#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jyy s ARG 2 N 0.00 3.63 0.22 -0.67 1.04 -1.26 -4.96 118.95 116.95 2jyy s ARG 2 Ca 0.00 2.09 -0.30 0.00 -1.04 0.00 0.00 55.73 56.48 2jyy s ARG 2 Cb 0.00 -2.49 -0.09 0.00 -2.04 0.00 0.00 34.95 30.33 2jyy s ARG 2 CO 0.00 -0.75 1.35 0.96 -0.04 0.00 0.00 175.30 176.82 2jyy s ILE 3 N -1.35 2.99 -1.17 4.99 -4.36 -1.06 -4.91 121.20 116.33 2jyy s ILE 3 Ca 0.64 0.84 -0.06 0.00 -0.26 0.00 0.00 60.65 61.80 2jyy s ILE 3 Cb -0.36 -3.53 0.05 0.00 1.25 0.00 0.00 42.46 39.86 2jyy s ILE 3 CO 0.45 0.13 2.64 0.00 0.24 0.00 0.00 174.94 178.40 2jyy n THR 5 N 2.01 0.00 -3.89 0.00 -2.24 -1.26 -3.33 114.28 105.56 2jyy n THR 5 Ca 0.63 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.41 2jyy n THR 5 Cb 0.33 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.56 2jyy n THR 5 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2jyy n ASN 6 N 0.00 -0.13 -0.30 3.42 6.94 -1.26 -1.43 115.26 122.50 2jyy n ASN 6 Ca 0.00 -1.02 -0.04 0.00 -0.02 0.00 0.00 54.58 53.49 2jyy n ASN 6 Cb 0.00 0.21 0.07 0.00 -2.36 0.00 0.00 39.78 37.70 2jyy n ASN 6 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2jyy h ALA 8 N 1.28 0.70 -0.08 0.00 0.00 -1.84 0.49 119.26 119.82 2jyy h ALA 8 Ca 0.29 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 2jyy h ALA 8 Cb -0.10 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 2jyy h ALA 8 CO -0.06 0.15 0.01 0.00 0.00 0.00 0.00 179.25 179.35 2jyy n ALA 9 N -2.25 2.72 -2.67 0.00 0.00 -1.05 -3.20 120.51 114.05 2jyy n ALA 9 Ca 0.03 -0.26 -0.38 0.00 0.00 0.00 0.00 53.44 52.83 2jyy n ALA 9 Cb 0.02 -1.02 -0.06 0.00 0.00 0.00 0.00 19.45 18.39 2jyy n ALA 9 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2jyy s GLY 10 N 0.04 2.43 0.52 0.00 0.00 -0.32 -4.73 107.32 105.27 2jyy s GLY 10 Ca 0.07 -0.16 -0.20 0.00 0.00 0.00 0.00 44.72 44.43 2jyy s GLY 10 CO 0.02 0.73 1.15 -1.59 0.00 0.00 0.00 173.10 173.41 2jyy s THR 11 N 0.39 3.09 0.23 0.90 2.01 -1.26 -4.21 115.64 116.78 2jyy s THR 11 Ca 0.27 0.72 -0.32 0.00 0.31 0.00 0.00 61.69 62.66 2jyy s THR 11 Cb -0.16 -3.31 -0.12 0.00 0.01 0.00 0.00 72.50 68.92 2jyy s THR 11 CO 0.12 -0.11 1.63 0.29 -0.69 0.00 0.00 174.62 175.85 2jyy n LYS 12 N -1.10 2.55 0.00 4.92 4.01 -1.26 -1.47 118.16 125.82 2jyy n LYS 12 Ca 0.11 0.92 0.00 0.00 -0.51 0.00 0.00 58.31 58.82 2jyy n LYS 12 Cb 0.50 -2.71 0.00 0.00 -0.51 0.00 0.00 35.03 32.31 2jyy n LYS 12 