#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hnx n VAL 2 N 0.00 0.49 -4.49 1.12 3.14 -1.26 -2.44 118.33 114.88 1hnx n VAL 2 Ca 0.00 -0.12 -0.25 0.00 -2.96 0.00 0.00 64.34 61.01 1hnx n VAL 2 Cb 0.00 -0.92 -0.08 0.00 -1.06 0.00 0.00 33.84 31.78 1hnx n VAL 2 CO 0.00 0.00 0.00 -0.54 -6.46 0.00 0.00 176.83 169.83 1hnx s LYS 3 N 0.04 1.93 -0.24 1.45 1.02 0.21 -1.64 119.74 122.51 1hnx s LYS 3 Ca 0.78 -2.18 -0.01 0.00 0.02 0.00 0.00 55.97 54.58 1hnx s LYS 3 Cb -0.87 -0.49 0.07 0.00 -0.52 0.00 0.00 37.83 36.03 1hnx s LYS 3 CO 0.49 -0.52 0.01 0.42 -0.92 0.00 0.00 175.35 174.83 1hnx s ILE 4 N -3.22 1.09 0.00 2.17 1.01 -1.14 -1.73 121.20 119.37 1hnx s ILE 4 Ca 0.25 -1.07 0.00 0.00 0.00 0.00 0.00 60.65 59.83 1hnx s ILE 4 Cb 0.02 -1.54 0.00 0.00 0.01 0.00 0.00 42.46 40.95 1hnx s ILE 4 CO 0.16 -0.27 0.00 -2.11 0.00 0.00 0.00 174.94 172.72 1hnx n ARG 5 N 4.82 0.00 -3.93 2.79 1.85 -0.00 -0.93 116.66 121.26 1hnx n ARG 5 Ca -0.08 0.00 -0.23 0.00 -1.00 0.00 0.00 57.85 56.54 1hnx n ARG 5 Cb 0.45 0.00 -0.02 0.00 -1.05 0.00 0.00 32.46 31.83 1hnx n ARG 5 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 1hnx s LEU 6 N 0.00 4.31 -0.15 2.89 1.02 -1.26 -0.18 118.68 125.31 1hnx s LEU 6 Ca 0.00 0.12 -0.04 0.00 0.02 0.00 0.00 54.13 54.23 1hnx s LEU 6 Cb 0.00 -2.90 0.07 0.00 0.02 0.00 0.00 46.19 43.37 1hnx s LEU 6 CO 0.00 -0.04 0.15 0.00 0.02 0.00 0.00 176.35 176.47 1hnx s ALA 7 N -1.92 0.04 0.31 4.21 0.00 -1.13 -4.88 121.76 118.39 1hnx s ALA 7 Ca 0.35 0.12 -0.28 0.00 0.00 0.00 0.00 51.96 52.14 1hnx s ALA 7 Cb -0.10 -1.05 -0.13 0.00 0.00 0.00 0.00 23.12 21.84 1hnx s ALA 7 CO 0.29 -1.00 1.13 0.54 0.00 0.00 0.00 175.76 176.72 1hnx n ARG 8 N 5.30 1.66 0.00 0.00 5.12 -1.26 -1.82 116.66 125.67 1hnx n ARG 8 Ca -0.06 0.58 0.00 0.00 -1.93 0.00 0.00 57.85 56.45 1hnx n ARG 8 Cb 0.49 -2.05 0.00 0.00 -1.16 0.00 0.00 32.46 29.75 1hnx n ARG 8 CO 0.00 0.00 0.00 1.19 -1.93 0.00 0.00 177.63 176.89 1hnx n PHE 9 N 0.34 0.00 0.00 -1.55 3.72 0.27 -4.86 117.46 115.38 1hnx n PHE 9 Ca 0.08 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.48 1hnx n PHE 9 Cb 0.33 0.03 0.00 0.00 -0.94 0.00 0.00 39.48 38.90 1hnx n PHE 9 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1hnx n GLY 10 N 0.00 -1.14 3.57 1.37 0.00 -1.13 -4.66 105.19 103.20 1hnx n GLY 10 Ca 0.00 -0.11 0.03 0.00 0.00 0.00 0.00 46.02 45.94 1hnx n GLY 10 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1hnx s SER 11 N -1.58 -0.02 -0.23 1.61 1.04 -0.12 -4.83 113.70 109.58 1hnx s SER 11 Ca 0.00 -0.04 -0.42 0.00 0.48 0.00 0.00 55.95 55.97 1hnx s SER 11 Cb 0.00 0.05 -0.19 0.00 0.10 0.00 0.00 66.02 65.98 1hnx s SER 11 CO 0.00 -0.09 1.41 1.17 0.98 0.00 0.00 173.24 176.71 1hnx n LYS 12 N -0.47 0.30 -0.85 4.02 4.81 -1.26 0.14 118.16 124.84 1hnx n LYS 12 Ca -0.09 0.11 0.00 0.00 -0.87 0.00 0.00 58.31 57.46 1hnx n LYS 12 Cb 0.63 -1.65 0.00 0.00 0.02 0.00 0.00 35.03 34.03 1hnx n LYS 12 