#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 -3.00 0.00 -1.24 0.00 -1.26 -4.98 118.16 107.68 1brz n LYS 3 Ca 0.00 2.35 0.00 0.00 0.00 0.00 0.00 58.31 60.66 1brz n LYS 3 Cb 0.00 -3.00 0.00 0.00 0.00 0.00 0.00 35.03 32.03 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 0.00 0.36 -0.13 0.00 0.00 -1.26 0.92 119.74 119.63 1brz s LYS 5 Ca 0.00 -0.66 -0.09 0.00 0.00 0.00 0.00 55.97 55.22 1brz s LYS 5 Cb 0.00 0.13 0.04 0.00 0.00 0.00 0.00 37.83 38.00 1brz s LYS 5 CO 0.00 -0.06 0.32 -1.59 0.00 0.00 0.00 175.35 174.02 1brz s LYS 6 N -1.73 0.32 0.34 1.78 -2.85 -0.53 -4.96 119.74 112.11 1brz s LYS 6 Ca -0.13 0.57 -0.29 0.00 -1.00 0.00 0.00 55.97 55.13 1brz s LYS 6 Cb -0.08 0.02 -0.10 0.00 -2.06 0.00 0.00 37.83 35.61 1brz s LYS 6 CO -0.02 -0.12 1.35 0.14 0.10 0.00 0.00 175.35 176.80 1brz s VAL 7 N 0.89 2.59 -0.72 1.79 -7.23 -1.26 -1.29 120.40 115.17 1brz s VAL 7 Ca -0.06 0.59 -0.07 0.00 -1.81 0.00 0.00 61.98 60.63 1brz s VAL 7 Cb -0.07 -3.38 -0.15 0.00 0.56 0.00 0.00 36.38 33.34 1brz s VAL 7 CO -0.06 0.14 3.24 0.00 -0.31 0.00 0.00 175.10 178.10 1brz n TYR 8 N 0.81 1.19 0.00 2.82 4.19 -0.18 -4.91 117.16 121.08 1brz n TYR 8 Ca 0.00 -2.21 0.00 0.00 3.31 0.00 0.00 57.90 59.00 1brz n TYR 8 Cb 0.41 -1.93 0.00 0.00 0.49 0.00 0.00 39.34 38.31 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 2.72 0.00 -0.05 2.98 1.02 -1.26 -1.29 120.64 124.76 1brz n GLU 9 Ca 0.58 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.72 1brz n GLU 9 Cb 0.59 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 32.01 1brz n GLU 9 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 1brz n ASN 10 N -0.81 0.00 -4.68 1.62 0.23 -1.26 -4.83 115.26 105.53 1brz n ASN 10 Ca 0.00 -1.72 -0.47 0.00 -0.53 0.00 0.00 54.58 51.86 1brz n ASN 10 Cb 0.00 -0.35 -0.04 0.00 -2.08 0.00 0.00 39.78 37.30 1brz n ASN 10 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1brz n TYR 11 N 4.34 2.37 -1.50 -2.53 9.36 -0.41 -4.70 117.16 124.08 1brz n TYR 11 Ca 0.00 -0.05 -0.22 0.00 3.32 0.00 0.00 57.90 60.95 1brz n TYR 11 Cb 0.00 -2.68 -0.22 0.00 -0.63 0.00 0.00 39.34 35.81 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 6.43 0.03 -1.53 2.98 -0.02 -1.26 -4.66 135.00 136.97 1brz n PRO 12 Ca 0.21 -0.04 -0.28 0.00 -2.02 0.00 0.00 63.50 61.37 1brz n PRO 12 Cb 0.32 -1.14 -0.11 0.00 -0.02 0.00 0.00 33.50 32.55 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 5.69 -0.03 -3.65 -1.45 0.31 -1.26 -4.77 118.33 113.17 1brz n VAL 13 Ca 0.67 -0.48 0.00 0.00 -0.01 0.00 0.00 64.34 64.52 1brz n VAL 13 Cb 0.15 -1.50 -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 8.66 -0.22 0.00 4.52 1.04 -1.26 -5.06 113.70 121.37 1brz s SER 14 Ca 1.12 0.36 0.00 0.00 0.48 0.00 0.00 55.95 57.91 1brz s SER 14 Cb -0.54 1.04 0.00 0.00 0.10 0.00 0.00 66.02 66.62 1brz s SER 14 CO 0.33 -0.06 0.00 