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2jyy n GLY 13 N 3.17 2.64 3.71 0.72 0.00 -1.26 -5.00 105.19 109.17 2jyy n GLY 13 Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 2jyy n GLY 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jyy s LYS 15 N 0.91 4.00 -0.18 0.00 -0.14 0.12 -3.12 119.74 121.33 2jyy s LYS 15 Ca 0.31 -0.21 -0.18 0.00 -1.36 0.00 0.00 55.97 54.53 2jyy s LYS 15 Cb -0.16 -3.63 -0.04 0.00 -1.68 0.00 0.00 37.83 32.33 2jyy s LYS 15 CO 0.13 -0.14 0.49 0.71 -0.76 0.00 0.00 175.35 175.78 2jyy s TYR 16 N 1.65 3.41 0.31 3.18 1.51 0.52 0.31 117.35 128.23 2jyy s TYR 16 Ca 0.09 0.78 0.10 0.00 -1.01 0.00 0.00 57.07 57.03 2jyy s TYR 16 Cb -0.15 -2.62 -0.05 0.00 -0.11 0.00 0.00 41.96 39.02 2jyy s TYR 16 CO 0.09 -0.02 -0.04 -0.06 -1.11 0.00 0.00 175.55 174.41 2jyy s PHE 17 N 1.34 2.53 0.00 2.71 0.40 0.88 -0.39 117.98 125.45 2jyy s PHE 17 Ca 0.24 -0.37 0.00 0.00 -0.60 0.00 0.00 56.93 56.20 2jyy s PHE 17 Cb -0.15 -1.32 0.00 0.00 0.51 0.00 0.00 43.02 42.05 2jyy s PHE 17 CO 0.10 0.56 0.00 -1.13 0.70 0.00 0.00 175.22 175.44 2jyy n SER 18 N -0.87 0.00 0.07 1.36 3.41 -0.45 -1.63 113.62 115.51 2jyy n SER 18 Ca -0.05 0.00 -0.22 0.00 -0.26 0.00 0.00 58.87 58.34 2jyy n SER 18 Cb 0.61 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 64.41 2jyy n SER 18 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 2jyy h ASP 19 N 0.00 0.58 -0.64 4.04 2.03 -1.90 -3.36 116.42 117.18 2jyy h ASP 19 Ca 0.00 -0.92 -0.06 0.00 -0.73 0.00 0.00 57.03 55.32 2jyy h ASP 19 Cb 0.00 -0.19 -0.03 0.00 -0.83 0.00 0.00 39.33 38.28 2jyy h ASP 19 CO 0.00 1.63 0.17 -2.24 -1.03 0.00 0.00 179.24 177.76 2jyy h ASP 20 N -0.11 0.96 0.00 4.15 2.03 -1.96 -3.47 116.42 118.01 2jyy h ASP 20 Ca -0.26 -0.23 0.00 0.00 -0.73 0.00 0.00 57.03 55.81 2jyy h ASP 20 Cb 1.91 -0.25 0.00 0.00 -0.83 0.00 0.00 39.33 40.16 2jyy h ASP 20 CO 0.17 0.93 0.00 0.61 -1.03 0.00 0.00 179.24 179.92 2jyy n GLY 21 N -0.67 -0.29 3.74 7.15 0.00 -1.26 -5.12 105.19 108.74 2jyy n GLY 21 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 2jyy n GLY 21 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jyy s THR 22 N -0.70 3.04 -0.29 2.61 2.01 -1.26 -4.73 115.64 116.32 2jyy s THR 22 Ca 0.00 0.86 -0.29 0.00 0.31 0.00 0.00 61.69 62.57 2jyy s THR 22 Cb 0.00 -3.55 -0.02 0.00 0.01 0.00 0.00 72.50 68.94 2jyy s THR 22 CO 0.00 0.13 1.72 0.12 -0.69 0.00 0.00 174.62 175.90 2jyy s PHE 23 N 0.09 1.93 -0.13 4.92 5.36 -1.26 -1.34 