#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hky s TYR 2 N 0.00 1.13 0.05 2.11 -0.85 -1.26 -4.92 117.35 113.61 1hky s TYR 2 Ca 0.00 0.72 -0.30 0.00 -0.52 0.00 0.00 57.07 56.96 1hky s TYR 2 Cb 0.00 -3.34 -0.08 0.00 0.38 0.00 0.00 41.96 38.92 1hky s TYR 2 CO 0.00 -3.56 1.77 -1.59 -1.52 0.00 0.00 175.55 170.65 1hky s LYS 3 N -5.17 4.17 0.26 -3.49 0.00 -1.26 -4.88 119.74 109.37 1hky s LYS 3 Ca 0.68 2.43 0.11 0.00 0.00 0.00 0.00 55.97 59.20 1hky s LYS 3 Cb -0.14 -3.80 0.31 0.00 0.00 0.00 0.00 37.83 34.19 1hky s LYS 3 CO 0.57 -0.83 1.57 0.22 0.00 0.00 0.00 175.35 176.88 1hky h ASP 4 N 9.14 0.00 0.00 0.03 1.82 -1.91 -3.43 116.42 122.07 1hky h ASP 4 Ca -0.44 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.20 1hky h ASP 4 Cb 1.21 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.22 1hky h ASP 4 CO 0.94 0.64 0.00 -0.67 -1.61 0.00 0.00 179.24 178.54 1hky n ASP 5 N -3.67 0.00 0.00 2.28 -0.08 -1.26 -5.07 116.55 108.75 1hky n ASP 5 Ca -0.01 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.27 1hky n ASP 5 Cb 0.65 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.11 1hky n ASP 5 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 1hky n ASP 6 N -0.79 0.00 -4.89 1.67 2.03 -1.26 -5.13 116.55 108.18 1hky n ASP 6 Ca 0.00 0.00 -0.23 0.00 0.52 0.00 0.00 54.79 55.08 1hky n ASP 6 Cb 0.00 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.38 1hky n ASP 6 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1hky s ASP 7 N -1.64 4.88 0.40 1.67 2.15 -1.26 -4.96 116.67 117.90 1hky s ASP 7 Ca 0.00 -0.94 -0.03 0.00 0.43 0.00 0.00 52.55 52.01 1hky s ASP 7 Cb 0.00 -0.18 -0.04 0.00 -0.30 0.00 0.00 42.92 42.41 1hky s ASP 7 CO 0.00 -0.85 0.66 -0.54 -0.17 0.00 0.00 175.17 174.27 1hky s LYS 8 N -4.21 3.54 0.27 4.34 1.02 -1.26 -4.52 119.74 118.92 1hky s LYS 8 Ca 0.44 -0.03 0.02 0.00 0.02 0.00 0.00 55.97 56.42 1hky s LYS 8 Cb -0.03 -2.53 -0.04 0.00 -0.52 0.00 0.00 37.83 34.72 1hky s LYS 8 CO 0.26 -0.00 0.15 0.14 -0.92 0.00 0.00 175.35 174.98 1hky s VAL 9 N -2.48 0.24 -0.28 3.17 -7.23 -1.26 -5.06 120.40 107.50 1hky s VAL 9 Ca 0.44 -2.00 0.09 0.00 -1.81 0.00 0.00 61.98 58.70 1hky s VAL 9 Cb -0.10 -2.53 0.49 0.00 0.56 0.00 0.00 36.38 34.79 1hky s VAL 9 CO 0.39 0.00 1.42 0.29 -0.31 0.00 0.00 175.10 176.88 1hky n LYS 10 N -0.47 1.88 -0.20 4.82 4.76 -1.26 -4.60 118.16 123.10 1hky n LYS 10 Ca 0.02 -3.27 0.07 0.00 -2.87 0.00 0.00 58.31 52.26 1hky n LYS 10 