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 1hnx n HIS 13 N 3.16 0.00 -3.06 5.64 8.25 -1.26 -4.77 115.22 123.17 1hnx n HIS 13 Ca 0.25 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.54 1hnx n HIS 13 Cb 0.04 -1.79 -0.02 0.00 1.12 0.00 0.00 29.99 29.34 1hnx n HIS 13 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1hnx n ASN 14 N -0.50 1.34 -4.68 0.41 5.15 0.36 -5.12 115.26 112.22 1hnx n ASN 14 Ca 0.00 -3.03 -0.34 0.00 -0.60 0.00 0.00 54.58 50.60 1hnx n ASN 14 Cb 0.41 -0.60 0.11 0.00 -0.53 0.00 0.00 39.78 39.18 1hnx n ASN 14 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 1hnx n PRO 15 N 0.16 0.35 -3.17 1.20 -0.04 -1.18 -0.94 135.00 131.38 1hnx n PRO 15 Ca 0.23 0.19 0.03 0.00 -0.04 0.00 0.00 63.50 63.91 1hnx n PRO 15 Cb 0.66 -2.41 -0.01 0.00 -0.04 0.00 0.00 33.50 31.70 1hnx n PRO 15 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1hnx s HIS 16 N -1.98 -1.68 0.54 0.54 3.76 -1.26 -4.57 115.29 110.64 1hnx s HIS 16 Ca 0.74 1.25 -0.06 0.00 -0.15 0.00 0.00 55.06 56.85 1hnx s HIS 16 Cb -0.31 0.37 -0.01 0.00 1.11 0.00 0.00 32.58 33.73 1hnx s HIS 16 CO 0.49 -0.99 0.85 0.71 -0.85 0.00 0.00 174.74 174.95 1hnx s TYR 17 N 2.81 3.41 -0.24 1.40 1.51 -0.79 -0.57 117.35 124.89 1hnx s TYR 17 Ca 0.14 0.74 0.01 0.00 -1.01 0.00 0.00 57.07 56.95 1hnx s TYR 17 Cb -0.12 -2.52 0.06 0.00 -0.11 0.00 0.00 41.96 39.27 1hnx s TYR 17 CO -0.24 -0.55 -0.06 1.03 -1.11 0.00 0.00 175.55 174.61 1hnx s ARG 18 N -4.87 1.74 -0.24 -0.62 0.52 -0.75 -2.43 118.95 112.30 1hnx s ARG 18 Ca 0.51 -1.06 -0.29 0.00 -0.52 0.00 0.00 55.73 54.37 1hnx s ARG 18 Cb -0.10 -2.65 -0.03 0.00 0.52 0.00 0.00 34.95 32.69 1hnx s ARG 18 CO 0.45 -0.59 1.81 0.42 0.02 0.00 0.00 175.30 177.41 1hnx s ILE 19 N 1.34 3.45 0.08 1.52 1.01 0.35 -2.83 121.20 126.12 1hnx s ILE 19 Ca -0.06 0.49 0.05 0.00 0.00 0.00 0.00 60.65 61.12 1hnx s ILE 19 Cb -0.19 -3.51 -0.03 0.00 0.01 0.00 0.00 42.46 38.73 1hnx s ILE 19 CO -0.06 -0.27 -0.13 -0.69 0.00 0.00 0.00 174.94 173.79 1hnx s VAL 20 N 6.24 1.10 0.08 2.92 1.01 0.75 -1.13 120.40 131.37 1hnx s VAL 20 Ca 0.81 -1.43 -0.08 0.00 0.00 0.00 0.00 61.98 61.28 1hnx s VAL 20 Cb -0.27 -1.19 -0.06 0.00 0.00 0.00 0.00 36.38 34.87 1hnx s VAL 20 CO 0.33 -0.32 0.37 -0.69 0.00 0.00 0.00 175.10 174.78 1hnx s VAL 21 N -1.64 5.15 -0.26 2.92 1.01 0.05 -0.82 120.40 126.82 1hnx s VAL 21 Ca 0.01 0.29 -0.35 0.00 0.00 0.00 0.00 61.98 61.93 1hnx s VAL 21 Cb -0.08 -3.62 0.16 0.00 0.00 0.00 0.00 36.38 32.84 1hnx s VAL 21 CO 0.02 0.25 1.32 0.28 0.00 0.00 0.00 175.10 176.96 1hnx s THR 22 N -1.44 0.00 0.53 3.92 -1.32 -0.70 -1.38 115.64 115.25 1hnx s THR 22 Ca 0.34 0.00 -0.19 0.00 -1.21 0.00 0.00 61.69 60.62 1hnx s THR 22 Cb -0.13 -1.00 -0.06 0.00 -1.51 0.00 0.00 72.50 69.79 1hnx s THR 22 CO 0.19 0.00 1.10 -0.62 -2.21 0.00 0.00 174.62 173.08 1hnx s ASP 23 N -1.77 5.90 0.54 8.08 -1.08 -1.26 0.67 116.67 127.74 1hnx s ASP 23 Ca 0.10 2.07 0.22 0.00 -0.52 0.00 0.00 52.55 