117.98 127.56 2jyy s PHE 23 Ca 0.58 0.57 -0.10 0.00 -0.96 0.00 0.00 56.93 57.02 2jyy s PHE 23 Cb -0.38 -4.09 -0.08 0.00 -0.34 0.00 0.00 43.02 38.13 2jyy s PHE 23 CO 0.40 -2.95 0.13 0.28 -1.46 0.00 0.00 175.22 171.61 2jyy h VAL 24 N 6.54 0.44 -1.41 3.12 2.07 -1.04 -3.48 116.25 122.48 2jyy h VAL 24 Ca -0.34 -1.37 0.25 0.00 0.82 0.00 0.00 66.70 66.06 2jyy h VAL 24 Cb 1.16 0.87 -0.20 0.00 -1.52 0.00 0.00 31.29 31.60 2jyy h VAL 24 CO 1.02 0.15 0.82 0.00 0.02 0.00 0.00 177.57 179.58 2jyy s GLU 26 N -2.16 2.18 -0.39 0.00 2.12 -1.26 -0.36 118.70 118.83 2jyy s GLU 26 Ca 0.09 -0.90 -0.28 0.00 0.36 0.00 0.00 54.97 54.23 2jyy s GLU 26 Cb -0.01 -2.41 -0.01 0.00 0.26 0.00 0.00 34.13 31.96 2jyy s GLU 26 CO -0.05 -1.03 1.71 0.20 -0.54 0.00 0.00 175.26 175.56 2jyy s GLY 27 N -4.56 0.78 -0.27 -1.50 0.00 -1.18 -4.66 107.32 95.94 2jyy s GLY 27 Ca 0.61 0.03 0.00 0.00 0.00 0.00 0.00 44.72 45.36 2jyy s GLY 27 CO 0.41 3.17 1.81 -1.84 0.00 0.00 0.00 173.10 176.65 2jyy n GLU 28 N 8.46 1.70 -1.08 2.90 0.28 0.16 -4.72 120.64 128.33 2jyy n GLU 28 Ca 0.21 -1.46 -0.26 0.00 -0.16 0.00 0.00 57.16 55.49 2jyy n GLU 28 Cb 0.48 -1.57 -0.07 0.00 1.43 0.00 0.00 31.44 31.70 2jyy n GLU 28 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 177.13 175.84 2jyy n SER 29 N 0.16 6.74 -4.71 -1.84 3.41 -1.19 -4.53 113.62 111.65 2jyy n SER 29 Ca 0.28 -2.47 -0.42 0.00 -0.26 0.00 0.00 58.87 56.01 2jyy n SER 29 Cb 0.74 -1.39 -0.03 0.00 -0.26 0.00 0.00 64.21 63.27 2jyy n SER 29 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2jyy s ASP 30 N 2.31 6.54 0.00 4.04 2.15 -1.26 -5.01 116.67 125.45 2jyy s ASP 30 Ca 0.62 2.65 0.00 0.00 0.43 0.00 0.00 52.55 56.25 2jyy s ASP 30 Cb 0.21 -2.59 0.00 0.00 -0.30 0.00 0.00 42.92 40.24 2jyy s ASP 30 CO -0.03 -0.87 0.00 -0.81 -0.17 0.00 0.00 175.17 173.29 2jyy n PRO 31 N 4.32 2.58 0.00 4.34 -0.04 -1.26 -4.59 135.00 140.35 2jyy n PRO 31 Ca 0.15 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.61 2jyy n PRO 31 Cb 0.38 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.84 2jyy n PRO 31 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2jyy n ARG 32 N 0.00 0.00 -3.63 0.54 1.74 -1.26 -4.73 116.66 109.32 2jyy n ARG 32 Ca 0.00 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 56.99 2jyy n ARG 32 Cb 0.00 -0.58 -0.07 0.00 -1.02 0.00 0.00 32.46 30.79 2jyy n ARG 32 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2jyy s ASN 33 N 0.00 -0.39 -0.84 