#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eoo n SER 2 N 0.00 5.53 -4.29 1.61 3.41 -1.26 -4.94 113.62 113.67 2eoo n SER 2 Ca 0.00 -3.76 -0.35 0.00 -0.26 0.00 0.00 58.87 54.51 2eoo n SER 2 Cb 0.00 -0.52 -0.14 0.00 -0.26 0.00 0.00 64.21 63.29 2eoo n SER 2 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2eoo s SER 3 N -3.13 4.12 0.00 4.04 0.01 -1.26 -4.87 113.70 112.61 2eoo s SER 3 Ca 0.53 -0.42 0.00 0.00 1.31 0.00 0.00 55.95 57.37 2eoo s SER 3 Cb 0.43 -1.69 0.00 0.00 0.21 0.00 0.00 66.02 64.96 2eoo s SER 3 CO -0.04 -0.00 0.00 0.61 0.41 0.00 0.00 173.24 174.22 2eoo n GLY 4 N 4.67 2.38 4.22 3.44 0.00 -1.26 -4.81 105.19 113.84 2eoo n GLY 4 Ca -0.19 0.02 -0.34 0.00 0.00 0.00 0.00 46.02 45.52 2eoo n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2eoo n SER 5 N 4.99 -1.77 -4.19 1.61 3.41 -1.26 -4.94 113.62 111.46 2eoo n SER 5 Ca 0.00 -1.08 -0.22 0.00 -0.26 0.00 0.00 58.87 57.31 2eoo n SER 5 Cb 0.00 -2.49 -0.13 0.00 -0.26 0.00 0.00 64.21 61.33 2eoo n SER 5 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2eoo s SER 6 N -3.70 2.00 0.00 4.04 0.01 -1.26 -5.11 113.70 109.68 2eoo s SER 6 Ca 0.48 -0.52 0.00 0.00 1.31 0.00 0.00 55.95 57.21 2eoo s SER 6 Cb -0.26 -0.13 0.00 0.00 0.21 0.00 0.00 66.02 65.83 2eoo s SER 6 CO 0.94 0.06 0.00 0.61 0.41 0.00 0.00 173.24 175.26 2eoo n GLY 7 N 1.71 3.64 3.34 3.44 0.00 -1.26 -5.14 105.19 110.92 2eoo n GLY 7 Ca -0.18 -0.35 -0.33 0.00 0.00 0.00 0.00 46.02 45.16 2eoo n GLY 7 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2eoo n SER 8 N 0.00 -2.35 0.00 1.61 3.41 -1.26 -5.00 113.62 110.03 2eoo n SER 8 Ca 0.00 0.13 0.00 0.00 -0.26 0.00 0.00 58.87 58.74 2eoo n SER 8 Cb 0.00 -1.08 0.00 0.00 -0.26 0.00 0.00 64.21 62.87 2eoo n SER 8 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2eoo n GLY 9 N 1.81 -0.31 2.96 5.00 0.00 -1.26 -5.11 105.19 108.28 2eoo n GLY 9 Ca 0.04 0.57 -0.31 0.00 0.00 0.00 0.00 46.02 46.32 2eoo n GLY 9 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2eoo s GLU 10 N 0.00 2.27 -0.05 1.61 2.12 -1.26 -5.08 118.70 118.31 2eoo s GLU 10 Ca 0.00 -2.87 -0.19 0.00 0.36 0.00 0.00 54.97 52.27 2eoo s GLU 10 Cb 0.00 -3.44 -0.05 0.00 0.26 0.00 0.00 34.13 30.90 2eoo s GLU 10 CO 