#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 0.41 -4.72 1.61 7.64 -1.26 -5.04 113.62 112.26 2eoo n SER 2 Ca 0.00 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.46 2eoo n SER 2 Cb 0.00 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.16 2eoo n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2eoo s SER 3 N -4.87 7.33 0.00 6.43 0.15 -1.26 -4.90 113.70 116.58 2eoo s SER 3 Ca 0.00 1.85 0.00 0.00 0.70 0.00 0.00 55.95 58.50 2eoo s SER 3 Cb 0.00 -2.58 0.00 0.00 -1.71 0.00 0.00 66.02 61.73 2eoo s SER 3 CO 0.00 -0.24 0.00 0.61 1.20 0.00 0.00 173.24 174.81 2eoo n GLY 4 N 2.60 -1.38 2.13 9.45 0.00 -1.26 -5.06 105.19 111.67 2eoo n GLY 4 Ca 0.05 0.63 -0.25 0.00 0.00 0.00 0.00 46.02 46.45 2eoo n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2eoo n SER 5 N 0.00 4.89 -4.46 1.61 7.64 -1.26 -5.00 113.62 117.04 2eoo n SER 5 Ca 0.00 -3.74 -0.43 0.00 1.01 0.00 0.00 58.87 55.70 2eoo n SER 5 Cb 0.00 -0.37 -0.08 0.00 -1.01 0.00 0.00 64.21 62.75 2eoo n SER 5 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2eoo s SER 6 N -3.58 6.18 0.00 6.43 0.15 -1.26 -4.52 113.70 117.10 2eoo s SER 6 Ca 0.50 -0.87 0.00 0.00 0.70 0.00 0.00 55.95 56.28 2eoo s SER 6 Cb 0.41 -2.22 0.00 0.00 -1.71 0.00 0.00 66.02 62.50 2eoo s SER 6 CO -0.01 -0.62 0.00 0.61 1.20 0.00 0.00 173.24 174.41 2eoo n GLY 7 N 5.15 0.58 3.37 9.45 0.00 -1.26 -5.08 105.19 117.39 2eoo n GLY 7 Ca -0.09 -0.01 -0.45 0.00 0.00 0.00 0.00 46.02 45.48 2eoo n GLY 7 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2eoo s SER 8 N 0.00 7.24 -0.25 1.61 0.15 -1.26 -4.95 113.70 116.23 2eoo s SER 8 Ca 0.00 -3.40 -0.28 0.00 0.70 0.00 0.00 55.95 52.97 2eoo s SER 8 Cb 0.00 -2.26 0.16 0.00 -1.71 0.00 0.00 66.02 62.21 2eoo s SER 8 CO 0.00 -0.42 1.24 -0.83 1.20 0.00 0.00 173.24 174.42 2eoo s GLY 9 N 1.76 0.02 -0.16 9.45 0.00 -1.26 -5.06 107.32 112.07 2eoo s GLY 9 Ca 0.33 2.76 -0.13 0.00 0.00 0.00 0.00 44.72 47.69 2eoo s GLY 9 CO -0.06 1.39 0.28 1.18 0.00 0.00 0.00 173.10 175.88 2eoo n GLU 10 N 1.06 0.67 -0.96 2.90 -0.58 -1.26 -4.87 120.64 117.60 2eoo n GLU 10 Ca -0.07 0.39 -0.22 0.00 -0.42 0.00 0.00 57.16 56.85 2eoo n GLU 10 Cb 0.58 -1.72 -0.12 0.00 -0.57 0.00 0.00 31.44 29.61 2eoo n GLU 10 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2eoo n ARG 11 N -3.89 0.00 0.22 3.49 1.74 -1.26 -4.70 116.66 112.25 2eoo n ARG 11 Ca -0.33 0.00 0.09 0.00 -0.77 0.00 0.00 57.85 56.84 2eoo n ARG 11 Cb 0.89 -0.84 0.48 0.00 -1.02 0.00 0.00 32.46 31.98 2eoo n ARG 11 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 2eoo h PRO 12 N 7.47 0.00 -5.24 5.56 0.13 -1.90 -3.40 132.00 134.62 2eoo h PRO 12 Ca -0.01 0.00 -0.65 0.00 -0.87 0.00 0.00 66.00 64.47 2eoo h PRO 12 Cb 0.80 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 31.77 