0.29 0.98 0.00 0.00 173.24 174.78 1brz n LYS 15 N 3.21 0.00 -0.88 4.02 5.02 -1.26 -4.98 118.16 123.29 1brz n LYS 15 Ca -0.17 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.12 1brz n LYS 15 Cb 0.57 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.58 1brz n LYS 15 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1brz n GLN 17 N 1.26 3.35 -2.73 0.00 6.02 -1.26 -5.00 117.38 119.02 1brz n GLN 17 Ca 0.00 -4.49 -0.01 0.00 -0.01 0.00 0.00 57.00 52.50 1brz n GLN 17 Cb 0.03 -2.22 0.00 0.00 1.02 0.00 0.00 30.24 29.07 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 -0.45 -2.92 0.00 1.08 4.77 -1.26 -4.82 117.00 113.39 1brz n LEU 18 Ca 0.38 0.32 0.00 0.00 -0.03 0.00 0.00 56.01 56.68 1brz n LEU 18 Cb 0.65 -1.30 0.00 0.00 -2.33 0.00 0.00 43.42 40.44 1brz n LEU 18 CO 0.33 -1.14 0.00 0.00 -1.33 0.00 0.00 177.39 175.25 1brz n ALA 19 N 1.13 0.00 0.00 -1.18 0.00 -1.26 -4.94 120.51 114.26 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 0.42 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.87 1brz n ALA 19 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1brz n ASN 20 N 0.00 0.00 0.00 0.00 6.94 -1.26 -4.70 115.26 116.24 1brz n ASN 20 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.56 1brz n ASN 20 Cb 0.00 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.42 1brz n ASN 20 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1brz n GLN 21 N 0.00 0.00 -0.33 -3.83 1.13 -1.26 0.63 117.38 113.71 1brz n GLN 21 Ca 0.00 0.31 0.07 0.00 -1.94 0.00 0.00 57.00 55.44 1brz n GLN 21 Cb 0.00 -1.05 0.26 0.00 0.11 0.00 0.00 30.24 29.57 1brz n GLN 21 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1brz n ASN 23 N -4.57 0.00 -0.25 0.00 5.15 -1.07 -0.67 115.26 113.85 1brz n ASN 23 Ca 0.17 0.40 0.05 0.00 -0.60 0.00 0.00 54.58 54.61 1brz n ASN 23 Cb 0.34 0.00 0.17 0.00 -0.53 0.00 0.00 39.78 39.75 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 0.10 0.07 1.20 3.20 0.19 0.33 116.97 122.06 1brz h TYR 24 Ca 0.00 0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.92 1brz h TYR 24 Cb 0.00 0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.33 1brz h TYR 24 CO 0.00 -0.17 -0.18 -0.44 -1.64 0.00 0.00 178.16 175.72 1brz h ASP 25 N 0.17 -0.55 -0.82 -2.11 5.19 -0.71 -1.52 116.42 116.07 1brz h ASP 25 Ca 0.41 0.06 0.12 0.00 -0.62 0.00 0.00 57.03 56.99 1brz h ASP 25 Cb 0.73 0.20 -0.06 0.00 0.18 0.00 0.00 39.33 40.38 1brz h ASP 25 CO -0.59 -0.20 0.53 0.00 -3.12 0.00 0.00 179.24 175.86 1brz n LYS 27 N -4.52 0.02 0.00 0.00 4.81 0.11 -0.77 118.16 117.81 1brz n LYS 27 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.59 1brz n LYS 27 Cb 0.39 -1.19 0.00 0.00 0.02 0.00 0.00 35.03 34.25 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 -0.69 0.00 0.15 3.14 7.94 0.76 -4.74 117.00 123.56 1brz n LEU 28 Ca 0.00 0.00 -0.11 0.00 -1.11 0.00 0.00 56.01 54.79 1brz n LEU 28 Cb 0.00 0.00 -0.06 0.00 0.53 0.00 0.00 43.42 43.89 1brz n LEU 28 CO 0.00 0.00 0.37 0.44 -1.11 0.00 0.00 177.39 177.09 1brz h ASP 29 N 0.00 -0.37 -0.55 1.96 3.32 0.62 -3.29 116.42 118.11 1brz h ASP 29 Ca 0.00 -0.16 -0.06 0.00 0.02 0.00 0.00 57.03 56.84 1brz h ASP 29 Cb 0.00 0.10 -0.03 0.00 0.22 0.00 0.00 39.33 39.61 1brz h ASP 29 CO 0.00 0.08 0.07 0.29 -1.72 0.00 0.00 179.24 177.96 1brz n LYS 30 N -5.09 4.17 -3.88 3.56 4.01 -1.12 -4.94 118.16 114.88 1brz n LYS 30 Ca -0.08 -3.09 -0.28 0.00 -0.51 0.00 0.00 58.31 54.34 1brz n LYS 30 Cb 0.26 -2.17 -0.07 0.00 -0.51 0.00 0.00 35.03 32.54 1brz n LYS 30 CO 0.00 0.00 0.00 -2.39 -1.11 0.00 0.00 177.40 173.90 1brz n HIS 31 N 0.16 -0.94 0.00 2.13 1.44 -0.75 -4.88 115.22 112.39 1brz n HIS 31 Ca 0.30 0.50 0.00 0.00 -2.01 0.00 0.00 57.72 56.51 1brz n HIS 31 Cb 1.19 -1.81 0.00 0.00 0.12 0.00 0.00 29.99 29.49 1brz n HIS 31 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1brz n ALA 32 N -3.52 0.00 0.00 1.59 0.00 0.05 -4.94 120.51 113.69 1brz n ALA 32 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1brz n ALA 32 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.90 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 0.00 0.12 -0.66 0.00 1.74 -0.07 -4.79 116.66 113.00 1brz n ARG 33 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1brz n ARG 33 Cb 0.00 -0.52 0.00 0.00 -1.02 0.00 0.00 32.46 30.92 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 -0.66 0.00 0.00 0.55 3.41 -0.49 -4.81 113.62 111.62 1brz n SER 34 Ca 0.00 -0.48 0.00 0.00 -0.26 0.00 0.00 58.87 58.13 1brz n SER 34 Cb 0.02 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.97 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 -1.33 3.63 5.00 0.00 -1.26 0.72 105.19 111.95 1brz n GLY 35 Ca 0.00 -0.95 -0.03 0.00 0.00 0.00 0.00 46.02 45.04 1brz n GLY 35 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1brz s GLU 36 N -0.78 0.16 -0.78 1.61 2.02 -0.07 -4.28 118.70 116.59 1brz s GLU 36 Ca 0.00 -0.01 -0.23 0.00 0.02 0.00 0.00 54.97 54.75 1brz s GLU 36 Cb 0.00 0.08 0.07 0.00 0.10 0.00 0.00 34.13 34.38 1brz s GLU 36 CO 0.00 -0.06 1.13 0.00 0.02 0.00 0.00 175.26 176.35 1brz s PHE 38 N 4.28 2.89 -0.21 0.00 0.08 0.71 -4.78 117.98 120.96 1brz s PHE 38 Ca 0.30 -0.26 0.19 0.00 0.12 0.00 0.00 56.93 57.29 1brz s PHE 38 Cb -0.10 -1.58 0.01 0.00 -0.57 0.00 0.00 43.02 40.78 1brz s PHE 38 CO 0.05 0.37 1.11 1.88 -0.10 0.00 0.00 175.22 178.53 1brz h TYR 39 N 1.46 0.00 -1.85 0.36 0.05 -1.91 0.95 116.97 116.03 1brz h TYR 39 Ca -0.45 0.00 0.15 0.00 0.05 0.00 0.00 58.73 58.48 1brz h TYR 39 Cb 1.25 0.00 -0.06 0.00 1.01 0.00 0.00 36.73 38.93 1brz h TYR 39 CO 0.58 0.28 -0.34 -0.40 -1.05 0.00 0.00 178.16 177.22 1brz n ASP 40 N -2.90 -3.54 -1.82 3.88 5.75 -1.26 -1.33 116.55 115.33 1brz n ASP 40 Ca -0.02 