Cb 0.65 -1.81 0.21 0.00 -1.84 0.00 0.00 35.03 32.24 1hky n LYS 10 CO 0.00 0.00 0.00 -0.11 -1.37 0.00 0.00 177.40 175.92 1hky n LEU 11 N -1.10 2.22 -4.69 -0.35 7.94 -1.26 -4.87 117.00 114.89 1hky n LEU 11 Ca 0.32 -1.09 -0.40 0.00 -1.11 0.00 0.00 56.01 53.73 1hky n LEU 11 Cb 0.96 -0.26 -0.05 0.00 0.53 0.00 0.00 43.42 44.60 1hky n LEU 11 CO 0.17 0.54 0.40 -0.89 -1.11 0.00 0.00 177.39 176.50 1hky s THR 12 N -1.48 5.03 0.00 1.96 2.01 -1.26 -4.84 115.64 117.06 1hky s THR 12 Ca 0.29 1.31 0.00 0.00 0.31 0.00 0.00 61.69 63.60 1hky s THR 12 Cb 0.15 -3.99 0.00 0.00 0.01 0.00 0.00 72.50 68.67 1hky s THR 12 CO 0.20 0.16 0.00 0.00 -0.69 0.00 0.00 174.62 174.30 1hky s TYR 14 N 0.00 2.82 0.00 0.00 6.14 -1.26 -4.50 117.35 120.55 1hky s TYR 14 Ca 0.00 -0.16 0.00 0.00 0.64 0.00 0.00 57.07 57.55 1hky s TYR 14 Cb 0.00 -1.33 0.00 0.00 0.42 0.00 0.00 41.96 41.05 1hky s TYR 14 CO 0.00 0.55 0.00 1.04 0.64 0.00 0.00 175.55 177.78 1hky n GLN 15 N -0.41 0.00 -1.55 4.97 6.02 -1.12 -4.64 117.38 120.65 1hky n GLN 15 Ca -0.09 0.00 -0.38 0.00 -0.01 0.00 0.00 57.00 56.52 1hky n GLN 15 Cb 0.56 0.00 -0.04 0.00 1.02 0.00 0.00 30.24 31.78 1hky n GLN 15 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 1hky n ASN 16 N 3.01 2.20 0.00 1.08 5.15 -1.26 -1.38 115.26 124.05 1hky n ASN 16 Ca 0.00 -0.32 0.00 0.00 -0.60 0.00 0.00 54.58 53.66 1hky n ASN 16 Cb 0.00 -1.50 0.00 0.00 -0.53 0.00 0.00 39.78 37.75 1hky n ASN 16 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1hky n GLY 17 N 6.06 -0.00 1.17 8.20 0.00 -1.26 -4.75 105.19 114.61 1hky n GLY 17 Ca 0.40 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.42 1hky n GLY 17 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1hky n VAL 18 N -0.01 -3.18 -1.51 1.61 0.31 -1.26 -4.88 118.33 109.41 1hky n VAL 18 Ca 0.00 1.43 -0.36 0.00 -0.01 0.00 0.00 64.34 65.40 1hky n VAL 18 Cb 0.14 -2.12 0.08 0.00 -0.91 0.00 0.00 33.84 31.03 1hky n VAL 18 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 1hky n SER 19 N -1.61 1.04 -4.63 4.52 7.64 -0.89 -4.79 113.62 114.90 1hky n SER 19 Ca 0.00 0.74 -0.30 0.00 1.01 0.00 0.00 58.87 60.32 1hky n SER 19 Cb 0.17 -1.45 -0.09 0.00 -1.01 0.00 0.00 64.21 61.83 1hky n SER 19 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1hky s PHE 20 N -1.64 2.85 0.23 1.43 0.08 -1.26 -2.93 117.98 116.74 1hky s PHE 20 Ca 0.77 -0.10 -0.22 0.00 0.12 0.00 0.00 56.93 57.49 1hky s PHE 20 Cb -0.37 -1.47 0.04 0.00 -0.57 