54.42 1hnx s ASP 23 Cb -0.01 -2.57 1.47 0.00 -1.46 0.00 0.00 42.92 40.35 1hnx s ASP 23 CO -0.04 -1.09 2.17 0.00 0.52 0.00 0.00 175.17 176.72 1hnx h ALA 24 N 1.23 1.73 0.00 3.66 0.00 -1.81 -3.07 119.26 121.00 1hnx h ALA 24 Ca -0.50 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1hnx h ALA 24 Cb 1.25 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1hnx h ALA 24 CO 0.57 0.03 0.00 0.54 0.00 0.00 0.00 179.25 180.40 1hnx n ARG 25 N -4.18 0.29 -1.18 0.00 1.74 -1.26 -4.92 116.66 107.15 1hnx n ARG 25 Ca -0.03 0.01 -0.29 0.00 -0.77 0.00 0.00 57.85 56.76 1hnx n ARG 25 Cb 0.11 -1.50 0.15 0.00 -1.02 0.00 0.00 32.46 30.20 1hnx n ARG 25 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1hnx s ARG 26 N -2.71 1.02 0.60 5.56 1.81 -1.16 -5.01 118.95 119.07 1hnx s ARG 26 Ca 0.24 0.76 -0.17 0.00 -1.72 0.00 0.00 55.73 54.84 1hnx s ARG 26 Cb 0.20 -1.79 -0.03 0.00 -0.45 0.00 0.00 34.95 32.88 1hnx s ARG 26 CO 0.47 -2.39 1.11 0.15 -0.68 0.00 0.00 175.30 173.97 1hnx s LYS 27 N -4.93 3.12 0.53 3.54 1.02 -1.26 -4.88 119.74 116.88 1hnx s LYS 27 Ca 0.64 1.47 0.23 0.00 0.02 0.00 0.00 55.97 58.34 1hnx s LYS 27 Cb -0.18 -1.99 1.46 0.00 -0.52 0.00 0.00 37.83 36.60 1hnx s LYS 27 CO 0.57 -1.01 2.14 0.07 -0.92 0.00 0.00 175.35 176.20 1hnx h ARG 28 N 0.63 0.00 -0.49 1.68 0.11 -1.94 -0.50 114.38 113.87 1hnx h ARG 28 Ca -0.48 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.60 1hnx h ARG 28 Cb 1.25 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.33 1hnx h ARG 28 CO 0.56 0.07 0.00 -0.25 0.10 0.00 0.00 179.97 180.45 1hnx n ASP 29 N -4.01 3.88 -2.34 0.08 10.43 -1.26 -4.42 116.55 118.91 1hnx n ASP 29 Ca -0.03 -2.34 0.00 0.00 2.57 0.00 0.00 54.79 54.99 1hnx n ASP 29 Cb 0.16 -0.44 0.00 0.00 1.84 0.00 0.00 41.12 42.67 1hnx n ASP 29 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1hnx n GLY 30 N 0.69 -0.63 3.63 0.44 0.00 -0.20 -4.96 105.19 104.16 1hnx n GLY 30 Ca 0.20 -1.70 -0.43 0.00 0.00 0.00 0.00 46.02 44.10 1hnx n GLY 30 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1hnx s LYS 31 N -1.28 3.72 0.23 1.61 2.20 -1.26 -4.91 119.74 120.04 1hnx s LYS 31 Ca 0.00 1.75 -0.05 0.00 -0.36 0.00 0.00 55.97 57.31 1hnx s LYS 31 Cb 0.00 -4.09 -0.05 0.00 -1.51 0.00 0.00 37.83 32.17 1hnx s LYS 31 CO 0.00 -1.40 0.48 1.52 -0.36 0.00 0.00 175.35 175.59 1hnx s TYR 32 N 5.60 3.47 0.19 4.03 1.13 -1.26 -4.86 117.35 125.64 1hnx s TYR 32 Ca 0.76 0.61 -0.11 0.00 -1.41 0.00 0.00 57.07 56.93 1hnx s TYR 32 Cb -0.27 -2.07 0.11 0.00 -1.10 0.00 0.00 41.96 38.64 1hnx s TYR 32 CO 0.31 0.29 1.78 0.82 -2.51 0.00 0.00 175.55 176.24 1hnx h ILE 33 N 1.67 1.22 -1.47 -3.49 5.03 -1.59 -3.46 117.51 115.42 1hnx h ILE 33 Ca -0.47 -0.60 0.11 0.00 -0.12 0.00 0.00 64.86 63.77 1hnx h ILE 33 Cb 1.18 0.39 -0.25 0.00 -3.03 0.00 0.00 36.82 35.11 1hnx h ILE 33 CO 0.69 0.25 0.61 -0.70 -0.68 0.00 0.00 178.15 178.31 1hnx s GLU 34 N -5.75 0.47 -0.09 2.37 2.12 -1.16 -5.00 118.70 111.65 