2eoo h PRO 12 CO 0.95 0.25 0.36 0.71 -0.23 0.00 0.00 178.00 180.05 2eoo s TYR 13 N -3.81 2.83 -0.03 1.56 2.02 -1.25 -5.01 117.35 113.65 2eoo s TYR 13 Ca -0.01 -0.57 0.02 0.00 -0.37 0.00 0.00 57.07 56.14 2eoo s TYR 13 Cb 0.11 -4.08 0.01 0.00 -0.40 0.00 0.00 41.96 37.60 2eoo s TYR 13 CO 0.64 -1.43 -0.09 0.20 -1.57 0.00 0.00 175.55 173.31 2eoo s GLY 14 N 3.40 0.55 -0.07 0.71 0.00 -1.26 -0.99 107.32 109.65 2eoo s GLY 14 Ca 0.20 -0.30 -0.06 0.00 0.00 0.00 0.00 44.72 44.55 2eoo s GLY 14 CO 0.11 -0.00 0.18 0.00 0.00 0.00 0.00 173.10 173.38 2eoo n ASN 16 N 1.59 2.24 -0.31 0.00 0.23 -1.26 -3.03 115.26 114.71 2eoo n ASN 16 Ca -0.16 -0.07 -0.03 0.00 -0.53 0.00 0.00 54.58 53.79 2eoo n ASN 16 Cb 0.54 -0.38 0.01 0.00 -2.08 0.00 0.00 39.78 37.87 2eoo n ASN 16 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 2eoo n GLU 17 N -3.24 -0.22 -0.06 -3.83 -0.58 -1.26 -3.39 120.64 108.05 2eoo n GLU 17 Ca -0.39 1.23 -0.11 0.00 -0.42 0.00 0.00 57.16 57.46 2eoo n GLU 17 Cb 0.90 -1.82 -0.05 0.00 -0.57 0.00 0.00 31.44 29.90 2eoo n GLU 17 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2eoo n GLY 19 N 2.55 0.75 2.98 0.00 0.00 -1.18 -5.12 105.19 105.17 2eoo n GLY 19 Ca -0.24 -0.67 -0.12 0.00 0.00 0.00 0.00 46.02 44.99 2eoo n GLY 19 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2eoo s LYS 20 N -0.78 0.26 0.59 1.61 1.02 -1.17 -4.97 119.74 116.31 2eoo s LYS 20 Ca 0.00 0.63 -0.02 0.00 0.02 0.00 0.00 55.97 56.60 2eoo s LYS 20 Cb 0.00 -0.33 0.04 0.00 -0.52 0.00 0.00 37.83 37.02 2eoo s LYS 20 CO 0.00 -0.47 0.86 -0.80 -0.92 0.00 0.00 175.35 174.01 2eoo s ASN 21 N 2.49 5.21 -0.19 2.83 0.01 -1.26 -2.53 114.94 121.51 2eoo s ASN 21 Ca 0.06 0.25 -0.26 0.00 -0.71 0.00 0.00 52.86 52.20 2eoo s ASN 21 Cb -0.14 -1.10 0.07 0.00 0.41 0.00 0.00 41.25 40.48 2eoo s ASN 21 CO -0.13 -1.24 0.67 -0.36 -1.51 0.00 0.00 177.10 174.53 2eoo s PHE 22 N -2.92 -0.70 -1.08 2.20 0.08 -0.16 -4.98 117.98 110.41 2eoo s PHE 22 Ca 0.57 1.57 0.15 0.00 0.12 0.00 0.00 56.93 59.34 2eoo s PHE 22 Cb -0.10 0.30 0.64 0.00 -0.57 0.00 0.00 43.02 43.28 2eoo s PHE 22 CO 0.41 -0.44 1.52 0.41 -0.10 0.00 0.00 175.22 177.03 2eoo n GLY 23 N 2.13 2.42 2.76 4.36 0.00 -1.26 -3.84 105.19 111.75 2eoo n GLY 23 Ca -0.16 -0.74 -0.16 0.00 0.00 0.00 0.00 46.02 44.96 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 -1.91 0.01 0.04 1.61 3.00 -1.26 -5.04 118.95 115.39 2eoo s ARG 24 Ca 0.45 0.21 -0.11 0.00 0.00 0.00 0.00 55.73 56.27 2eoo s ARG 24 Cb 0.30 -0.33 -0.04 0.00 0.00 0.00 0.00 34.95 34.87 2eoo s ARG 24 CO 0.20 -0.19 1.19 1.25 0.00 0.00 0.00 175.30 177.75 2eoo h HIS 25 N 7.50 -0.58 -0.91 -0.53 -0.00 -2.00 -2.02 115.15 116.61 2eoo h HIS 25 Ca -0.39 0.03 0.14 0.00 -0.00 0.00 0.00 60.37 60.14 2eoo h HIS 25 Cb 1.12 0.27 -0.15 0.00 -0.00 