0.00 -1.18 0.53 0.50 -0.54 0.00 0.00 175.26 174.57 2eoo s ARG 11 N -0.68 4.27 0.24 4.30 6.06 -1.26 -4.98 118.95 126.90 2eoo s ARG 11 Ca 0.20 0.59 0.01 0.00 -2.50 0.00 0.00 55.73 54.03 2eoo s ARG 11 Cb -0.18 -3.36 0.28 0.00 0.06 0.00 0.00 34.95 31.75 2eoo s ARG 11 CO -0.06 0.33 1.61 -1.00 -2.50 0.00 0.00 175.30 173.68 2eoo h PRO 12 N 5.93 0.43 -0.85 5.12 0.13 -1.98 -2.87 132.00 137.92 2eoo h PRO 12 Ca -0.44 -0.23 -0.08 0.00 -0.87 0.00 0.00 66.00 64.37 2eoo h PRO 12 Cb 1.20 0.01 -0.05 0.00 0.13 0.00 0.00 31.00 32.28 2eoo h PRO 12 CO 0.71 0.79 0.11 0.66 -0.23 0.00 0.00 178.00 180.04 2eoo n TYR 13 N -4.01 1.26 -1.74 1.56 4.01 -1.26 -4.96 117.16 112.02 2eoo n TYR 13 Ca -0.02 -0.64 -0.37 0.00 -0.16 0.00 0.00 57.90 56.71 2eoo n TYR 13 Cb 0.52 -0.41 0.06 0.00 -0.31 0.00 0.00 39.34 39.20 2eoo n TYR 13 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 2eoo s GLY 14 N -0.35 2.87 -0.01 2.72 0.00 -1.09 -4.02 107.32 107.46 2eoo s GLY 14 Ca 0.29 1.26 0.03 0.00 0.00 0.00 0.00 44.72 46.30 2eoo s GLY 14 CO 0.08 1.71 -0.06 0.00 0.00 0.00 0.00 173.10 174.83 2eoo n ASN 16 N 1.62 1.31 -0.33 0.00 0.23 -1.26 -2.73 115.26 114.10 2eoo n ASN 16 Ca -0.16 -0.06 0.20 0.00 -0.53 0.00 0.00 54.58 54.03 2eoo n ASN 16 Cb 0.53 0.32 0.39 0.00 -2.08 0.00 0.00 39.78 38.93 2eoo n ASN 16 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 2eoo h GLU 17 N 0.00 0.07 0.00 -3.83 3.07 -1.98 -3.33 114.58 108.58 2eoo h GLU 17 Ca -0.51 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.35 2eoo h GLU 17 Cb 1.97 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 29.87 2eoo h GLU 17 CO -0.02 0.05 -0.48 0.00 -1.40 0.00 0.00 179.01 177.15 2eoo n GLY 19 N 2.34 0.87 3.54 0.00 0.00 -1.10 -5.10 105.19 105.73 2eoo n GLY 19 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 2eoo n GLY 19 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2eoo s LYS 20 N 0.00 3.35 0.18 1.61 2.47 -1.22 -4.85 119.74 121.28 2eoo s LYS 20 Ca 0.00 -0.52 0.05 0.00 -1.56 0.00 0.00 55.97 53.95 2eoo s LYS 20 Cb 0.00 -2.81 -0.04 0.00 -1.46 0.00 0.00 37.83 33.52 2eoo s LYS 20 CO 0.00 0.41 0.15 -0.80 0.16 0.00 0.00 175.35 175.26 2eoo s ASN 21 N -0.09 5.51 0.26 1.43 -0.87 -1.26 -0.01 114.94 119.91 2eoo s ASN 