#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 -3.17 0.00 0.11 4.76 -1.26 -5.02 118.16 113.59 1brz n LYS 3 Ca 0.00 2.48 0.00 0.00 -2.87 0.00 0.00 58.31 57.92 1brz n LYS 3 Cb 0.00 -3.28 0.00 0.00 -1.84 0.00 0.00 35.03 29.91 1brz n LYS 3 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1brz s LYS 5 N -0.53 4.22 -0.16 0.00 -0.14 -1.26 -0.40 119.74 121.47 1brz s LYS 5 Ca 0.00 0.63 -0.07 0.00 -1.36 0.00 0.00 55.97 55.18 1brz s LYS 5 Cb 0.00 -3.31 0.07 0.00 -1.68 0.00 0.00 37.83 32.91 1brz s LYS 5 CO 0.00 0.47 0.35 0.15 -0.76 0.00 0.00 175.35 175.56 1brz s LYS 6 N -0.48 0.28 0.51 1.68 1.02 -0.01 -4.98 119.74 117.76 1brz s LYS 6 Ca 0.28 0.84 -0.23 0.00 0.02 0.00 0.00 55.97 56.88 1brz s LYS 6 Cb -0.18 0.09 -0.06 0.00 -0.52 0.00 0.00 37.83 37.17 1brz s LYS 6 CO 0.16 -0.23 1.38 0.14 -0.92 0.00 0.00 175.35 175.88 1brz s VAL 7 N 2.12 2.07 -1.21 3.17 -7.23 -1.26 -0.36 120.40 117.69 1brz s VAL 7 Ca -0.04 0.06 -0.10 0.00 -1.81 0.00 0.00 61.98 60.09 1brz s VAL 7 Cb -0.11 -3.03 0.20 0.00 0.56 0.00 0.00 36.38 34.00 1brz s VAL 7 CO -0.11 0.00 1.59 0.00 -0.31 0.00 0.00 175.10 176.27 1brz n TYR 8 N -0.73 3.77 -0.11 2.82 9.36 0.30 -4.80 117.16 127.78 1brz n TYR 8 Ca 0.08 -3.07 0.00 0.00 3.32 0.00 0.00 57.90 58.23 1brz n TYR 8 Cb 0.44 -1.90 0.00 0.00 -0.63 0.00 0.00 39.34 37.25 1brz n TYR 8 CO 0.00 0.00 0.00 0.39 0.22 0.00 0.00 176.86 177.47 1brz n GLU 9 N 3.93 0.00 -2.63 2.98 1.02 -1.26 -1.46 120.64 123.22 1brz n GLU 9 Ca 0.35 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.49 1brz n GLU 9 Cb 0.38 -0.03 0.00 0.00 -0.02 0.00 0.00 31.44 31.77 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 1.51 0.00 -4.50 1.62 5.15 -1.26 -4.63 115.26 113.15 1brz n ASN 10 Ca 0.00 0.00 -0.48 0.00 -0.60 0.00 0.00 54.58 53.50 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 0.00 1.40 0.00 0.00 177.26 178.66 1brz n TYR 11 N -0.75 1.73 -1.62 1.20 9.36 -0.53 -4.82 117.16 121.74 1brz n TYR 11 Ca 0.00 0.13 -0.59 0.00 3.32 0.00 0.00 57.90 60.77 1brz n TYR 11 Cb 0.00 -2.60 -0.08 0.00 -0.63 0.00 0.00 39.34 36.03 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 8.38 0.80 -0.01 2.98 -0.02 -1.26 -4.70 135.00 141.17 1brz n PRO 12 Ca 0.37 0.28 -0.00 0.00 -2.02 0.00 0.00 63.50 62.13 1brz n PRO 12 Cb 0.31 -1.98 -0.00 0.00 -0.02 0.00 0.00 33.50 31.81 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 5.15 0.02 0.11 -1.45 0.31 -1.26 -4.15 118.33 117.06 1brz n VAL 13 Ca 0.33 -0.01 0.03 0.00 -0.01 0.00 0.00 64.34 64.68 1brz n VAL 13 Cb 0.09 -1.08 0.40 0.00 -0.91 0.00 0.00 33.84 32.34 1brz n VAL 13 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 1brz h SER 14 N 4.27 0.25 -2.90 4.52 4.64 -1.98 -3.45 113.55 118.92 1brz h SER 14 Ca 0.00 -0.04 0.12 0.00 -0.47 0.00 0.00 61.79 61.40 1brz h SER 14 Cb 0.01 -0.07 -0.28 0.00 -0.31 0.00 0.00 62.40 61.75 1brz h SER 14 CO 0.08 0.37 0.65 -0.54 -0.87 0.00 0.00 176.83 176.52 1brz s LYS 15 N -4.83 0.32 0.00 4.77 1.02 -1.26 -5.06 119.74 114.71 1brz s LYS 15 Ca -0.06 0.33 0.00 0.00 0.02 0.00 0.00 55.97 56.26 1brz s LYS 15 Cb 0.16 0.16 0.00 0.00 -0.52 0.00 0.00 37.83 37.62 1brz s LYS 15 CO 0.73 -0.05 0.00 0.00 -0.92 0.00 0.00 175.35 175.11 1brz n GLN 17 N 0.00 2.07 0.00 0.00 6.02 -1.26 -4.61 117.38 119.59 1brz n GLN 17 Ca 0.00 -1.71 0.00 0.00 -0.01 0.00 0.00 57.00 55.28 1brz n GLN 17 Cb 0.09 -1.90 0.00 0.00 1.02 0.00 0.00 30.24 29.45 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 1.11 0.00 0.00 1.08 4.77 -1.26 -5.19 117.00 117.51 1brz n LEU 18 Ca 0.39 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.37 1brz n LEU 18 Cb 0.63 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.72 1brz n LEU 18 CO 0.28 0.00 0.00 0.00 -1.33 0.00 0.00 177.39 176.34 1brz n ALA 19 N -3.00 0.00 -0.44 -1.18 0.00 -1.26 -5.01 120.51 109.62 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 0.76 0.00 0.00 0.00 5.15 -1.26 -4.16 115.26 115.75 1brz n ASN 20 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 1brz n ASN 20 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 1brz n ASN 20 CO 0.00 0.00 0.00 1.67 1.40 0.00 0.00 177.26 180.33 1brz n GLN 21 N 0.00 0.00 -0.13 1.20 0.00 -1.26 0.32 117.38 117.52 1brz n GLN 21 Ca 0.00 0.66 -0.09 0.00 -0.00 0.00 0.00 57.00 57.57 1brz n GLN 21 Cb 0.00 -1.05 -0.01 0.00 0.00 0.00 0.00 30.24 29.18 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 -4.69 0.00 -0.33 0.00 4.05 -0.06 -1.18 115.26 113.05 1brz n ASN 23 Ca -0.00 0.69 0.26 0.00 0.45 0.00 0.00 54.58 55.97 1brz n ASN 23 Cb 0.12 -0.19 0.49 0.00 1.23 0.00 0.00 39.78 41.43 1brz n ASN 23 CO 0.00 0.00 0.00 0.22 -3.05 0.00 0.00 177.26 174.43 1brz h TYR 24 N 0.00 0.74 0.26 1.20 3.20 0.51 0.28 116.97 123.16 1brz h TYR 24 Ca 0.00 0.04 -0.00 0.00 3.14 0.00 0.00 58.73 61.91 1brz h TYR 24 Cb 0.00 -0.16 -0.03 0.00 1.54 0.00 0.00 36.73 38.08 1brz h TYR 24 CO 0.02 -0.34 -0.45 -0.44 -1.64 0.00 0.00 178.16 175.31 1brz h ASP 25 N 0.14 -1.29 -0.57 -2.11 5.19 -1.09 -1.56 116.42 115.13 1brz h ASP 25 Ca 0.76 0.12 0.11 0.00 -0.62 0.00 0.00 57.03 57.40 1brz h ASP 25 Cb 1.84 0.45 -0.08 0.00 0.18 0.00 0.00 39.33 41.72 1brz h ASP 25 CO -0.71 -0.52 0.09 0.00 -3.12 0.00 0.00 179.24 174.97 1brz n LYS 27 N -5.16 0.06 0.00 0.00 4.81 -0.11 -1.06 118.16 116.70 1brz n LYS 27 Ca 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.52 1brz n LYS 27 Cb 0.31 -1.01 0.00 0.00 0.02 0.00 0.00 35.03 34.35 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 -0.28 0.00 0.14 3.14 0.00 0.82 -4.59 117.00 116.23 1brz n LEU 28 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 56.01 56.12 1brz n LEU 28 Cb 0.00 