1hnx s GLU 34 Ca -0.13 0.22 -0.15 0.00 0.36 0.00 0.00 54.97 55.27 1hnx s GLU 34 Cb 0.14 0.22 -0.05 0.00 0.26 0.00 0.00 34.13 34.70 1hnx s GLU 34 CO 0.79 -0.12 0.37 0.21 -0.54 0.00 0.00 175.26 175.97 1hnx s LYS 35 N -0.73 4.12 -0.02 4.30 2.20 -1.26 -0.77 119.74 127.58 1hnx s LYS 35 Ca 0.01 0.29 0.02 0.00 -0.36 0.00 0.00 55.97 55.93 1hnx s LYS 35 Cb -0.02 -3.35 0.04 0.00 -1.51 0.00 0.00 37.83 32.99 1hnx s LYS 35 CO -0.03 0.40 0.84 0.44 -0.36 0.00 0.00 175.35 176.64 1hnx n ILE 36 N 2.93 0.63 0.00 5.43 -5.35 -0.28 -4.96 119.36 117.76 1hnx n ILE 36 Ca -0.12 -0.68 0.00 0.00 -0.27 0.00 0.00 62.75 61.68 1hnx n ILE 36 Cb 0.52 0.59 0.00 0.00 -1.74 0.00 0.00 39.64 39.01 1hnx n ILE 36 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1hnx n GLY 37 N -0.38 1.81 3.26 3.28 0.00 -0.76 -3.98 105.19 108.43 1hnx n GLY 37 Ca 0.02 -0.97 -0.14 0.00 0.00 0.00 0.00 46.02 44.92 1hnx n GLY 37 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1hnx s TYR 38 N -2.00 1.33 -0.26 1.61 -0.85 -1.19 0.13 117.35 116.13 1hnx s TYR 38 Ca 0.00 -1.19 -0.15 0.00 -0.52 0.00 0.00 57.07 55.21 1hnx s TYR 38 Cb 0.00 -0.75 0.08 0.00 0.38 0.00 0.00 41.96 41.67 1hnx s TYR 38 CO 0.00 -0.38 0.65 -0.47 -1.52 0.00 0.00 175.55 173.82 1hnx s TYR 39 N -3.84 -0.98 -0.67 -3.49 5.04 -1.02 -2.98 117.35 109.41 1hnx s TYR 39 Ca 0.34 1.99 -0.05 0.00 -2.44 0.00 0.00 57.07 56.91 1hnx s TYR 39 Cb 0.07 0.57 0.17 0.00 0.35 0.00 0.00 41.96 43.12 1hnx s TYR 39 CO 0.10 -0.49 0.51 0.34 -1.34 0.00 0.00 175.55 174.67 1hnx s ASP 40 N 1.55 5.56 0.65 4.32 3.68 -1.14 -1.88 116.67 129.40 1hnx s ASP 40 Ca -0.09 -2.83 0.11 0.00 2.13 0.00 0.00 52.55 51.86 1hnx s ASP 40 Cb -0.06 -1.93 0.45 0.00 -1.45 0.00 0.00 42.92 39.93 1hnx s ASP 40 CO -0.18 -0.41 1.20 -0.65 0.13 0.00 0.00 175.17 175.26 1hnx h PRO 41 N 7.18 0.00 -0.22 4.34 0.11 -1.87 0.43 132.00 141.97 1hnx h PRO 41 Ca 0.01 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.12 1hnx h PRO 41 Cb 0.97 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.08 1hnx h PRO 41 CO 0.72 0.00 0.00 0.54 -0.21 0.00 0.00 178.00 179.05 1hnx n ARG 42 N -2.76 2.75 -3.35 1.05 1.74 -1.26 -5.01 116.66 109.82 1hnx n ARG 42 Ca 0.06 -2.20 -0.16 0.00 -0.77 0.00 0.00 57.85 54.78 1hnx n ARG 42 Cb 1.05 -1.38 0.00 0.00 -1.02 0.00 0.00 32.46 31.10 1hnx n ARG 42 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1hnx n LYS 43 N -0.16 -0.93 0.00 5.56 4.01 0.15 -4.77 118.16 122.03 1hnx n LYS 43 Ca 0.12 0.42 0.14 0.00 -0.51 0.00 0.00 58.31 58.48 1hnx n LYS 43 Cb 0.53 -1.35 0.56 0.00 -0.51 0.00 0.00 35.03 34.26 1hnx n LYS 43 CO 0.00 0.00 0.00 0.25 -1.11 0.00 0.00 177.40 176.54 1hnx n THR 44 N -1.93 0.00 -3.74 -0.18 -2.24 -1.26 -4.85 114.28 100.09 1hnx n THR 44 Ca -0.19 -0.09 -0.14 0.00 -2.27 0.00 0.00 64.05 61.35 1hnx n THR 44 Cb 0.43 0.07 -0.08 0.00 -2.10 0.00 0.00 70.33 68.65 1hnx n THR 44 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1hnx s THR 45 N -2.41 