0.55 2.20 -1.26 -5.08 114.94 110.13 2jyy s ASN 33 Ca 0.00 0.70 -0.22 0.00 -0.94 0.00 0.00 52.86 52.40 2jyy s ASN 33 Cb 0.00 0.70 -0.15 0.00 -2.00 0.00 0.00 41.25 39.80 2jyy s ASN 33 CO 0.00 -0.17 1.92 -2.65 -2.94 0.00 0.00 177.10 173.27 2jyy n PRO 34 N 1.89 1.52 -2.03 3.55 -0.02 -1.26 -4.92 135.00 133.73 2jyy n PRO 34 Ca -0.12 -1.95 -0.43 0.00 -2.02 0.00 0.00 63.50 58.98 2jyy n PRO 34 Cb 0.56 -3.06 -0.03 0.00 -0.02 0.00 0.00 33.50 30.96 2jyy n PRO 34 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2jyy s LYS 35 N 5.27 3.59 -0.20 -0.52 1.02 -1.26 -4.96 119.74 122.68 2jyy s LYS 35 Ca 0.59 1.62 -0.25 0.00 0.02 0.00 0.00 55.97 57.95 2jyy s LYS 35 Cb 0.12 -4.12 -0.01 0.00 -0.52 0.00 0.00 37.83 33.30 2jyy s LYS 35 CO 0.12 -1.54 0.83 0.00 -0.92 0.00 0.00 175.35 173.84 2jyy s ALA 36 N 5.98 3.58 -0.37 5.17 0.00 -1.26 -5.01 121.76 129.85 2jyy s ALA 36 Ca 0.77 -0.04 -0.28 0.00 0.00 0.00 0.00 51.96 52.42 2jyy s ALA 36 Cb -0.25 -3.26 0.02 0.00 0.00 0.00 0.00 23.12 19.63 2jyy s ALA 36 CO 0.32 -0.77 1.02 0.00 0.00 0.00 0.00 175.76 176.33 2jyy s ALA 37 N 2.45 3.40 0.00 0.00 0.00 -1.26 -4.92 121.76 121.43 2jyy s ALA 37 Ca 0.37 -0.30 -0.04 0.00 0.00 0.00 0.00 51.96 51.99 2jyy s ALA 37 Cb -0.16 -3.66 -0.17 0.00 0.00 0.00 0.00 23.12 19.13 2jyy s ALA 37 CO 0.10 -1.67 2.98 -0.35 0.00 0.00 0.00 175.76 176.82 2jyy n PRO 38 N 7.00 1.60 -2.71 0.00 -0.04 -1.26 -3.92 135.00 135.67 2jyy n PRO 38 Ca 0.10 -0.63 -0.07 0.00 -0.04 0.00 0.00 63.50 62.85 2jyy n PRO 38 Cb 0.48 -1.65 0.11 0.00 -0.04 0.00 0.00 33.50 32.40 2jyy n PRO 38 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 2jyy n ARG 39 N 2.17 1.10 -1.26 0.54 -4.01 -1.26 -5.15 116.66 108.79 2jyy n ARG 39 Ca 0.27 -1.79 -0.31 0.00 -1.04 0.00 0.00 57.85 54.98 2jyy n ARG 39 Cb 0.75 -0.32 0.10 0.00 -3.04 0.00 0.00 32.46 29.96 2jyy n ARG 39 CO 0.00 0.00 0.00 0.54 -3.04 0.00 0.00 177.63 175.13 2jyy s ASN 40 N -1.17 4.24 -0.88 2.89 6.03 -1.25 -4.05 114.94 120.74 2jyy s ASN 40 Ca 0.21 1.72 -0.01 0.00 -1.03 0.00 0.00 52.86 53.75 2jyy s ASN 40 Cb 0.36 -2.41 0.00 0.00 -3.03 0.00 0.00 41.25 36.16 2jyy s ASN 40 CO -0.08 -2.19 0.74 0.00 -2.03 0.00 0.00 177.10 173.54 2jyy s ASP 42 N -3.87 5.82 0.43 0.00 -1.08 -0.51 -4.86 116.67 112.60 2jyy s ASP 42 Ca 0.06 2.14 0.13 0.00 -0.52 0.00 0.00 52.55 54.37 2jyy s ASP 42 Cb -0.03 -2.52 1.02 0.00 -1.46 0.00 0.00 42.92 39.93 2jyy s ASP 42 CO 0.53 -1.63 1.98 1.55 0.52 0.00 0.00 175.17 