0.00 0.51 0.00 0.00 0.00 0.00 43.42 43.94 1brz n LEU 28 CO 0.00 0.00 0.84 -0.67 0.00 0.00 0.00 177.39 177.56 1brz n ASP 29 N -0.99 0.62 0.00 1.96 -0.08 1.15 -3.11 116.55 116.09 1brz n ASP 29 Ca 0.00 0.69 0.00 0.00 -1.51 0.00 0.00 54.79 53.97 1brz n ASP 29 Cb 0.00 -0.81 0.00 0.00 2.34 0.00 0.00 41.12 42.65 1brz n ASP 29 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 1brz n LYS 30 N -2.23 0.00 -3.33 -0.67 4.76 -1.22 -5.01 118.16 110.46 1brz n LYS 30 Ca 0.01 -0.15 -0.18 0.00 -2.87 0.00 0.00 58.31 55.12 1brz n LYS 30 Cb 0.16 -0.42 0.07 0.00 -1.84 0.00 0.00 35.03 33.00 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 -2.20 -2.33 2.13 8.25 -1.18 -5.02 115.22 114.88 1brz n HIS 31 Ca 0.00 0.82 -0.22 0.00 -0.26 0.00 0.00 57.72 58.06 1brz n HIS 31 Cb 0.34 -4.41 0.13 0.00 1.12 0.00 0.00 29.99 27.17 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 -4.24 -0.31 -0.04 -1.41 0.00 -0.23 -4.92 120.51 109.37 1brz n ALA 32 Ca -0.07 -1.66 -0.15 0.00 0.00 0.00 0.00 53.44 51.56 1brz n ALA 32 Cb 0.58 0.17 -0.14 0.00 0.00 0.00 0.00 19.45 20.06 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 -2.89 0.69 0.00 0.00 3.00 0.18 -4.44 116.66 113.20 1brz n ARG 33 Ca 0.15 0.22 0.00 0.00 -0.00 0.00 0.00 57.85 58.22 1brz n ARG 33 Cb 0.52 -1.69 0.00 0.00 0.00 0.00 0.00 32.46 31.29 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 -3.20 0.00 0.00 6.15 3.41 -0.71 -4.85 113.62 114.42 1brz n SER 34 Ca -0.28 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.33 1brz n SER 34 Cb 1.06 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 65.01 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 1.01 3.60 5.00 0.00 -1.26 0.43 105.19 113.97 1brz n GLY 35 Ca 0.00 -1.47 0.01 0.00 0.00 0.00 0.00 46.02 44.56 1brz n GLY 35 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1brz s GLU 36 N -1.78 0.11 0.22 1.61 -1.05 -0.13 -4.35 118.70 113.32 1brz s GLU 36 Ca 0.00 -0.05 -0.15 0.00 -0.15 0.00 0.00 54.97 54.61 1brz s GLU 36 Cb 0.00 0.04 -0.08 0.00 -0.44 0.00 0.00 34.13 33.65 1brz s GLU 36 CO 0.00 -0.05 0.64 0.00 0.95 0.00 0.00 175.26 176.80 1brz s PHE 38 N -1.64 0.26 -0.98 0.00 0.08 -0.43 -4.92 117.98 110.35 1brz s PHE 38 Ca 0.44 -0.73 -0.15 0.00 0.12 0.00 0.00 56.93 56.61 1brz s PHE 38 Cb -0.14 -0.16 0.19 0.00 -0.57 0.00 0.00 43.02 42.34 1brz s PHE 38 CO 0.20 -0.49 1.07 0.71 -0.10 0.00 0.00 175.22 176.61 1brz s TYR 39 N -3.88 3.57 1.01 0.36 2.02 -1.25 -1.21 117.35 117.98 1brz s TYR 39 Ca 0.06 -1.92 -0.23 0.00 -0.37 0.00 0.00 57.07 54.60 1brz s TYR 39 Cb 0.06 -4.08 -0.13 0.00 -0.40 0.00 0.00 41.96 37.41 1brz s TYR 39 CO -0.11 -1.24 -1.07 -0.25 -1.57 0.00 0.00 175.55 171.32 1brz n ASP 40 N 4.99 -3.60 0.00 2.29 8.00 -0.49 -4.61 116.55 123.13 1brz n ASP 40 Ca 0.23 0.04 0.02 0.00 0.71 0.00 0.00 54.79 55.80 