0.00 0.00 43.02 40.65 1hky s PHE 20 CO 0.46 0.46 0.83 -0.08 -0.10 0.00 0.00 175.22 176.79 1hky s THR 21 N -1.30 0.00 0.00 0.64 -1.32 0.15 -4.97 115.64 108.84 1hky s THR 21 Ca 0.24 -0.86 0.00 0.00 -1.21 0.00 0.00 61.69 59.86 1hky s THR 21 Cb -0.11 -2.07 0.00 0.00 -1.51 0.00 0.00 72.50 68.81 1hky s THR 21 CO 0.16 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.18 1hky n GLY 22 N -0.47 1.89 2.77 6.08 0.00 -1.26 -1.68 105.19 112.51 1hky n GLY 22 Ca -0.05 -0.22 -0.24 0.00 0.00 0.00 0.00 46.02 45.52 1hky n GLY 22 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hky n GLY 23 N 0.00 -2.68 3.07 -0.02 0.00 -1.16 -4.82 105.19 99.58 1hky n GLY 23 Ca 0.00 -1.49 -0.34 0.00 0.00 0.00 0.00 46.02 44.19 1hky n GLY 23 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hky s LYS 24 N -4.96 1.98 0.16 1.61 1.02 -1.26 -4.89 119.74 113.40 1hky s LYS 24 Ca 0.56 -2.05 -0.31 0.00 0.02 0.00 0.00 55.97 54.19 1hky s LYS 24 Cb -0.05 -3.50 -0.11 0.00 -0.52 0.00 0.00 37.83 33.65 1hky s LYS 24 CO 0.43 -1.06 1.75 0.00 -0.92 0.00 0.00 175.35 175.54 1hky s ALA 25 N 0.72 3.84 0.45 5.17 0.00 -1.26 -4.85 121.76 125.82 1hky s ALA 25 Ca 0.11 1.49 0.37 0.00 0.00 0.00 0.00 51.96 53.93 1hky s ALA 25 Cb -0.22 -3.72 1.88 0.00 0.00 0.00 0.00 23.12 21.07 1hky s ALA 25 CO -0.05 -1.04 2.19 -0.84 0.00 0.00 0.00 175.76 176.02 1hky h ILE 26 N 4.25 0.15 -1.40 0.00 -0.00 -1.77 -3.44 117.51 115.31 1hky h ILE 26 Ca -0.44 -0.27 0.13 0.00 -0.00 0.00 0.00 64.86 64.28 1hky h ILE 26 Cb 1.21 1.22 -0.25 0.00 -0.00 0.00 0.00 36.82 39.00 1hky h ILE 26 CO 0.95 0.03 0.67 -0.55 -0.00 0.00 0.00 178.15 179.25 1hky s SER 27 N -5.58 -0.27 -0.04 2.16 0.15 -1.20 -5.04 113.70 103.88 1hky s SER 27 Ca -0.03 0.32 -0.03 0.00 0.70 0.00 0.00 55.95 56.91 1hky s SER 27 Cb 0.12 0.26 0.01 0.00 -1.71 0.00 0.00 66.02 64.70 1hky s SER 27 CO 0.49 -0.23 0.10 -1.61 1.20 0.00 0.00 173.24 173.19 1hky s GLU 28 N -0.94 0.10 0.38 5.44 2.02 -1.26 -0.32 118.70 124.12 1hky s GLU 28 Ca 0.02 0.16 0.08 0.00 0.02 0.00 0.00 54.97 55.24 1hky s GLU 28 Cb -0.01 0.01 -0.02 0.00 0.10 0.00 0.00 34.13 34.21 1hky s GLU 28 CO -0.02 -0.04 0.39 0.00 0.02 0.00 0.00 175.26 175.60 1hky s ALA 29 N 0.23 4.08 -0.65 5.21 0.00 -0.54 -4.90 121.76 125.18 1hky s ALA 29 Ca -0.01 -1.74 0.03 0.00 0.00 0.00 0.00 51.96 50.24 1hky s ALA 29 Cb -0.02 -1.22 0.36 0.00 0.00 0.00 0.00 23.12 22.23 1hky s ALA 29 CO -0.01 -0.14 1.26 1.17 0.00 0.00 0.00 175.76 178.04 