0.00 0.00 27.41 28.65 2eoo h HIS 25 CO 0.50 -0.18 -0.40 0.66 -0.00 0.00 0.00 177.93 178.51 2eoo h SER 26 N -0.16 -1.47 -0.92 3.26 4.64 -1.99 0.61 113.55 117.52 2eoo h SER 26 Ca 0.02 0.30 0.26 0.00 -0.47 0.00 0.00 61.79 61.90 2eoo h SER 26 Cb 0.22 0.75 -0.14 0.00 -0.31 0.00 0.00 62.40 62.91 2eoo h SER 26 CO -0.19 -0.29 0.33 0.45 -0.87 0.00 0.00 176.83 176.27 2eoo h HIS 27 N -0.04 0.52 -0.24 4.77 -0.00 -1.82 0.26 115.15 118.60 2eoo h HIS 27 Ca 0.30 0.05 -0.05 0.00 -0.00 0.00 0.00 60.37 60.66 2eoo h HIS 27 Cb 0.57 -0.08 -0.01 0.00 -0.00 0.00 0.00 27.41 27.89 2eoo h HIS 27 CO -0.85 -0.20 -0.06 1.25 -0.00 0.00 0.00 177.93 178.07 2eoo h LEU 28 N 0.24 0.47 -0.36 2.43 5.85 0.80 -1.05 115.31 123.69 2eoo h LEU 28 Ca 0.61 -0.36 0.01 0.00 0.84 0.00 0.00 57.88 58.98 2eoo h LEU 28 Cb 1.29 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 42.16 2eoo h LEU 28 CO -0.65 0.73 0.22 0.40 -0.34 0.00 0.00 178.44 178.80 2eoo h ILE 29 N 0.21 1.05 -0.32 4.05 1.08 0.47 -0.60 117.51 123.46 2eoo h ILE 29 Ca 0.06 -0.15 -0.03 0.00 -0.39 0.00 0.00 64.86 64.35 2eoo h ILE 29 Cb 0.52 0.57 -0.01 0.00 -3.07 0.00 0.00 36.82 34.82 2eoo h ILE 29 CO 0.02 0.08 0.10 -0.08 -0.69 0.00 0.00 178.15 177.58 2eoo h GLU 30 N 0.44 0.50 -0.07 2.37 4.81 -0.70 -3.02 114.58 118.92 2eoo h GLU 30 Ca 0.14 -0.11 0.02 0.00 -0.13 0.00 0.00 59.36 59.28 2eoo h GLU 30 Cb -0.01 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.27 2eoo h GLU 30 CO -0.06 0.54 -0.08 1.25 -0.73 0.00 0.00 179.01 179.94 2eoo h HIS 31 N 0.36 -0.18 -0.85 0.92 2.76 -0.94 -2.37 115.15 114.85 2eoo h HIS 31 Ca 0.10 0.01 0.21 0.00 -2.20 0.00 0.00 60.37 58.49 2eoo h HIS 31 Cb 0.25 0.09 -0.13 0.00 1.55 0.00 0.00 27.41 29.18 2eoo h HIS 31 CO 0.01 -0.12 0.26 -0.07 -1.30 0.00 0.00 177.93 176.71 2eoo h LEU 32 N -0.10 0.09 -0.56 0.26 3.38 -1.04 -0.05 115.31 117.28 2eoo h LEU 32 Ca 0.05 0.17 0.11 0.00 0.09 0.00 0.00 57.88 58.31 2eoo h LEU 32 Cb 0.18 0.21 -0.11 0.00 0.09 0.00 0.00 40.66 41.03 2eoo h LEU 32 CO -0.13 -0.08 -0.20 0.11 0.09 0.00 0.00 178.44 178.23 2eoo h LYS 33 N 0.27 -0.06 -1.34 1.13 1.57 -1.30 0.25 116.57 117.09 2eoo h LYS 33 Ca 0.52 0.00 0.39 0.00 -1.87 0.00 0.00 60.65 59.69 2eoo h LYS 33 Cb 0.99 0.01 -0.05 0.00 0.08 0.00 0.00 32.23 33.26 2eoo h LYS 33 CO -0.58 -0.04 1.26 0.54 -0.57 0.00 0.00 179.45 180.05 2eoo n ARG 34 N -5.42 0.01 -0.81 3.15 5.12 -0.03 0.13 116.66 118.81 2eoo n ARG 34 Ca 0.05 1.01 -0.15 0.00 -1.93 0.00 0.00 57.85 56.83 2eoo n ARG 34 Cb 0.32 -2.43 0.05 0.00 -1.16 0.00 0.00 32.46 29.24 2eoo n ARG 34 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 2eoo n HIS 35 N -3.42 1.48 0.00 -1.55 8.25 0.88 -3.95 115.22 116.92 2eoo n HIS 35 Ca 0.30 -1.76 0.00 0.00 -0.26 0.00 0.00 57.72 56.01 2eoo n HIS 35 Cb 1.66 -0.86 0.00 0.00 1.12 