178.11 2jyy h PRO 43 N 13.42 0.41 0.00 4.34 0.13 -1.91 -1.79 132.00 146.60 2jyy h PRO 43 Ca -0.44 -0.02 -0.08 0.00 -0.87 0.00 0.00 66.00 64.59 2jyy h PRO 43 Cb 1.24 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 32.26 2jyy h PRO 43 CO 0.96 0.27 -0.39 0.07 -0.23 0.00 0.00 178.00 178.68 2jyy h ARG 44 N 0.42 0.00 -5.65 0.86 0.11 -1.99 -3.43 114.38 104.70 2jyy h ARG 44 Ca 0.27 0.00 -0.59 0.00 0.10 0.00 0.00 59.98 59.76 2jyy h ARG 44 Cb 0.50 0.00 -0.09 0.00 1.11 0.00 0.00 29.97 31.49 2jyy h ARG 44 CO -0.07 0.39 -0.09 0.42 0.10 0.00 0.00 179.97 180.71 2jyy s ILE 45 N -3.72 5.15 -0.08 0.08 1.01 -0.68 -3.86 121.20 119.10 2jyy s ILE 45 Ca -0.01 0.96 -0.02 0.00 0.00 0.00 0.00 60.65 61.58 2jyy s ILE 45 Cb 0.12 -3.83 -0.04 0.00 0.01 0.00 0.00 42.46 38.72 2jyy s ILE 45 CO 0.69 0.26 -0.09 0.00 0.00 0.00 0.00 174.94 175.80 2jyy n ALA 46 N 4.19 2.17 -3.33 9.38 0.00 -0.65 -4.52 120.51 127.75 2jyy n ALA 46 Ca -0.06 -0.33 -0.14 0.00 0.00 0.00 0.00 53.44 52.91 2jyy n ALA 46 Cb 0.51 0.36 -0.09 0.00 0.00 0.00 0.00 19.45 20.23 2jyy n ALA 46 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 2jyy s TYR 47 N -2.15 -0.39 -0.15 0.00 -0.85 -0.65 -2.56 117.35 110.60 2jyy s TYR 47 Ca -0.11 0.80 -0.02 0.00 -0.52 0.00 0.00 57.07 57.22 2jyy s TYR 47 Cb 0.04 0.18 -0.02 0.00 0.38 0.00 0.00 41.96 42.53 2jyy s TYR 47 CO 0.16 -0.36 -0.09 0.20 -1.52 0.00 0.00 175.55 173.94 2jyy s GLY 48 N -0.65 1.62 -0.19 5.49 0.00 -1.26 -0.08 107.32 112.25 2jyy s GLY 48 Ca -0.07 -0.88 -0.04 0.00 0.00 0.00 0.00 44.72 43.73 2jyy s GLY 48 CO 0.04 -0.09 -0.04 -0.42 0.00 0.00 0.00 173.10 172.58 2jyy s ILE 49 N 0.44 3.60 -0.18 0.90 -1.09 0.15 -4.88 121.20 120.13 2jyy s ILE 49 Ca -0.07 -0.44 -0.20 0.00 -2.23 0.00 0.00 60.65 57.71 2jyy s ILE 49 Cb -0.15 -2.60 -0.18 0.00 -1.58 0.00 0.00 42.46 37.95 2jyy s ILE 49 CO 0.04 0.46 0.26 0.00 -1.23 0.00 0.00 174.94 174.46 2jyy n PRO 51 N -4.50 2.81 -3.52 0.00 -0.02 -1.26 -4.58 135.00 123.92 2jyy n PRO 51 Ca -0.24 -1.91 -0.05 0.00 -2.02 0.00 0.00 63.50 59.29 2jyy n PRO 51 Cb 0.56 -2.71 -0.07 0.00 -0.02 0.00 0.00 33.50 31.27 2jyy n PRO 51 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2jyy s LEU 52 N 0.40 -0.86 0.00 2.45 0.20 -1.26 -5.16 118.68 114.45 2jyy s LEU 52 Ca 0.55 0.95 0.00 0.00 0.69 0.00 0.00 54.13 56.32 2jyy s LEU 52 Cb 0.14 1.63 0.00 0.00 -0.43 0.00 0.00 46.19 47.53 2jyy s LEU 52 CO -0.04 -0.25 0.00 0.00 -0.29 0.00 0.00 176.35 175.77