 0.00 -0.07 -0.21 0.00 0.36 0.00 0.00 54.97 55.05 1brz s GLU 36 Cb 0.00 0.13 0.06 0.00 0.26 0.00 0.00 34.13 34.58 1brz s GLU 36 CO 0.00 -0.11 0.79 0.00 -0.54 0.00 0.00 175.26 175.39 1brz s PHE 38 N 3.29 2.58 -1.23 0.00 0.40 0.61 -4.84 117.98 118.79 1brz s PHE 38 Ca 0.21 -0.24 0.22 0.00 -0.60 0.00 0.00 56.93 56.51 1brz s PHE 38 Cb -0.17 -2.59 -0.11 0.00 0.51 0.00 0.00 43.02 40.65 1brz s PHE 38 CO 0.14 -0.82 0.99 0.66 0.70 0.00 0.00 175.22 176.89 1brz n TYR 39 N -2.20 0.00 -1.02 0.36 4.01 -1.26 0.15 117.16 117.20 1brz n TYR 39 Ca 0.09 0.00 0.09 0.00 -0.16 0.00 0.00 57.90 57.93 1brz n TYR 39 Cb 0.60 -0.02 -0.05 0.00 -0.31 0.00 0.00 39.34 39.56 1brz n TYR 39 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 1brz n ASP 40 N -1.18 -4.26 0.00 7.72 5.75 -1.26 -0.35 116.55 122.97 1brz n ASP 40 Ca 0.05 0.77 0.01 0.00 -0.01 0.00 0.00 54.79 55.61 1brz n ASP 40 Cb 0.36 -3.38 0.03 0.00 -1.03 0.00 0.00 41.12 37.10 1brz n ASP 40 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1brz n GLU 41 N -3.69 0.20 -0.03 0.11 1.02 -1.26 -1.05 120.64 115.94 1brz n GLU 41 Ca -0.05 0.00 0.02 0.00 -0.02 0.00 0.00 57.16 57.11 1brz n GLU 41 Cb 0.39 -1.08 -0.12 0.00 -0.02 0.00 0.00 31.44 30.61 1brz n GLU 41 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1brz n LYS 42 N -0.58 0.89 -2.92 3.49 4.76 -1.25 -5.03 118.16 117.52 1brz n LYS 42 Ca 0.01 -0.09 -0.11 0.00 -2.87 0.00 0.00 58.31 55.24 1brz n LYS 42 Cb 0.00 -1.38 0.06 0.00 -1.84 0.00 0.00 35.03 31.87 1brz n LYS 42 CO 0.00 0.00 0.00 -2.13 -1.37 0.00 0.00 177.40 173.90 1brz n ARG 43 N -2.24 -3.88 -0.11 1.97 0.63 0.52 -4.95 116.66 108.60 1brz n ARG 43 Ca -0.11 0.59 0.00 0.00 -0.92 0.00 0.00 57.85 57.41 1brz n ARG 43 Cb 0.63 -4.74 0.00 0.00 0.45 0.00 0.00 32.46 28.80 1brz n ARG 43 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1brz n ASN 44 N -2.51 0.08 -1.68 6.15 5.03 -1.10 -5.06 115.26 116.17 1brz n ASN 44 Ca -0.17 -1.26 0.00 0.00 0.87 0.00 0.00 54.58 54.02 1brz n ASN 44 Cb 0.61 -0.05 0.00 0.00 -1.02 0.00 0.00 39.78 39.32 1brz n ASN 44 CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.26 175.32 1brz n LEU 45 N -0.03 -5.32 -3.95 3.41 7.94 -1.25 -4.91 117.00 112.90 1brz n LEU 45 Ca 0.00 2.61 -0.09 0.00 -1.11 0.00 0.00 56.01 57.42 1brz n LEU 45 Cb 0.54 -2.62 -0.09 0.00 0.53 0.00 0.00 43.42 41.77 1brz n LEU 45 CO 0.00 -1.19 -0.24 -1.10 -1.11 0.00 0.00 177.39 173.76 1brz s GLN 46 N -1.46 0.57 -0.37 1.96 -1.52 0.12 -4.80 119.66 114.17 1brz s GLN 46 Ca 0.00 -0.79 -0.15 0.00 -1.95 0.00 0.00 55.36 52.47 1brz s GLN 46 Cb 0.00 0.22 0.00 0.00 -0.22 0.00 0.00 33.01 33.01 1brz s GLN 46 CO 0.00 -0.14 0.33 0.00 -0.25 0.00 0.00 175.29 175.23 1brz s ILE 48 N 1.89 4.98 -0.39 0.00 -1.09 0.10 -0.40 121.20 126.29 1brz s ILE 48 Ca 0.09 0.69 -0.18 0.00 -2.23 0.00 0.00 60.65 59.02 1brz s ILE 48 Cb -0.17 -3.96 0.01 0.00 -1.58 0.00 0.00 42.46 36.76 1brz s ILE 48 CO 0.11 -0.13 0.49 0.00 -1.23 0.00 0.00 174.94 174.18 1brz s ASP 50 N 1.82 6.42 0.00 0.00 2.15 0.26 -1.41 116.67 125.91 1brz s ASP 50 Ca 0.16 0.54 0.00 0.00 0.43 0.00 0.00 52.55 53.68 1brz s ASP 50 Cb -0.16 -2.07 0.00 0.00 -0.30 0.00 0.00 42.92 40.39 1brz s ASP 50 CO 0.14 -0.10 0.00 -1.22 -0.17 0.00 0.00 175.17 173.83 1brz n TYR 51 N -0.71 0.00 0.08 -5.34 4.02 0.27 -0.25 117.16 115.23 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 0.54 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.86 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 -3.04 0.00 0.00 0.00 2.13 -1.26 -5.07 120.64 113.40 1brz n GLU 53 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1brz n GLU 53 Cb 0.00 -0.89 0.00 0.00 0.27 0.00 0.00 31.44 30.82 1brz n GLU 53 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38