1brz n ASP 40 Cb 0.46 -0.66 0.14 0.00 -0.02 0.00 0.00 41.12 41.04 1brz n ASP 40 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 1brz n GLU 41 N 1.64 0.15 -0.40 -1.24 2.13 -1.26 -1.51 120.64 120.14 1brz n GLU 41 Ca -0.01 0.01 0.08 0.00 0.66 0.00 0.00 57.16 57.90 1brz n GLU 41 Cb 0.68 -1.50 0.24 0.00 0.27 0.00 0.00 31.44 31.13 1brz n GLU 41 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1brz n LYS 42 N -1.02 2.99 -3.17 5.31 5.02 -1.26 -4.99 118.16 121.05 1brz n LYS 42 Ca 0.04 -2.68 -0.12 0.00 -2.02 0.00 0.00 58.31 53.52 1brz n LYS 42 Cb 0.02 -1.73 0.06 0.00 -0.02 0.00 0.00 35.03 33.35 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 -0.22 -2.05 -3.72 1.97 3.00 -0.57 -5.04 116.66 110.04 1brz n ARG 43 Ca 0.19 0.93 -0.12 0.00 -0.01 0.00 0.00 57.85 58.85 1brz n ARG 43 Cb 0.80 -5.70 -0.13 0.00 0.00 0.00 0.00 32.46 27.43 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 -3.32 -0.28 -0.67 0.55 0.01 -1.25 -4.96 114.94 105.02 1brz s ASN 44 Ca 0.38 0.57 -0.24 0.00 -0.71 0.00 0.00 52.86 52.86 1brz s ASN 44 Cb -0.05 0.46 0.05 0.00 0.41 0.00 0.00 41.25 42.12 1brz s ASN 44 CO 0.72 -0.17 1.06 -0.76 -1.51 0.00 0.00 177.10 176.43 1brz s LEU 45 N 1.31 3.99 0.04 0.60 1.43 -1.25 -1.40 118.68 123.39 1brz s LEU 45 Ca -0.09 -0.75 0.06 0.00 -1.03 0.00 0.00 54.13 52.32 1brz s LEU 45 Cb -0.10 -2.52 -0.03 0.00 0.03 0.00 0.00 46.19 43.57 1brz s LEU 45 CO -0.09 -1.53 -0.12 -1.10 0.23 0.00 0.00 176.35 173.73 1brz s GLN 46 N 4.55 2.25 -0.68 1.70 -0.21 -0.35 -4.79 119.66 122.14 1brz s GLN 46 Ca 0.27 -0.90 -0.26 0.00 0.02 0.00 0.00 55.36 54.49 1brz s GLN 46 Cb -0.14 -2.33 0.04 0.00 1.00 0.00 0.00 33.01 31.59 1brz s GLN 46 CO 0.13 0.55 1.16 0.00 -2.12 0.00 0.00 175.29 175.01 1brz s ILE 48 N 5.06 4.70 -0.20 0.00 1.09 0.01 -0.53 121.20 131.32 1brz s ILE 48 Ca 0.33 0.57 -0.16 0.00 -1.10 0.00 0.00 60.65 60.29 1brz s ILE 48 Cb -0.10 -4.26 -0.04 0.00 -1.06 0.00 0.00 42.46 36.99 1brz s ILE 48 CO 0.16 -0.59 0.42 0.00 -0.10 0.00 0.00 174.94 174.83 1brz s ASP 50 N 1.04 6.68 -0.52 0.00 2.15 0.17 -0.83 116.67 125.37 1brz s ASP 50 Ca 0.20 0.81 0.07 0.00 0.43 0.00 0.00 52.55 54.06 1brz s ASP 50 Cb -0.15 -2.19 0.28 0.00 -0.30 0.00 0.00 42.92 40.56 1brz s ASP 50 CO 0.08 0.33 0.71 -1.22 -0.17 0.00 0.00 175.17 174.90 1brz n TYR 51 N 1.73 2.02 -1.19 -5.34 4.02 0.47 0.52 117.16 119.38 1brz n TYR 51 Ca -0.15 -3.90 -0.27 0.00 -0.01 0.00 0.00 57.90 53.57 1brz n TYR 51 Cb 0.53 -0.46 0.13 0.00 -0.02 0.00 0.00 39.34 39.52 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 -0.95 -0.06 0.00 0.00 0.00 -1.26 -5.01 120.64 113.35 1brz n GLU 53 Ca 0.58 1.14 0.06 0.00 0.00 0.00 0.00 57.16 58.94 1brz n GLU 53 Cb 1.21 -1.75 0.05 0.00 0.00 0.00 0.00 31.44 30.94 1brz n GLU 53 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79