#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 3.06 0.00 0.11 1.02 -1.26 -4.96 119.74 117.71 1brz s LYS 3 Ca 0.00 -0.82 0.00 0.00 0.02 0.00 0.00 55.97 55.17 1brz s LYS 3 Cb 0.00 -2.54 0.00 0.00 -0.52 0.00 0.00 37.83 34.77 1brz s LYS 3 CO 0.00 -0.08 0.00 0.00 -0.92 0.00 0.00 175.35 174.35 1brz s LYS 5 N 0.00 4.07 -0.12 0.00 0.00 -1.26 -0.41 119.74 122.01 1brz s LYS 5 Ca 0.00 0.33 -0.07 0.00 0.00 0.00 0.00 55.97 56.24 1brz s LYS 5 Cb 0.00 -3.31 0.05 0.00 0.00 0.00 0.00 37.83 34.57 1brz s LYS 5 CO 0.00 0.48 0.29 -1.59 0.00 0.00 0.00 175.35 174.53 1brz s LYS 6 N -0.35 0.26 0.12 1.78 -2.85 -0.45 -4.96 119.74 113.29 1brz s LYS 6 Ca 0.22 0.59 -0.31 0.00 -1.00 0.00 0.00 55.97 55.47 1brz s LYS 6 Cb -0.15 -0.08 -0.09 0.00 -2.06 0.00 0.00 37.83 35.44 1brz s LYS 6 CO 0.10 -0.16 1.61 0.14 0.10 0.00 0.00 175.35 177.15 1brz s VAL 7 N 1.24 2.81 -2.00 1.79 -7.23 -1.26 -1.42 120.40 114.33 1brz s VAL 7 Ca -0.09 0.46 0.17 0.00 -1.81 0.00 0.00 61.98 60.71 1brz s VAL 7 Cb -0.09 -3.29 0.49 0.00 0.56 0.00 0.00 36.38 34.05 1brz s VAL 7 CO -0.09 0.02 1.50 0.00 -0.31 0.00 0.00 175.10 176.21 1brz n TYR 8 N 4.74 0.00 0.00 2.82 4.19 0.66 -4.92 117.16 124.65 1brz n TYR 8 Ca 0.15 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.36 1brz n TYR 8 Cb 0.39 0.00 0.00 0.00 0.49 0.00 0.00 39.34 40.22 1brz n TYR 8 CO 0.00 0.00 0.00 -0.85 0.91 0.00 0.00 176.86 176.92 1brz n GLU 9 N -0.87 0.00 0.00 2.98 0.28 -1.26 -4.72 120.64 117.04 1brz n GLU 9 Ca 0.13 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.13 1brz n GLU 9 Cb 0.06 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.93 1brz n GLU 9 CO 0.00 0.00 0.00 -1.71 -0.16 0.00 0.00 177.13 175.26 1brz n ASN 10 N -2.51 0.00 -3.65 -1.84 5.15 -1.26 -4.90 115.26 106.26 1brz n ASN 10 Ca 0.00 0.00 -0.00 0.00 -0.60 0.00 0.00 54.58 53.98 1brz n ASN 10 Cb 0.00 0.00 -0.06 0.00 -0.53 0.00 0.00 39.78 39.19 1brz n ASN 10 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 1brz s TYR 11 N 0.00 -0.16 0.00 1.20 6.14 -1.26 -5.03 117.35 118.24 1brz s TYR 11 Ca 0.00 0.33 -0.02 0.00 0.64 0.00 0.00 57.07 58.02 1brz s TYR 11 Cb 0.00 0.22 -0.11 0.00 0.42 0.00 0.00 41.96 42.49 1brz s TYR 11 CO 0.00 -0.08 1.92 -0.35 0.64 0.00 0.00 175.55 177.68 1brz n PRO 12 N 2.72 0.95 -1.80 4.97 -0.04 -1.26 -4.75 135.00 135.79 1brz n PRO 12 Ca -0.15 -0.40 0.00 0.00 -0.04 0.00 0.00 63.50 62.91 1brz n PRO 12 Cb 0.57 -1.63 0.00 0.00 -0.04 0.00 0.00 33.50 32.40 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 2.45 0.00 0.00 0.52 0.31 -1.26 -4.80 118.33 115.55 1brz n VAL 13 Ca 0.17 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.50 1brz n VAL 13 Cb 0.44 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.37 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 0.33 0.00 -4.73 4.52 3.41 -1.26 -4.92 113.62 110.98 1brz n SER 14 Ca 0.00 0.00 -0.31 0.00 -0.26 0.00 0.00 58.87 58.30 1brz