0.39 0.00 0.00 -0.01 0.00 0.00 54.79 55.14 1brz n ASP 40 Cb 0.67 -2.67 0.00 0.00 -1.03 0.00 0.00 41.12 38.09 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 -2.76 0.29 0.00 0.11 -0.58 -1.26 -1.89 120.64 114.55 1brz n GLU 41 Ca -0.01 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.73 1brz n GLU 41 Cb 0.57 -1.36 0.00 0.00 -0.57 0.00 0.00 31.44 30.09 1brz n GLU 41 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1brz n LYS 42 N 1.81 0.00 -3.86 3.49 5.02 -1.18 -5.06 118.16 118.39 1brz n LYS 42 Ca 0.00 0.00 -0.32 0.00 -2.02 0.00 0.00 58.31 55.97 1brz n LYS 42 Cb 0.14 -0.32 0.01 0.00 -0.02 0.00 0.00 35.03 34.85 1brz n LYS 42 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1brz n ARG 43 N 0.00 -1.05 0.00 1.97 1.74 -0.44 -4.86 116.66 114.01 1brz n ARG 43 Ca 0.00 0.53 0.00 0.00 -0.77 0.00 0.00 57.85 57.61 1brz n ARG 43 Cb 0.21 -2.61 0.00 0.00 -1.02 0.00 0.00 32.46 29.04 1brz n ARG 43 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1brz n ASN 44 N -2.43 0.06 -3.52 0.55 3.02 -1.15 -5.05 115.26 106.74 1brz n ASN 44 Ca -0.22 -1.01 -0.22 0.00 -0.03 0.00 0.00 54.58 53.11 1brz n ASN 44 Cb 0.63 0.00 0.03 0.00 -0.61 0.00 0.00 39.78 39.83 1brz n ASN 44 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 1brz n LEU 45 N -0.00 -3.86 -4.98 3.41 -0.00 -1.23 -4.99 117.00 105.35 1brz n LEU 45 Ca 0.00 -0.77 -0.20 0.00 -0.00 0.00 0.00 56.01 55.04 1brz n LEU 45 Cb 0.26 -2.56 0.03 0.00 -0.00 0.00 0.00 43.42 41.15 1brz n LEU 45 CO 0.00 0.07 0.31 -1.10 -0.00 0.00 0.00 177.39 176.66 1brz s GLN 46 N -4.98 2.63 -0.35 1.96 -0.21 0.33 -4.79 119.66 114.24 1brz s GLN 46 Ca 0.29 -0.90 -0.16 0.00 0.02 0.00 0.00 55.36 54.62 1brz s GLN 46 Cb -0.09 -2.56 -0.01 0.00 1.00 0.00 0.00 33.01 31.35 1brz s GLN 46 CO 0.83 -0.59 0.39 0.00 -2.12 0.00 0.00 175.29 173.80 1brz s ILE 48 N 2.08 5.09 -0.37 0.00 1.01 0.11 -1.02 121.20 128.10 1brz s ILE 48 Ca 0.13 1.07 -0.13 0.00 0.00 0.00 0.00 60.65 61.72 1brz s ILE 48 Cb -0.16 -3.86 0.00 0.00 0.01 0.00 0.00 42.46 38.44 1brz s ILE 48 CO 0.12 0.36 0.25 0.00 0.00 0.00 0.00 174.94 175.67 1brz s ASP 50 N 1.68 6.49 0.00 0.00 -1.08 0.22 -1.45 116.67 122.53 1brz s ASP 50 Ca 0.05 0.65 0.00 0.00 -0.52 0.00 0.00 52.55 52.73 1brz s ASP 50 Cb -0.18 -2.11 0.00 0.00 -1.46 0.00 0.00 42.92 39.17 1brz s ASP 50 CO 0.09 -0.05 0.00 -1.22 0.52 0.00 0.00 175.17 174.52 1brz n TYR 51 N -0.34 0.00 0.00 -5.34 4.02 0.26 -0.89 117.16 114.87 1brz n TYR 51 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.87 1brz n TYR 51 Cb 0.53 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.85 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 2.13 -1.26 -4.93 120.64 116.58 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 -0.93 0.00 0.00 0.27 0.00 0.00 31.44 30.78 1brz n GLU 53 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38