#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 -2.71 -0.67 3.00 -1.26 -4.59 118.16 111.93 1brz n LYS 3 Ca 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 58.31 58.26 1brz n LYS 3 Cb 0.00 0.00 0.08 0.00 0.00 0.00 0.00 35.03 35.11 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 -1.70 0.19 -0.21 0.00 2.36 -1.26 -1.29 119.74 117.83 1brz s LYS 5 Ca 0.22 0.47 -0.04 0.00 -2.55 0.00 0.00 55.97 54.07 1brz s LYS 5 Cb 0.41 -0.10 0.11 0.00 -1.05 0.00 0.00 37.83 37.20 1brz s LYS 5 CO -0.04 -0.14 0.35 0.21 1.55 0.00 0.00 175.35 177.27 1brz s LYS 6 N 1.08 0.29 0.18 4.03 2.20 -0.19 -5.00 119.74 122.32 1brz s LYS 6 Ca -0.08 0.67 -0.31 0.00 -0.36 0.00 0.00 55.97 55.88 1brz s LYS 6 Cb -0.09 -0.27 -0.10 0.00 -1.51 0.00 0.00 37.83 35.85 1brz s LYS 6 CO -0.07 -0.48 1.54 0.14 -0.36 0.00 0.00 175.35 176.12 1brz s VAL 7 N 2.52 2.65 -0.90 4.02 -7.23 -1.26 -1.26 120.40 118.94 1brz s VAL 7 Ca 0.06 0.48 -0.12 0.00 -1.81 0.00 0.00 61.98 60.59 1brz s VAL 7 Cb -0.14 -3.31 -0.09 0.00 0.56 0.00 0.00 36.38 33.40 1brz s VAL 7 CO -0.13 0.04 2.06 0.00 -0.31 0.00 0.00 175.10 176.77 1brz n TYR 8 N 3.66 1.68 0.00 2.82 4.19 -0.14 -4.88 117.16 124.48 1brz n TYR 8 Ca 0.12 -1.98 0.00 0.00 3.31 0.00 0.00 57.90 59.36 1brz n TYR 8 Cb 0.39 -1.74 0.00 0.00 0.49 0.00 0.00 39.34 38.48 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 5.34 0.00 0.00 2.98 1.02 -1.26 -1.27 120.64 127.45 1brz n GLU 9 Ca 0.48 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.62 1brz n GLU 9 Cb 0.25 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.67 1brz n GLU 9 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1brz n ASN 10 N -1.85 0.00 -4.59 1.62 4.05 -1.26 -4.83 115.26 108.40 1brz n ASN 10 Ca 0.00 -1.34 -0.41 0.00 0.45 0.00 0.00 54.58 53.28 1brz n ASN 10 Cb 0.00 0.00 0.02 0.00 1.23 0.00 0.00 39.78 41.03 1brz n ASN 10 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1brz n TYR 11 N 2.73 0.83 0.00 1.20 4.19 -0.40 -4.97 117.16 120.74 1brz n TYR 11 Ca 0.00 0.53 0.00 0.00 3.31 0.00 0.00 57.90 61.74 1brz n TYR 11 Cb 0.00 -2.17 0.00 0.00 0.49 0.00 0.00 39.34 37.66 1brz n TYR 11 CO 0.00 0.00 0.00 -2.30 0.91 0.00 0.00 176.86 175.47 1brz n PRO 12 N -0.01 3.24 0.00 2.98 -0.02 -1.26 -4.87 135.00 135.07 1brz n PRO 12 Ca 0.10 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.58 1brz n PRO 12 Cb 0.41 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.89 1brz n PRO 12 CO 0.00 0.00 0.00 1.55 1.98 0.00 0.00 175.50 179.03 1brz n VAL 13 N 0.00 0.00 0.23 -1.45 3.14 -1.26 -4.84 118.33 114.14 1brz n VAL 13 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 1brz n VAL 13 Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.78 1brz n VAL 13 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 1brz n SER 14 N 0.00 0.20 -3.15 6.55 3.41 -1.26 -4.19 