1hky n LYS 30 N -1.54 3.65 -4.12 0.00 0.00 -1.26 0.11 118.16 115.00 1hky n LYS 30 Ca 0.02 -4.61 -0.28 0.00 0.00 0.00 0.00 58.31 53.44 1hky n LYS 30 Cb 0.60 -2.29 -0.07 0.00 0.00 0.00 0.00 35.03 33.28 1hky n LYS 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1hky s ALA 31 N -3.71 3.42 -0.97 3.14 0.00 -1.26 -4.85 121.76 117.53 1hky s ALA 31 Ca 0.47 -1.20 0.24 0.00 0.00 0.00 0.00 51.96 51.47 1hky s ALA 31 Cb 0.31 -1.25 0.35 0.00 0.00 0.00 0.00 23.12 22.53 1hky s ALA 31 CO -0.18 0.57 1.31 0.00 0.00 0.00 0.00 175.76 177.46 1hky n ALA 32 N 0.01 3.73 -2.76 0.00 0.00 -1.26 -2.17 120.51 118.05 1hky n ALA 32 Ca -0.09 -0.39 -0.16 0.00 0.00 0.00 0.00 53.44 52.80 1hky n ALA 32 Cb 0.54 -1.06 -0.14 0.00 0.00 0.00 0.00 19.45 18.79 1hky n ALA 32 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1hky s SER 33 N -3.09 0.65 0.51 0.00 1.04 -1.26 -4.77 113.70 106.78 1hky s SER 33 Ca 0.10 -0.13 0.20 0.00 0.48 0.00 0.00 55.95 56.60 1hky s SER 33 Cb 0.17 -0.06 1.29 0.00 0.10 0.00 0.00 66.02 67.52 1hky s SER 33 CO 0.73 0.05 2.05 -1.28 0.98 0.00 0.00 173.24 175.77 1hky h SER 34 N 5.90 0.06 -0.70 7.02 0.87 -1.94 -1.86 113.55 122.90 1hky h SER 34 Ca -0.29 0.00 0.15 0.00 -1.23 0.00 0.00 61.79 60.43 1hky h SER 34 Cb 1.19 -0.01 -0.11 0.00 -0.44 0.00 0.00 62.40 63.03 1hky h SER 34 CO 0.49 0.04 0.10 -0.61 -0.53 0.00 0.00 176.83 176.32 1hky h GLN 35 N 0.06 0.19 0.00 2.24 5.75 -1.99 1.10 115.11 122.47 1hky h GLN 35 Ca 0.17 -0.01 -0.09 0.00 -0.15 0.00 0.00 58.65 58.57 1hky h GLN 35 Cb 0.58 -0.04 -0.01 0.00 1.07 0.00 0.00 27.48 29.08 1hky h GLN 35 CO -0.01 0.13 -0.41 0.00 -2.65 0.00 0.00 178.83 175.89 1hky h ALA 36 N 1.61 0.93 0.00 3.38 0.00 -1.77 -2.49 119.26 120.92 1hky h ALA 36 Ca 0.39 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1hky h ALA 36 Cb 0.65 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1hky h ALA 36 CO -0.53 0.51 0.00 0.00 0.00 0.00 0.00 179.25 179.22 1hky h GLN 38 N 0.00 0.01 -0.07 0.00 1.08 0.13 -1.70 115.11 114.55 1hky h GLN 38 Ca 0.00 -0.02 -0.04 0.00 -1.45 0.00 0.00 58.65 57.15 1hky h GLN 38 Cb 0.75 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 28.18 1hky h GLN 38 CO 0.00 1.01 -0.13 0.93 -0.95 0.00 0.00 178.83 179.69 1hky h GLU 39 N -0.98 0.11 -0.03 1.46 4.39 -1.53 -0.50 114.58 117.50 1hky h GLU 39 Ca -0.06 -0.02 -0.04 0.00 0.34 0.00 0.00 59.36 59.58 1hky h GLU 39 Cb 1.07 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.70 