n SER 14 Cb 0.00 0.00 0.12 0.00 -0.26 0.00 0.00 64.21 64.07 1brz n SER 14 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1brz s LYS 15 N 0.00 1.68 -0.32 4.33 1.02 -1.26 -5.04 119.74 120.15 1brz s LYS 15 Ca 0.00 1.17 -0.08 0.00 0.02 0.00 0.00 55.97 57.09 1brz s LYS 15 Cb 0.00 -1.83 0.19 0.00 -0.52 0.00 0.00 37.83 35.67 1brz s LYS 15 CO 0.00 -2.05 0.99 0.00 -0.92 0.00 0.00 175.35 173.37 1brz n GLN 17 N 4.32 0.00 -2.47 0.00 1.13 -1.26 -4.98 117.38 114.12 1brz n GLN 17 Ca 0.07 0.00 -0.42 0.00 -1.94 0.00 0.00 57.00 54.71 1brz n GLN 17 Cb 0.60 0.00 -0.03 0.00 0.11 0.00 0.00 30.24 30.93 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 0.00 4.28 -0.82 1.08 1.43 -1.26 -4.89 118.68 118.50 1brz s LEU 18 Ca 0.00 1.81 -0.22 0.00 -1.03 0.00 0.00 54.13 54.69 1brz s LEU 18 Cb 0.00 -3.56 -0.19 0.00 0.03 0.00 0.00 46.19 42.47 1brz s LEU 18 CO 0.00 -0.57 2.37 0.00 0.23 0.00 0.00 176.35 178.38 1brz n ALA 19 N 5.13 0.62 -2.00 4.21 0.00 -1.26 -4.37 120.51 122.83 1brz n ALA 19 Ca 0.11 -1.08 0.00 0.00 0.00 0.00 0.00 53.44 52.46 1brz n ALA 19 Cb 0.46 -2.95 0.00 0.00 0.00 0.00 0.00 19.45 16.96 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 14.06 0.00 0.00 0.00 2.85 -1.26 -4.90 115.26 126.01 1brz n ASN 20 Ca 0.53 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 55.00 1brz n ASN 20 Cb 0.33 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.35 1brz n ASN 20 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1brz n GLN 21 N 0.00 0.00 0.26 1.20 1.13 -1.26 0.23 117.38 118.94 1brz n GLN 21 Ca 0.00 0.00 -0.16 0.00 -1.94 0.00 0.00 57.00 54.90 1brz n GLN 21 Cb 0.00 0.00 -0.08 0.00 0.11 0.00 0.00 30.24 30.27 1brz n GLN 21 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1brz h ASN 23 N -0.72 -1.26 0.04 0.00 -0.00 0.26 0.46 115.58 114.36 1brz h ASN 23 Ca -0.05 0.12 0.03 0.00 -0.00 0.00 0.00 56.30 56.40 1brz h ASN 23 Cb 0.60 0.44 -0.05 0.00 -0.00 0.00 0.00 38.32 39.31 1brz h ASN 23 CO 0.03 -0.52 -0.43 0.22 -0.00 0.00 0.00 177.43 176.73 1brz h TYR 24 N -0.75 -1.22 -0.31 0.67 3.20 0.01 0.26 116.97 118.83 1brz h TYR 24 Ca -0.03 0.04 0.07 0.00 3.14 0.00 0.00 58.73 61.95 1brz h TYR 24 Cb 0.70 0.53 -0.08 0.00 1.54 0.00 0.00 36.73 39.41 1brz h TYR 24 CO -0.32 -0.51 -0.28 -0.44 -1.64 0.00 0.00 178.16 174.97 1brz h ASP 25 N -0.61 -0.90 -0.37 -2.11 3.32 -0.96 -1.13 116.42 113.65 1brz h ASP 25 Ca 0.03 0.16 0.03 0.00 0.02 0.00 0.00 57.03 57.28 1brz h ASP 25 Cb 0.67 0.42 -0.03 0.00 0.22 0.00 0.00 39.33 40.61 1brz h ASP 25 CO -0.29 -0.30 0.17 0.00 -1.72 0.00 0.00 179.24 177.09 1brz n LYS 27 N -4.96 0.06 0.00 0.00 5.02 0.88 -0.14 118.16 119.01 1brz n LYS 27 Ca 0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.30 1brz n LYS 27 Cb 0.11 -1.00 0.00 0.00 -0.02 0.00 0.00 35.03 34.11 1brz n LYS 27 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1brz n LEU 28 N -0.40 0.00 0.00 -0.35 7.94 0.86 -4.55 117.00 120.50 1brz n LEU 28 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 1brz n LEU 28 Cb 0.00 0.00 0.00 0.00 0.53 0.00 0.00 43.42 43.95 1brz n LEU 28 CO 0.00 0.00 0.00 0.47 -1.11 0.00 0.00 177.39 176.75 1brz n ASP 29 N 0.00 0.00 -0.48 1.96 9.92 -1.00 0.35 116.55 127.30 1brz n ASP 29 Ca 0.00 0.00 0.10 0.00 -0.53 0.00 0.00 54.79 54.36 1brz n ASP 29 Cb 0.00 0.00 -0.00 0.00 -0.64 0.00 0.00 41.12 40.48 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 0.00 1.35 -2.30 -1.24 5.02 -1.26 -5.01 118.16 114.72 1brz n LYS 30 Ca 0.00 -0.99 -0.03 0.00 -2.02 0.00 0.00 58.31 55.27 1brz n LYS 30 Cb 0.00 -1.43 0.01 0.00 -0.02 0.00 0.00 35.03 33.59 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 0.01 -1.36 -1.33 2.13 8.25 1.08 -5.08 115.22 118.92 1brz n HIS 31 Ca 0.09 0.50 0.00 0.00 -0.26 0.00 0.00 57.72 58.05 1brz n HIS 31 Cb 0.44 -2.99 0.00 0.00 1.12 0.00 0.00 29.99 28.56 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 -1.77 0.00 -0.09 -1.41 0.00 0.80 -4.87 120.51 113.16 1brz n ALA 32 Ca -0.01 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.29 1brz n ALA 32 Cb 0.52 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.83 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 -0.31 0.68 -1.78 0.00 0.63 0.26 -4.60 116.66 111.54 1brz n ARG 33 Ca 0.00 0.10 0.00 0.00 -0.92 0.00 0.00 57.85 57.03 1brz n ARG 33 Cb 0.00 -1.57 0.00 0.00 0.45 0.00 0.00 32.46 31.34 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 -3.01 0.00 -3.55 6.15 3.41 0.15 -4.79 113.62 111.98 1brz n SER 34 Ca -0.35 -0.97 -0.10 0.00 -0.26 0.00 0.00 58.87 57.18 1brz n SER 34 Cb 1.08 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 65.01 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 -2.60 0.66 -0.28 5.00 0.00 -1.26 -0.08 107.32 108.76 1brz s GLY 35 Ca 0.00 -0.94 -0.27 0.00 0.00 0.00 0.00 44.72 43.52 1brz s GLY 35 CO 0.00 -0.58 1.35 1.85 0.00 0.00 0.00 173.10 175.72 1brz s GLU 36 N -3.38 0.14 0.38 2.90 2.12 0.42 -4.55 118.70 116.74 1brz s GLU 36 Ca 0.21 0.12 -0.05 0.00 0.36 0.00 0.00 54.97 55.61 1brz s GLU 36 Cb -0.02 0.07 -0.05 0.00 0.26 0.00 0.00 34.13 34.39 1brz s GLU 36 CO 0.12 -0.03 0.66 0.00 -0.54 0.00 0.00 175.26 175.47 1brz s PHE 38 N -2.37 -0.24 0.75 0.00 0.08 -0.04 -4.89 117.98 111.27 1brz s PHE 38 Ca 0.46 0.56 -0.07 0.00 0.12 0.00 0.00 56.93 57.99 1brz s PHE 38 Cb -0.10 0.08 0.10 0.00 -0.57 0.00 0.00 43.02 42.53 1brz s PHE 38 CO 0.36 -0.18 1.05 0.71 -0.10 0.00 0.00 175.22 177.06 1brz s TYR 39 N -0.20 2.37 0.52 0.36 2.02 -1.26 0.46 117.35 121.62 1brz s TYR 39 Ca -0.03 0.23 0.01 0.00 -0.37 0.00 0.00 57.07 56.91 1brz s TYR 39 Cb -0.03 -3.30 -0.00 0.00 -0.40 0.00 0.00 41.96 38.23 1brz s TYR 39 CO 0.01 -1.68 0.05 0.16 -1.57 0.00 0.00 175.55 172.52 1brz s ASP 40 N -4.63 4.20 0.00 2.29 -4.77 -0.01 -4.87 116.67 108.88 1brz s ASP 40 Ca 0.64 -1.63 0.00 0.00 -3.30 0.00 0.00 52.55 48.26 