113.62 115.18 1brz n SER 14 Ca 0.00 -0.42 0.05 0.00 -0.26 0.00 0.00 58.87 58.24 1brz n SER 14 Cb 0.00 -0.10 -0.01 0.00 -0.26 0.00 0.00 64.21 63.84 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 -1.07 0.17 0.00 4.33 2.20 -1.26 -5.14 119.74 118.97 1brz s LYS 15 Ca 0.00 0.23 0.00 0.00 -0.36 0.00 0.00 55.97 55.84 1brz s LYS 15 Cb 0.00 0.12 0.00 0.00 -1.51 0.00 0.00 37.83 36.44 1brz s LYS 15 CO 0.00 -0.26 0.00 0.00 -0.36 0.00 0.00 175.35 174.73 1brz n GLN 17 N 0.00 0.00 -2.67 0.00 1.13 -1.26 -5.05 117.38 109.53 1brz n GLN 17 Ca 0.00 0.00 0.02 0.00 -1.94 0.00 0.00 57.00 55.08 1brz n GLN 17 Cb 0.00 -0.31 0.01 0.00 0.11 0.00 0.00 30.24 30.05 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 -6.18 -0.05 0.00 1.08 1.43 -1.26 -4.93 118.68 108.76 1brz s LEU 18 Ca 0.00 -0.03 0.00 0.00 -1.03 0.00 0.00 54.13 53.07 1brz s LEU 18 Cb 0.00 0.07 0.00 0.00 0.03 0.00 0.00 46.19 46.29 1brz s LEU 18 CO 0.00 -0.01 0.00 0.00 0.23 0.00 0.00 176.35 176.57 1brz n ALA 19 N 3.47 0.00 -0.34 4.21 0.00 -1.26 -4.98 120.51 121.62 1brz n ALA 19 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.49 1brz n ALA 19 Cb 0.65 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.10 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 -0.29 0.00 0.00 0.00 4.05 -1.26 -4.54 115.26 113.22 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 0.00 -3.05 0.00 0.00 177.26 174.21 1brz n GLN 21 N 0.00 0.00 -0.36 1.20 3.00 -1.26 0.56 117.38 120.52 1brz n GLN 21 Ca 0.00 0.24 0.01 0.00 -0.01 0.00 0.00 57.00 57.23 1brz n GLN 21 Cb 0.00 -0.71 0.15 0.00 0.00 0.00 0.00 30.24 29.67 1brz n GLN 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1brz n ASN 23 N -4.49 0.00 -0.01 0.00 5.15 -1.00 -0.21 115.26 114.71 1brz n ASN 23 Ca 0.14 0.98 -0.10 0.00 -0.60 0.00 0.00 54.58 55.00 1brz n ASN 23 Cb 0.13 -0.48 -0.04 0.00 -0.53 0.00 0.00 39.78 38.86 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 -0.83 -0.03 1.20 3.20 0.11 0.16 116.97 120.78 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 0.00 0.39 -0.05 0.00 1.54 0.00 0.00 36.73 38.60 1brz h TYR 24 CO -0.17 -0.38 -0.50 -0.44 -1.64 0.00 0.00 178.16 175.02 1brz h ASP 25 N -0.36 -1.57 -0.64 -2.11 5.19 -1.36 0.17 116.42 115.74 1brz h ASP 25 Ca 0.10 0.18 0.14 0.00 -0.62 0.00 0.00 57.03 56.83 1brz h ASP 25 Cb 0.53 0.60 -0.04 0.00 0.18 0.00 0.00 39.33 40.60 1brz h ASP 25 CO -0.36 -0.48 0.44 0.00 -3.12 0.00 0.00 179.24 175.72 1brz n LYS 27 N -4.44 0.00 0.00 0.00 3.00 0.59 -0.89 118.16 116.42 1brz n LYS 27 Ca 0.12 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.43 1brz n LYS 27 Cb 0.51 -1.48 0.00 0.00 0.00 0.00 0.00 35.03 34.06 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 -0.97 0.00 0.21 3.14 -0.00 0.78 -4.70 117.00 115.47 1brz n LEU 28 Ca 0.00 0.00 0.15 0.00 -0.00 0.00 0.00 56.01 56.16 