0.05 0.46 4.28 -4.23 -1.26 -5.05 115.64 107.48 1hnx s THR 45 Ca 0.29 -0.43 0.24 0.00 -1.18 0.00 0.00 61.69 60.61 1hnx s THR 45 Cb 0.20 -0.65 0.44 0.00 1.34 0.00 0.00 72.50 73.83 1hnx s THR 45 CO 0.47 -0.24 1.82 1.55 -0.54 0.00 0.00 174.62 177.68 1hnx h PRO 46 N 3.79 0.24 -3.58 3.99 0.13 -2.02 -3.08 132.00 131.47 1hnx h PRO 46 Ca -0.29 -0.01 -0.80 0.00 -0.87 0.00 0.00 66.00 64.02 1hnx h PRO 46 Cb 1.17 -0.05 -0.28 0.00 0.13 0.00 0.00 31.00 31.97 1hnx h PRO 46 CO 0.40 0.16 0.50 -3.47 -0.23 0.00 0.00 178.00 175.35 1hnx n ASP 47 N -4.45 5.54 -1.88 1.44 4.64 -1.26 -4.85 116.55 115.74 1hnx n ASP 47 Ca 0.23 -3.05 -0.22 0.00 -1.38 0.00 0.00 54.79 50.37 1hnx n ASP 47 Cb 0.93 -1.38 0.09 0.00 -1.04 0.00 0.00 41.12 39.72 1hnx n ASP 47 CO 0.00 0.00 0.00 -2.67 -0.82 0.00 0.00 177.20 173.71 1hnx n TRP 48 N 2.72 2.45 0.00 -0.67 4.27 -1.17 -4.85 117.44 120.19 1hnx n TRP 48 Ca 0.24 -2.28 0.00 0.00 -3.89 0.00 0.00 57.50 51.57 1hnx n TRP 48 Cb 0.39 -0.72 0.00 0.00 -1.36 0.00 0.00 31.31 29.62 1hnx n TRP 48 CO 0.00 0.00 0.00 -0.11 -2.29 0.00 0.00 177.69 175.29 1hnx n LEU 49 N -0.90 0.00 -4.90 5.67 7.94 -1.26 -2.90 117.00 120.66 1hnx n LEU 49 Ca 0.47 0.00 -0.28 0.00 -1.11 0.00 0.00 56.01 55.09 1hnx n LEU 49 Cb 0.92 0.00 -0.01 0.00 0.53 0.00 0.00 43.42 44.86 1hnx n LEU 49 CO 0.46 0.00 0.45 -0.75 -1.11 0.00 0.00 177.39 176.44 1hnx s LYS 50 N 0.00 3.60 0.00 1.96 2.20 -1.16 -4.96 119.74 121.38 1hnx s LYS 50 Ca 0.00 0.28 0.00 0.00 -0.36 0.00 0.00 55.97 55.89 1hnx s LYS 50 Cb 0.00 -2.37 0.00 0.00 -1.51 0.00 0.00 37.83 33.95 1hnx s LYS 50 CO 0.00 -0.17 0.00 0.28 -0.36 0.00 0.00 175.35 175.10 1hnx n VAL 51 N -2.02 0.00 -3.87 4.02 0.31 -1.26 -3.13 118.33 112.37 1hnx n VAL 51 Ca 0.01 0.00 -0.38 0.00 -0.01 0.00 0.00 64.34 63.96 1hnx n VAL 51 Cb 0.55 0.39 0.03 0.00 -0.91 0.00 0.00 33.84 33.90 1hnx n VAL 51 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1hnx n ASP 52 N 0.00 -4.56 -0.23 4.52 2.03 -1.26 -4.58 116.55 112.47 1hnx n ASP 52 Ca 0.00 -1.15 0.32 0.00 0.52 0.00 0.00 54.79 54.48 1hnx n ASP 52 Cb 0.00 -2.59 0.73 0.00 -0.72 0.00 0.00 41.12 38.54 1hnx n ASP 52 CO 0.00 0.00 0.00 -0.37 -1.92 0.00 0.00 177.20 174.91 1hnx h VAL 53 N -2.23 0.39 -0.01 5.18 -1.51 -1.89 -1.71 116.25 114.48 1hnx h VAL 53 Ca -0.69 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 64.79 1hnx h VAL 53 Cb 1.38 0.44 -0.01 0.00 -2.13 0.00 0.00 31.29 30.97 1hnx h VAL 53 CO 0.51 0.00 -0.09 -0.08 -1.23 0.00 0.00 177.57 176.68 1hnx h GLU 54 N 0.00 -0.10 -0.35 5.19 4.57 -1.98 -2.10 114.58 119.81 1hnx h GLU 54 Ca 0.48 0.01 0.07 0.00 -1.18 0.00 0.00 59.36 58.74 1hnx h GLU 54 Cb 2.05 0.02 -0.07 0.00 -0.16 0.00 0.00 28.75 30.60 1hnx h GLU 54 CO -0.01 -0.07 -0.08 0.00 -1.18 0.00 0.00 179.01 177.68 1hnx h ARG 55 N -0.11 0.01 -0.23 1.92 2.47 -1.64 -2.85 114.38 113.95 1hnx h ARG 55 Ca 0.00 -0.00 0.02 0.00 -1.26 0.00 0.00 59.98 58.74 1hnx h ARG 55 Cb 0.12 -0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 28.41 1hnx h ARG 55 CO -0.06 0.01 -0.15 0.00 0.56 0.00 0.00 179.97 180.32 1hnx h ALA 56 N 1.34 -0.20 -1.27 0.04 0.00 -1.33 0.45 119.26 118.29 1hnx h ALA 56 Ca 0.17 0.03 0.39 0.00 0.00 0.00 0.00 54.91 55.50 1hnx h ALA 56 Cb 0.25 1.05 -0.11 0.00 0.00 0.00 0.00 17.79 18.98 1hnx h ALA 56 CO -0.35 -0.30 0.83 0.00 0.00 0.00 0.00 179.25 179.43 1hnx h ARG 57 N -0.02 0.15 0.70 0.00 3.08 -1.15 0.23 114.38 117.37 1hnx h ARG 57 Ca 0.04 -0.01 -0.03 0.00 0.07 0.00 0.00 59.98 60.04 1hnx h ARG 57 Cb 0.12 -0.03 0.01 0.00 0.08 0.00 0.00 29.97 30.14 1hnx h ARG 57 CO -0.23 0.10 -0.34 -0.92 -1.07 0.00 0.00 179.97 177.51 1hnx h TYR 58 N 0.15 -0.87 -0.09 3.04 5.03 0.01 0.60 116.97 124.85 1hnx h TYR 58 Ca 0.76 -0.02 0.04 0.00 2.58 0.00 0.00 58.73 62.08 1hnx h TYR 58 Cb 2.34 0.29 -0.05 0.00 1.55 0.00 0.00 36.73 40.86 1hnx h TYR 58 CO -0.00 -0.52 -0.21 -1.49 -1.32 0.00 0.00 178.16 174.61 1hnx h TRP 59 N -1.02 -0.56 -0.82 -3.82 4.06 0.10 0.29 115.95 114.18 1hnx h TRP 59 Ca -0.10 0.02 0.19 0.00 2.06 0.00 0.00 58.89 61.07 1hnx h TRP 59 Cb 0.74 0.26 -0.05 0.00 -1.00 0.00 0.00 29.16 29.11 1hnx h TRP 59 CO -0.01 -0.29 0.55 -0.07 -3.56 0.00 0.00 178.44 175.06 1hnx h LEU 60 N -0.29 0.29 0.00 -4.49 3.38 -1.08 0.88 115.31 114.00 1hnx h LEU 60 Ca 0.09 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1hnx h LEU 60 Cb 0.42 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1hnx h LEU 60 CO -0.26 0.13 0.00 -1.54 0.09 0.00 0.00 178.44 176.86 1hnx n SER 61 N -4.45 0.00 -2.71 -0.43 3.41 0.10 -3.16 113.62 106.38 1hnx n SER 61 Ca 0.17 -0.25 -0.06 0.00 -0.26 0.00 0.00 58.87 58.47 1hnx n SER 61 Cb 0.68 -0.00 0.07 0.00 -0.26 0.00 0.00 64.21 64.70 1hnx n SER 61 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1hnx n VAL 62 N -1.00 0.68 -0.74 -3.33 0.31 0.30 -5.00 118.33 109.55 1hnx n VAL 62 Ca 0.06 -2.38 0.00 0.00 -0.01 0.00 0.00 64.34 62.01 1hnx n VAL 62 Cb 0.03 0.94 0.00 0.00 -0.91 0.00 0.00 33.84 33.89 1hnx n VAL 62 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1hnx n GLY 63 N -0.51 0.90 3.77 2.92 0.00 -1.19 -5.01 105.19 106.07 1hnx n GLY 63 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 1hnx n GLY 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hnx s ALA 64 N -3.50 3.60 -0.26 4.61 0.00 -1.09 -4.63 121.76 120.49 1hnx s ALA 64 Ca 0.00 1.48 0.00 0.00 0.00 0.00 0.00 51.96 53.44 1hnx s ALA 64 Cb 0.00 -3.58 0.08 0.00 0.00 0.00 0.00 23.12 19.61 1hnx s ALA 64 CO 0.00 -0.92 0.01 -1.14 0.00 0.00 0.00 175.76 173.72 1hnx s GLN 65 N -1.48 1.23 0.48 0.00 2.00 -0.65 -4.59 119.66 116.64 1hnx s GLN 65 Ca 0.55 -1.05 -0.24 0.00 -2.00 0.00 0.00 55.36 52.62 1hnx s GLN 65 Cb -0.45 -2.45 -0.07 0.00 0.80 0.00 0.00 33.01 30.84 1hnx s GLN 65 CO 0.55 -0.75 1.41 -1.25 -0.50 0.00 0.00 175.29 174.75 1hnx s PRO 66 N 1.45 3.51 1.13 1.67 0.04 -1.26 -2.90 135.00 138.64 1hnx s PRO 66 Ca 0.01 2.36 -0.14 0.00 0.04 0.00 0.00 61.00 63.27 