1brz s ASP 40 Cb -0.08 0.56 0.00 0.00 -1.09 0.00 0.00 42.92 42.31 1brz s ASP 40 CO 0.46 -0.90 0.22 -1.84 0.70 0.00 0.00 175.17 173.80 1brz n GLU 41 N -1.33 0.28 0.00 2.11 0.28 -1.26 -3.72 120.64 116.99 1brz n GLU 41 Ca -0.18 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.82 1brz n GLU 41 Cb 0.67 -1.26 0.00 0.00 1.43 0.00 0.00 31.44 32.28 1brz n GLU 41 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 177.13 178.14 1brz n LYS 42 N 0.63 0.00 -0.01 3.44 3.00 -1.26 -5.05 118.16 118.91 1brz n LYS 42 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 1brz n LYS 42 Cb 0.11 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.14 1brz n LYS 42 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.40 175.27 1brz n ARG 43 N -1.33 0.00 -3.29 1.64 0.00 -1.24 -5.14 116.66 107.29 1brz n ARG 43 Ca 0.00 0.00 -0.38 0.00 -0.00 0.00 0.00 57.85 57.47 1brz n ARG 43 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 32.46 32.40 1brz n ARG 43 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.63 176.83 1brz s ASN 44 N 0.00 6.83 0.42 6.15 -0.87 -1.26 -4.81 114.94 121.39 1brz s ASN 44 Ca 0.00 0.99 -0.02 0.00 -1.57 0.00 0.00 52.86 52.26 1brz s ASN 44 Cb 0.00 -2.32 -0.03 0.00 -0.02 0.00 0.00 41.25 38.88 1brz s ASN 44 CO 0.00 0.09 0.67 -0.76 -2.57 0.00 0.00 177.10 174.53 1brz s LEU 45 N 0.04 3.81 -0.03 0.60 1.43 -1.26 -0.83 118.68 122.44 1brz s LEU 45 Ca 0.28 0.67 -0.02 0.00 -1.03 0.00 0.00 54.13 54.03 1brz s LEU 45 Cb -0.17 -3.57 0.02 0.00 0.03 0.00 0.00 46.19 42.50 1brz s LEU 45 CO 0.14 -0.46 0.08 -1.10 0.23 0.00 0.00 176.35 175.24 1brz s GLN 46 N -4.53 0.06 -0.67 1.70 -0.21 0.17 -4.92 119.66 111.26 1brz s GLN 46 Ca 0.44 0.18 -0.24 0.00 0.02 0.00 0.00 55.36 55.76 1brz s GLN 46 Cb -0.10 -0.06 0.06 0.00 1.00 0.00 0.00 33.01 33.91 1brz s GLN 46 CO 0.40 -0.07 1.04 0.00 -2.12 0.00 0.00 175.29 174.54 1brz s ILE 48 N 4.48 4.88 -0.28 0.00 1.09 0.82 -0.24 121.20 131.95 1brz s ILE 48 Ca 0.26 0.84 -0.16 0.00 -1.10 0.00 0.00 60.65 60.49 1brz s ILE 48 Cb -0.14 -4.06 -0.03 0.00 -1.06 0.00 0.00 42.46 37.17 1brz s ILE 48 CO 0.12 -0.23 0.42 0.00 -0.10 0.00 0.00 174.94 175.15 1brz s ASP 50 N 1.63 6.41 0.00 0.00 -1.08 0.89 -1.33 116.67 123.19 1brz s ASP 50 Ca 0.17 0.48 0.00 0.00 -0.52 0.00 0.00 52.55 52.68 1brz s ASP 50 Cb -0.16 -2.24 0.00 0.00 -1.46 0.00 0.00 42.92 39.06 1brz s ASP 50 CO 0.10 -0.14 0.00 -1.22 0.52 0.00 0.00 175.17 174.43 1brz n TYR 51 N 4.86 0.00 -1.75 -5.34 4.02 0.45 -0.57 117.16 118.82 1brz n TYR 51 Ca -0.07 0.00 -0.13 0.00 -0.01 0.00 0.00 57.90 57.69 1brz n TYR 51 Cb 0.51 0.00 -0.04 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 -2.20 0.08 0.00 0.00 2.13 -1.26 -5.10 120.64 114.29 1brz n GLU 53 Ca -0.14 0.01 0.13 0.00 0.66 0.00 0.00 57.16 57.82 1brz n GLU 53 Cb 0.49 -1.62 0.37 0.00 0.27 0.00 0.00 31.44 30.95 1brz n GLU 53 CO 0.00 0.00 0.00 0.98 -0.41 0.00 0.00 177.13 177.70