1brz n LEU 28 Cb 0.00 0.00 0.69 0.00 -0.00 0.00 0.00 43.42 44.11 1brz n LEU 28 CO 0.00 0.00 0.94 0.44 -0.00 0.00 0.00 177.39 178.77 1brz h ASP 29 N 0.00 0.00 0.00 1.96 5.19 0.66 -3.13 116.42 121.10 1brz h ASP 29 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1brz h ASP 29 Cb 0.00 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.51 1brz h ASP 29 CO 0.00 0.00 0.00 0.29 -3.12 0.00 0.00 179.24 176.41 1brz n LYS 30 N -2.59 0.00 -3.51 3.56 4.76 -1.21 -4.95 118.16 114.21 1brz n LYS 30 Ca -0.00 -0.26 -0.26 0.00 -2.87 0.00 0.00 58.31 54.93 1brz n LYS 30 Cb 0.17 -0.44 0.01 0.00 -1.84 0.00 0.00 35.03 32.93 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 0.00 -1.95 -1.71 2.13 8.25 -1.01 -4.95 115.22 115.98 1brz n HIS 31 Ca 0.00 0.61 0.00 0.00 -0.26 0.00 0.00 57.72 58.07 1brz n HIS 31 Cb 0.40 -3.44 0.00 0.00 1.12 0.00 0.00 29.99 28.07 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 -3.88 0.00 0.01 -1.41 0.00 -0.06 -4.95 120.51 110.21 1brz n ALA 32 Ca -0.01 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.52 1brz n ALA 32 Cb 0.55 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.86 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 -0.98 0.65 -3.43 0.00 3.00 0.40 -4.60 116.66 111.70 1brz n ARG 33 Ca 0.00 -0.11 0.00 0.00 -0.00 0.00 0.00 57.85 57.74 1brz n ARG 33 Cb 0.00 -1.59 0.00 0.00 0.00 0.00 0.00 32.46 30.87 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 -2.39 0.00 -2.58 6.15 3.41 0.19 -4.94 113.62 113.46 1brz n SER 34 Ca -0.05 0.00 0.02 0.00 -0.26 0.00 0.00 58.87 58.58 1brz n SER 34 Cb 0.62 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.57 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 0.24 3.60 5.00 0.00 -1.26 0.14 105.19 112.92 1brz n GLY 35 Ca 0.00 -0.91 -0.04 0.00 0.00 0.00 0.00 46.02 45.06 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 -2.00 0.26 -0.07 1.61 2.56 0.38 -4.18 118.70 117.26 1brz s GLU 36 Ca 0.17 -0.08 -0.22 0.00 0.00 0.00 0.00 54.97 54.84 1brz s GLU 36 Cb -0.00 0.12 -0.04 0.00 2.00 0.00 0.00 34.13 36.21 1brz s GLU 36 CO -0.01 -0.11 0.66 0.00 -0.56 0.00 0.00 175.26 175.23 1brz s PHE 38 N 0.66 0.33 0.71 0.00 0.08 0.18 -4.94 117.98 115.00 1brz s PHE 38 Ca 0.35 -0.68 -0.10 0.00 0.12 0.00 0.00 56.93 56.62 1brz s PHE 38 Cb -0.17 0.03 0.04 0.00 -0.57 0.00 0.00 43.02 42.35 1brz s PHE 38 CO 0.17 -0.78 1.07 0.71 -0.10 0.00 0.00 175.22 176.29 1brz s TYR 39 N -3.96 3.15 -0.53 0.36 1.51 -1.24 0.06 117.35 116.69 1brz s TYR 39 Ca 0.17 0.81 0.04 0.00 -1.01 0.00 0.00 57.07 57.07 1brz s TYR 39 Cb 0.02 -3.15 0.14 0.00 -0.11 0.00 0.00 41.96 38.87 1brz s TYR 39 CO 0.01 -1.32 0.31 0.16 -1.11 0.00 0.00 175.55 173.60 1brz s ASP 40 N -4.43 4.04 -0.12 2.29 -4.77 -1.26 -4.83 116.67 107.58 1brz s ASP 40 Ca 0.59 -3.09 -0.01 0.00 -3.30 0.00 0.00 52.55 46.74 1brz