1hnx s PRO 66 Cb -0.18 -2.53 0.25 0.00 0.04 0.00 0.00 34.50 32.09 1hnx s PRO 66 CO -0.12 -0.94 1.06 0.99 0.04 0.00 0.00 177.00 178.03 1hnx s THR 67 N -1.23 1.90 -0.00 1.26 2.01 -0.11 -4.74 115.64 114.73 1hnx s THR 67 Ca 0.64 0.00 -0.04 0.00 0.31 0.00 0.00 61.69 62.60 1hnx s THR 67 Cb -0.43 -2.30 -0.02 0.00 0.01 0.00 0.00 72.50 69.76 1hnx s THR 67 CO 0.54 0.00 0.62 0.44 -0.69 0.00 0.00 174.62 175.52 1hnx h ASP 68 N -2.39 -0.13 -1.51 3.53 3.32 -1.95 -1.32 116.42 115.96 1hnx h ASP 68 Ca -0.56 0.00 0.47 0.00 0.02 0.00 0.00 57.03 56.96 1hnx h ASP 68 Cb 1.33 0.03 -0.10 0.00 0.22 0.00 0.00 39.33 40.81 1hnx h ASP 68 CO 0.51 -0.05 1.03 0.74 -1.72 0.00 0.00 179.24 179.75 1hnx h THR 69 N -0.25 0.13 0.10 0.35 2.02 -1.97 1.06 112.91 114.34 1hnx h THR 69 Ca -0.02 -0.02 -0.00 0.00 0.77 0.00 0.00 66.41 67.14 1hnx h THR 69 Cb 0.12 0.07 0.00 0.00 -1.74 0.00 0.00 68.15 66.60 1hnx h THR 69 CO 0.03 0.01 -0.05 0.00 0.37 0.00 0.00 175.52 175.88 1hnx h ALA 70 N 1.39 -0.13 -0.50 6.16 0.00 -1.83 -2.42 119.26 121.92 1hnx h ALA 70 Ca 0.82 -0.17 0.07 0.00 0.00 0.00 0.00 54.91 55.64 1hnx h ALA 70 Cb 2.90 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 20.71 1hnx h ALA 70 CO -0.24 -0.41 0.34 -0.09 0.00 0.00 0.00 179.25 178.85 1hnx h ARG 71 N -0.47 0.36 -0.38 0.00 2.43 0.23 0.36 114.38 116.91 1hnx h ARG 71 Ca -0.01 -0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.15 1hnx h ARG 71 Cb 0.39 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.83 1hnx h ARG 71 CO 0.02 0.24 0.23 -0.09 -1.51 0.00 0.00 179.97 178.86 1hnx h ARG 72 N 0.37 0.46 -0.12 0.20 2.43 -0.59 0.13 114.38 117.26 1hnx h ARG 72 Ca 0.22 -0.03 -0.20 0.00 -0.81 0.00 0.00 59.98 59.17 1hnx h ARG 72 Cb 0.41 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.86 1hnx h ARG 72 CO -0.06 0.30 -0.74 -0.07 -1.51 0.00 0.00 179.97 177.90 1hnx h LEU 73 N 0.47 0.71 0.62 3.80 3.38 -0.86 -1.68 115.31 121.76 1hnx h LEU 73 Ca 0.15 -0.46 -0.03 0.00 0.09 0.00 0.00 57.88 57.62 1hnx h LEU 73 Cb -0.02 -0.21 0.01 0.00 0.09 0.00 0.00 40.66 40.53 1hnx h LEU 73 CO -0.06 1.23 -0.30 -0.07 0.09 0.00 0.00 178.44 179.34 1hnx h LEU 74 N 0.42 -0.70 -0.59 1.67 3.38 -0.60 -1.48 115.31 117.40 1hnx h LEU 74 Ca -0.04 0.01 0.10 0.00 0.09 0.00 0.00 57.88 58.04 1hnx h LEU 74 Cb 1.34 0.18 -0.07 0.00 0.09 0.00 0.00 40.66 42.20 1hnx h LEU 74 CO 0.14 -0.48 0.18 -0.09 0.09 0.00 0.00 178.44 178.28 1hnx h ARG 75 N -0.86 0.33 -1.46 1.13 2.43 -0.81 0.22 114.38 115.36 1hnx h ARG 75 Ca -0.09 -0.02 0.43 0.00 -0.81 0.00 0.00 59.98 59.49 1hnx h ARG 75 Cb 0.65 -0.08 -0.08 0.00 -0.42 0.00 0.00 29.97 30.05 1hnx h ARG 75 CO 0.14 0.22 1.03 0.37 -1.51 0.00 0.00 179.97 180.22 1hnx h GLN 76 N 0.35 0.05 -0.87 0.20 -0.00 -0.66 2.27 115.11 116.45 1hnx h GLN 76 Ca 0.30 -0.00 -0.59 0.00 -0.00 0.00 0.00 58.65 58.36 1hnx h GLN 76 Cb 0.39 -0.01 -0.32 0.00 0.00 0.00 0.00 27.48 27.54 1hnx h GLN 76 CO -0.33 0.03 0.24 0.00 0.00 0.00 0.00 178.83 