21 Ca 0.02 -0.16 -0.08 0.00 -1.57 0.00 0.00 52.86 51.07 2eoo s ASN 21 Cb -0.13 -1.43 -0.01 0.00 -0.02 0.00 0.00 41.25 39.66 2eoo s ASN 21 CO 0.03 0.05 0.41 -0.36 -2.57 0.00 0.00 177.10 174.66 2eoo s PHE 22 N -1.83 0.66 -0.09 2.20 0.08 -1.26 -4.98 117.98 112.76 2eoo s PHE 22 Ca 0.31 -0.97 0.01 0.00 0.12 0.00 0.00 56.93 56.40 2eoo s PHE 22 Cb -0.10 -0.00 -0.06 0.00 -0.57 0.00 0.00 43.02 42.29 2eoo s PHE 22 CO 0.24 -0.96 -0.08 0.41 -0.10 0.00 0.00 175.22 174.72 2eoo n GLY 23 N -0.40 -0.13 3.84 4.36 0.00 -1.26 -4.26 105.19 107.35 2eoo n GLY 23 Ca -0.00 -0.06 -0.36 0.00 0.00 0.00 0.00 46.02 45.59 2eoo n GLY 23 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2eoo s ARG 24 N -2.19 3.96 0.12 1.61 1.81 -1.26 -4.95 118.95 118.04 2eoo s ARG 24 Ca -0.13 0.45 -0.28 0.00 -1.72 0.00 0.00 55.73 54.05 2eoo s ARG 24 Cb 0.03 -3.02 -0.07 0.00 -0.45 0.00 0.00 34.95 31.44 2eoo s ARG 24 CO 0.22 0.54 1.60 1.25 -0.68 0.00 0.00 175.30 178.24 2eoo h HIS 25 N 3.87 -0.98 -0.29 -0.53 -0.00 -2.01 -2.38 115.15 112.83 2eoo h HIS 25 Ca -0.49 0.03 0.05 0.00 -0.00 0.00 0.00 60.37 59.95 2eoo h HIS 25 Cb 1.20 0.43 -0.04 0.00 -0.00 0.00 0.00 27.41 29.00 2eoo h HIS 25 CO 0.67 -0.45 0.03 0.66 -0.00 0.00 0.00 177.93 178.84 2eoo h SER 26 N -0.52 -0.05 -0.89 3.26 4.64 -1.99 -1.98 113.55 116.01 2eoo h SER 26 Ca 0.05 0.06 0.24 0.00 -0.47 0.00 0.00 61.79 61.67 2eoo h SER 26 Cb 0.60 0.09 -0.15 0.00 -0.31 0.00 0.00 62.40 62.63 2eoo h SER 26 CO -0.27 0.01 0.21 0.45 -0.87 0.00 0.00 176.83 176.36 2eoo h HIS 27 N 0.12 0.29 0.35 4.77 3.86 -1.85 0.37 115.15 123.07 2eoo h HIS 27 Ca 0.14 0.05 -0.02 0.00 -1.16 0.00 0.00 60.37 59.38 2eoo h HIS 27 Cb 0.16 0.01 0.00 0.00 1.06 0.00 0.00 27.41 28.65 2eoo h HIS 27 CO -0.19 -0.25 -0.17 1.25 0.86 0.00 0.00 177.93 179.43 2eoo h LEU 28 N 0.17 -0.39 -0.21 2.43 5.85 -0.90 -2.74 115.31 119.51 2eoo h LEU 28 Ca 0.56 -0.16 0.03 0.00 0.84 0.00 0.00 57.88 59.16 2eoo h LEU 28 Cb 1.16 0.10 -0.06 0.00 0.37 0.00 0.00 40.66 42.23 2eoo h LEU 28 CO -0.70 -0.01 -0.46 0.40 -0.34 0.00 0.00 178.44 177.33 2eoo h ILE 29 N -0.84 0.00 -0.66 4.05 1.08 -0.58 -1.56 117.51 119.01 2eoo h ILE 29 Ca -0.05 0.00 0.12 0.00 -0.39 0.00 0.00 64.86 64.55 2eoo h ILE 29 Cb 0.53 0.00 -0.13 0.00 -3.07 0.00 0.00 36.82 34.15 2eoo h ILE 29 CO 0.08 0.00 -0.25 -0.33 -0.69 0.00 0.00 178.15 176.96 2eoo h GLU 30 N -0.42 -0.07 -0.72 2.37 5.08 -1.08 0.14 114.58 119.87 2eoo h GLU 30 Ca 0.04 0.01 0.16 0.00 -1.00 0.00 0.00 59.36 58.56 2eoo h GLU 30 Cb 0.54 0.02 -0.11 0.00 0.50 0.00 0.00 28.75 29.70 2eoo h GLU 30 CO -0.42 -0.05 0.17 1.25 -1.00 0.00 0.00 179.01 178.96 2eoo h HIS 31 N -0.08 0.26 -0.64 4.33 2.76 -1.00 0.21 115.15 120.99 2eoo h HIS 31 Ca 0.29 0.04 0.02 0.00 -2.20 0.00 0.00 60.37 58.52 2eoo h HIS 31 Cb 0.53 -0.00 -0.03 0.00 1.55 0.00 0.00 27.41 29.46 2eoo h HIS 31 CO -0.60 -0.09 0.43 -0.07 -1.30 0.00 0.00 177.93 176.30 2eoo h LEU 32 N 0.26 0.70 -0.51 0.26 3.38 0.17 -2.79 115.31 116.78 2eoo h LEU 32 Ca 0.41 -0.01 0.09 0.00 0.09 0.00 0.00 57.88 58.46 2eoo h LEU 32 Cb 0.69 -0.17 -0.10 0.00 0.09 0.00 0.00 40.66 41.16 2eoo h LEU 32 CO -0.51 0.49 -0.34 0.11 0.09 0.00 0.00 178.44 178.29 2eoo h LYS 33 N 0.82 -0.19 -0.98 1.13 1.79 0.08 -1.63 116.57 117.59 2eoo h LYS 33 Ca 0.25 0.01 0.12 0.00 -2.18 0.00 0.00 60.65 58.85 2eoo h LYS 33 Cb -0.01 0.04 -0.14 0.00 -1.58 0.00 0.00 32.23 30.55 2eoo h LYS 33 CO -0.06 -0.13 -0.50 0.00 -1.08 0.00 0.00 179.45 177.68 2eoo h ARG 34 N -0.20 -0.01 -0.98 3.15 2.47 -1.49 0.54 114.38 117.85 2eoo h ARG 34 Ca 0.21 0.00 0.32 0.00 -1.26 0.00 0.00 59.98 59.25 2eoo h ARG 34 Cb 0.55 0.00 -0.18 0.00 -1.65 0.00 0.00 29.97 28.69 2eoo h ARG 34 CO -0.62 -0.01 0.23 0.45 0.56 0.00 0.00 179.97 180.58 2eoo h HIS 35 N -0.01 0.31 -0.40 3.04 3.86 -1.43 0.24 115.15 120.76 2eoo h HIS 35 Ca 0.24 0.06 -0.30 0.00 -1.16 0.00 0.00 60.37 59.20 2eoo h HIS 35 Cb 0.49 0.03 -0.11 0.00 1.06 0.00 0.00 27.41 28.88 2eoo h HIS 35 CO -0.95 -0.42 -0.10 0.34 0.86 0.00 0.00 177.93 177.65 2eoo n PHE 36 N -5.38 0.59 -3.50 2.45 7.35 0.19 -4.81 117.46 114.35 2eoo n PHE 36 Ca 0.28 -1.66 -0.16 0.00 -0.76 0.00 0.00 57.45 55.15 2eoo n PHE 36 Cb 0.94 -1.52 -0.05 0.00 0.35 0.00 0.00 39.48 39.20 2eoo n PHE 36 CO 0.00 0.00 0.00 0.50 -0.76 0.00 0.00 176.76 176.50 2eoo s ARG 37 N -0.01 1.07 -0.26 -4.13 6.06 0.83 -5.03 118.95 117.49 2eoo s ARG 37 Ca 0.64 0.06 -0.17 0.00 -2.50 0.00 0.00 55.73 53.75 2eoo s ARG 37 Cb 0.34 0.50 -0.03 0.00 0.06 0.00 0.00 