s ASP 40 Cb -0.11 -1.37 0.01 0.00 -1.09 0.00 0.00 42.92 40.37 1brz s ASP 40 CO 0.49 -0.20 0.03 -0.62 0.70 0.00 0.00 175.17 175.57 1brz n GLU 41 N 2.97 -0.98 0.00 2.11 1.02 -1.26 -4.19 120.64 120.30 1brz n GLU 41 Ca 0.11 0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.26 1brz n GLU 41 Cb 0.34 -0.29 0.00 0.00 -0.02 0.00 0.00 31.44 31.48 1brz n GLU 41 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1brz n LYS 42 N -0.78 0.00 0.00 3.49 4.81 -1.26 -5.09 118.16 119.33 1brz n LYS 42 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1brz n LYS 42 Cb 0.03 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.08 1brz n LYS 42 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 1brz n ARG 43 N -1.53 0.00 -0.79 1.64 1.74 -1.26 -5.18 116.66 111.28 1brz n ARG 43 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1brz n ARG 43 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 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 0.00 0.00 -3.08 0.55 3.02 -1.26 -5.00 115.26 109.49 1brz n ASN 44 Ca 0.00 -0.41 -0.12 0.00 -0.03 0.00 0.00 54.58 54.03 1brz n ASN 44 Cb 0.00 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.13 1brz n ASN 44 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1brz s LEU 45 N 0.00 -0.46 0.49 3.41 2.96 -1.26 -3.71 118.68 120.11 1brz s LEU 45 Ca 0.00 -1.97 -0.00 0.00 -0.22 0.00 0.00 54.13 51.94 1brz s LEU 45 Cb 0.00 1.06 0.01 0.00 0.50 0.00 0.00 46.19 47.75 1brz s LEU 45 CO 0.00 -0.13 0.72 -1.10 -1.32 0.00 0.00 176.35 174.52 1brz s GLN 46 N 0.85 2.94 -0.42 1.98 -0.21 0.11 -4.73 119.66 120.17 1brz s GLN 46 Ca 0.27 -0.49 -0.19 0.00 0.02 0.00 0.00 55.36 54.98 1brz s GLN 46 Cb -0.02 -2.51 0.02 0.00 1.00 0.00 0.00 33.01 31.50 1brz s GLN 46 CO -0.09 -0.42 0.55 0.00 -2.12 0.00 0.00 175.29 173.21 1brz s ILE 48 N 2.50 5.00 -0.38 0.00 1.09 0.12 -0.97 121.20 128.58 1brz s ILE 48 Ca 0.18 1.18 -0.19 0.00 -1.10 0.00 0.00 60.65 60.72 1brz s ILE 48 Cb -0.15 -3.95 0.00 0.00 -1.06 0.00 0.00 42.46 37.31 1brz s ILE 48 CO 0.16 0.08 0.53 0.00 -0.10 0.00 0.00 174.94 175.62 1brz s ASP 50 N 1.81 6.69 -0.00 0.00 2.15 0.37 -1.03 116.67 126.66 1brz s ASP 50 Ca 0.19 0.82 0.14 0.00 0.43 0.00 0.00 52.55 54.13 1brz s ASP 50 Cb -0.15 -2.20 -0.16 0.00 -0.30 0.00 0.00 42.92 40.10 1brz s ASP 50 CO 0.14 0.35 0.53 -1.22 -0.17 0.00 0.00 175.17 174.80 1brz n TYR 51 N 1.89 0.00 0.00 -5.34 4.02 -0.41 0.57 117.16 117.89 1brz n TYR 51 Ca -0.16 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.73 1brz n TYR 51 Cb 0.53 -0.06 0.00 0.00 -0.02 0.00 0.00 39.34 39.79 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 -4.91 120.64 116.59 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 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 1brz n GLU 53 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38