178.77 1hnx n ALA 77 N -2.76 5.72 -4.32 3.38 0.00 0.62 -4.92 120.51 118.24 1hnx n ALA 77 Ca 0.34 -3.52 -0.34 0.00 0.00 0.00 0.00 53.44 49.91 1hnx n ALA 77 Cb 1.50 -1.21 -0.07 0.00 0.00 0.00 0.00 19.45 19.67 1hnx n ALA 77 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hnx n GLY 78 N -0.88 -0.26 0.20 0.00 0.00 0.77 -4.78 105.19 100.24 1hnx n GLY 78 Ca 0.54 0.14 0.08 0.00 0.00 0.00 0.00 46.02 46.79 1hnx n GLY 78 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1hnx h VAL 79 N -1.49 0.57 0.00 1.61 2.07 -1.20 -3.33 116.25 114.49 1hnx h VAL 79 Ca -0.63 -1.37 -0.29 0.00 0.82 0.00 0.00 66.70 65.23 1hnx h VAL 79 Cb 1.39 1.94 -0.05 0.00 -1.52 0.00 0.00 31.29 33.05 1hnx h VAL 79 CO 0.76 0.26 -2.09 0.49 0.02 0.00 0.00 177.57 177.01 1hnx n PHE 80 N -3.32 0.00 -1.54 1.57 3.01 -1.26 -4.90 117.46 111.02 1hnx n PHE 80 Ca 0.01 0.00 -0.61 0.00 1.01 0.00 0.00 57.45 57.86 1hnx n PHE 80 Cb 0.51 -0.78 -0.10 0.00 -0.01 0.00 0.00 39.48 39.10 1hnx n PHE 80 CO 0.00 0.00 0.00 -2.13 1.01 0.00 0.00 176.76 175.64 1hnx n ARG 81 N -2.66 0.33 -0.01 -1.08 0.63 -1.25 -4.82 116.66 107.79 1hnx n ARG 81 Ca -0.27 0.11 0.10 0.00 -0.92 0.00 0.00 57.85 56.87 1hnx n ARG 81 Cb 0.99 -1.72 0.10 0.00 0.45 0.00 0.00 32.46 32.28 1hnx n ARG 81 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1hnx n GLN 82 N 5.93 1.95 0.00 -0.14 10.64 -1.26 -4.97 117.38 129.52 1hnx n GLN 82 Ca 0.40 -1.78 0.00 0.00 -1.83 0.00 0.00 57.00 53.78 1hnx n GLN 82 Cb 0.01 -1.41 0.00 0.00 -0.86 0.00 0.00 30.24 27.99 1hnx n GLN 82 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62 1hnx n GLU 83 N 1.19 0.00 -0.44 2.61 -0.58 -1.26 -4.59 120.64 117.57 1hnx n GLU 83 Ca 0.13 0.00 0.08 0.00 -0.42 0.00 0.00 57.16 56.95 1hnx n GLU 83 Cb 0.53 0.00 0.28 0.00 -0.57 0.00 0.00 31.44 31.67 1hnx n GLU 83 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1hnx n ALA 84 N 0.00 2.82 -3.72 0.62 0.00 -1.26 -4.93 120.51 114.04 1hnx n ALA 84 Ca 0.00 -1.18 -0.22 0.00 0.00 0.00 0.00 53.44 52.04 1hnx n ALA 84 Cb 0.00 -1.00 -0.02 0.00 0.00 0.00 0.00 19.45 18.42 1hnx n ALA 84 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1hnx n ARG 85 N 0.95 -0.77 -0.04 0.00 1.85 -1.26 -4.83 116.66 112.56 1hnx n ARG 85 Ca 0.20 -0.08 -0.09 0.00 -1.00 0.00 0.00 57.85 56.88 1hnx n ARG 85 Cb 0.66 -1.47 -0.08 0.00 -1.05 0.00 0.00 32.46 30.53 1hnx n ARG 85 CO 0.00 0.00 0.00 1.49 -0.01 0.00 0.00 177.63 179.11 1hnx h GLU 86 N -0.33 -0.04 0.24 2.89 4.57 -1.94 -3.40 114.58 116.56 1hnx h GLU 86 Ca -0.38 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 57.79 1hnx h GLU 86 Cb 0.78 0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 29.38 1hnx h GLU 86 CO 0.34 0.53 -0.15 0.78 -1.18 0.00 0.00 179.01 179.33 1hnx h GLY 87 N -0.96 -0.60 1.00 1.92 0.00 -2.04 -3.56 103.07 98.82 1hnx h GLY 87 Ca -0.00 0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.58 1hnx h GLY 87 CO 0.01 -0.21 0.00 0.00 0.00 0.00 0.00 176.54 176.34