34.95 35.82 2eoo s ARG 37 CO -0.08 -0.38 0.48 -2.00 -2.50 0.00 0.00 175.30 170.82 2eoo s GLU 38 N -1.87 4.07 -0.20 5.12 2.12 -1.26 -4.93 118.70 121.75 2eoo s GLU 38 Ca -0.07 0.27 0.14 0.00 0.36 0.00 0.00 54.97 55.66 2eoo s GLU 38 Cb -0.00 -3.64 0.41 0.00 0.26 0.00 0.00 34.13 31.16 2eoo s GLU 38 CO 0.03 -0.31 1.28 0.36 -0.54 0.00 0.00 175.26 176.08 2eoo n LYS 39 N 5.40 1.71 -0.96 4.30 0.00 -1.26 -4.81 118.16 122.54 2eoo n LYS 39 Ca -0.05 -3.02 -0.11 0.00 -0.00 0.00 0.00 58.31 55.13 2eoo n LYS 39 Cb 0.50 -1.66 -0.14 0.00 -0.00 0.00 0.00 35.03 33.73 2eoo n LYS 39 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 2eoo n SER 40 N -1.14 5.32 -3.87 -5.58 2.88 -1.26 -4.66 113.62 105.31 2eoo n SER 40 Ca 0.22 -2.51 -0.29 0.00 -1.33 0.00 0.00 58.87 54.96 2eoo n SER 40 Cb 0.78 -1.37 -0.13 0.00 -0.75 0.00 0.00 64.21 62.74 2eoo n SER 40 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2eoo s SER 41 N 1.91 4.39 0.00 -3.46 0.01 -1.26 -4.89 113.70 110.39 2eoo s SER 41 Ca 0.57 -3.46 0.00 0.00 1.31 0.00 0.00 55.95 54.37 2eoo s SER 41 Cb 0.28 -1.53 0.00 0.00 0.21 0.00 0.00 66.02 64.98 2eoo s SER 41 CO -0.01 -0.15 0.00 0.61 0.41 0.00 0.00 173.24 174.10 2eoo n GLY 42 N 2.49 -1.08 0.00 3.44 0.00 -1.26 -4.91 105.19 103.87 2eoo n GLY 42 Ca 0.15 -0.26 0.07 0.00 0.00 0.00 0.00 46.02 45.99 2eoo n GLY 42 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2eoo n PRO 43 N -0.27 0.49 -3.93 1.61 -0.04 -1.26 -4.24 135.00 127.36 2eoo n PRO 43 Ca 0.00 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.16 2eoo n PRO 43 Cb 0.00 -1.47 -0.14 0.00 -0.04 0.00 0.00 33.50 31.85 2eoo n PRO 43 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2eoo s SER 44 N -1.97 4.32 0.18 3.54 1.04 -1.26 -5.10 113.70 114.45 2eoo s SER 44 Ca 0.22 -2.73 0.00 0.00 0.48 0.00 0.00 55.95 53.92 2eoo s SER 44 Cb 0.10 -1.54 -0.04 0.00 0.10 0.00 0.00 66.02 64.65 2eoo s SER 44 CO 0.17 -0.27 0.36 -0.94 0.98 0.00 0.00 173.24 173.53 2eoo s SER 45 N 0.11 6.37 0.00 7.02 1.04 -1.26 -5.23 113.70 121.76 2eoo s SER 45 Ca 0.15 0.34 0.00 0.00 0.48 0.00 0.00 55.95 56.92 2eoo s SER 45 Cb -0.24 -1.98 0.00 0.00 0.10 0.00 0.00 66.02 63.90 2eoo s SER 45 CO -0.03 -0.01 0.10 0.61 0.98 0.00 0.00 173.24 174.89