0.00 0.00 29.99 31.91 2eoo n HIS 35 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2eoo n PHE 36 N 0.23 0.00 -1.55 4.41 7.35 0.35 -5.07 117.46 123.18 2eoo n PHE 36 Ca 0.29 0.00 -0.50 0.00 -0.76 0.00 0.00 57.45 56.48 2eoo n PHE 36 Cb 0.68 0.13 -0.05 0.00 0.35 0.00 0.00 39.48 40.60 2eoo n PHE 36 CO 0.00 0.00 0.00 -2.13 -0.76 0.00 0.00 176.76 173.87 2eoo n ARG 37 N -2.50 0.92 -3.78 -4.13 3.00 -1.25 -4.93 116.66 103.98 2eoo n ARG 37 Ca 0.00 0.33 -0.36 0.00 -0.00 0.00 0.00 57.85 57.82 2eoo n ARG 37 Cb 0.28 -1.79 -0.12 0.00 0.00 0.00 0.00 32.46 30.84 2eoo n ARG 37 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.63 176.42 2eoo s GLU 38 N -0.35 1.99 -0.03 -0.14 2.02 -1.26 -4.94 118.70 116.00 2eoo s GLU 38 Ca 0.75 -1.84 -0.21 0.00 0.02 0.00 0.00 54.97 53.69 2eoo s GLU 38 Cb -0.91 -3.57 -0.32 0.00 0.10 0.00 0.00 34.13 29.42 2eoo s GLU 38 CO 0.53 -1.07 0.93 1.57 0.02 0.00 0.00 175.26 177.24 2eoo h LYS 39 N 8.01 0.36 -0.67 1.61 2.10 -2.00 -3.33 116.57 122.65 2eoo h LYS 39 Ca -0.12 -0.60 0.13 0.00 -2.00 0.00 0.00 60.65 58.06 2eoo h LYS 39 Cb 1.04 0.22 -0.09 0.00 -0.90 0.00 0.00 32.23 32.50 2eoo h LYS 39 CO 0.69 1.28 0.17 1.03 -2.00 0.00 0.00 179.45 180.62 2eoo h SER 40 N -0.25 0.05 -0.87 7.07 0.87 -2.02 -2.23 113.55 116.17 2eoo h SER 40 Ca -0.16 0.12 0.11 0.00 -1.23 0.00 0.00 61.79 60.63 2eoo h SER 40 Cb 1.74 0.16 -0.13 0.00 -0.44 0.00 0.00 62.40 63.73 2eoo h SER 40 CO 0.18 0.01 -0.41 -1.20 -0.53 0.00 0.00 176.83 174.88 2eoo n SER 41 N -5.12 -0.70 0.00 6.23 7.64 -1.25 -4.83 113.62 115.59 2eoo n SER 41 Ca 0.11 1.52 0.00 0.00 1.01 0.00 0.00 58.87 61.51 2eoo n SER 41 Cb 0.38 -0.29 0.00 0.00 -1.01 0.00 0.00 64.21 63.29 2eoo n SER 41 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2eoo n GLY 42 N -1.33 0.81 3.57 0.23 0.00 -0.84 -5.04 105.19 102.59 2eoo n GLY 42 Ca 0.06 -0.33 -0.27 0.00 0.00 0.00 0.00 46.02 45.48 2eoo n GLY 42 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2eoo s PRO 43 N 0.00 2.54 -0.33 1.61 0.04 -1.26 -4.91 135.00 132.69 2eoo s PRO 43 Ca 0.00 -0.67 -0.39 0.00 0.04 0.00 0.00 61.00 59.98 2eoo s PRO 43 Cb 0.00 -5.14 -0.15 0.00 0.04 0.00 0.00 34.50 29.25 2eoo s PRO 43 CO 0.00 -3.62 1.92 0.45 0.04 0.00 0.00 177.00 175.78 2eoo n SER 44 N 14.11 2.12 -3.31 6.66 2.88 -1.26 -4.88 113.62 129.94 2eoo n SER 44 Ca 0.42 0.84 -0.06 0.00 -1.33 0.00 0.00 58.87 58.75 2eoo n SER 44 Cb 0.47 -1.14 0.01 0.00 -0.75 0.00 0.00 64.21 62.80 2eoo n SER 44 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2eoo s SER 45 N 4.90 -0.05 0.00 -3.46 1.04 -1.26 -5.33 113.70 109.55 2eoo s SER 45 Ca 1.04 -0.80 0.00 0.00 0.48 0.00 0.00 55.95 56.67 2eoo s SER 45 Cb -1.07 0.65 0.00 0.00 0.10 0.00 0.00 66.02 65.70 2eoo s SER 45 CO 0.61 -1.27 0.00 0.61 0.98 0.00 0.00 173.24 174.17