1hky h GLU 39 CO -0.03 0.25 -0.13 1.25 -1.16 0.00 0.00 179.01 179.19 1hky h LEU 40 N 0.11 0.16 -2.02 1.33 7.12 -1.50 -3.17 115.31 117.33 1hky h LEU 40 Ca 0.02 -0.66 -0.01 0.00 0.13 0.00 0.00 57.88 57.36 1hky h LEU 40 Cb 0.30 -0.05 -0.00 0.00 -0.53 0.00 0.00 40.66 40.38 1hky h LEU 40 CO 0.02 0.80 -0.04 0.00 -0.13 0.00 0.00 178.44 179.08 1hky h GLU 42 N 0.00 0.00 -0.67 0.00 4.39 -1.07 -2.14 114.58 115.08 1hky h GLU 42 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1hky h GLU 42 Cb 0.08 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.73 1hky h GLU 42 CO 0.01 0.14 0.00 1.63 -1.16 0.00 0.00 179.01 179.63 1hky n LYS 43 N -3.44 2.11 -4.25 2.33 4.76 -0.31 -4.82 118.16 114.55 1hky n LYS 43 Ca -0.01 -1.03 -0.17 0.00 -2.87 0.00 0.00 58.31 54.23 1hky n LYS 43 Cb 0.31 -1.59 -0.14 0.00 -1.84 0.00 0.00 35.03 31.77 1hky n LYS 43 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1hky s ASP 44 N -0.49 0.99 -0.05 4.39 -1.08 -0.81 -5.04 116.67 114.58 1hky s ASP 44 Ca 0.18 -0.26 0.04 0.00 -0.52 0.00 0.00 52.55 51.99 1hky s ASP 44 Cb 0.13 -0.07 -0.25 0.00 -1.46 0.00 0.00 42.92 41.27 1hky s ASP 44 CO 0.07 0.03 0.64 0.00 0.52 0.00 0.00 175.17 176.43 1hky h ALA 45 N 5.53 0.58 -0.00 3.66 0.00 -1.87 -3.31 119.26 123.85 1hky h ALA 45 Ca -0.32 -1.37 0.00 0.00 0.00 0.00 0.00 54.91 53.22 1hky h ALA 45 Cb 1.19 0.49 0.00 0.00 0.00 0.00 0.00 17.79 19.47 1hky h ALA 45 CO 0.47 1.43 0.00 1.63 0.00 0.00 0.00 179.25 182.78 1hky n LYS 46 N -3.24 1.00 -3.13 0.00 5.02 -1.26 -4.79 118.16 111.75 1hky n LYS 46 Ca -0.20 -0.00 -0.39 0.00 -2.02 0.00 0.00 58.31 55.69 1hky n LYS 46 Cb 1.04 -1.12 -0.05 0.00 -0.02 0.00 0.00 35.03 34.88 1hky n LYS 46 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1hky n ARG 48 N 3.71 0.00 -3.71 0.00 1.74 -1.25 -5.02 116.66 112.13 1hky n ARG 48 Ca -0.03 0.00 -0.35 0.00 -0.77 0.00 0.00 57.85 56.69 1hky n ARG 48 Cb 0.51 0.00 -0.09 0.00 -1.02 0.00 0.00 32.46 31.87 1hky n ARG 48 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1hky s PHE 49 N -2.00 3.60 0.82 -1.55 0.08 -0.73 -4.81 117.98 113.39 1hky s PHE 49 Ca 0.00 -2.91 -0.11 0.00 0.12 0.00 0.00 56.93 54.03 1hky s PHE 49 Cb 0.00 -3.16 0.09 0.00 -0.57 0.00 0.00 43.02 39.37 1hky s PHE 49 CO 0.00 -0.77 1.09 -0.59 -0.10 0.00 0.00 175.22 174.85 1hky s PHE 50 N -0.71 2.49 -0.31 0.36 -0.71 -1.23 -1.44 117.98 116.42 1hky s PHE 50 Ca 0.22 1.41 0.05 0.00 -1.04 0.00 0.00 56.93 57.57 1hky s PHE 50 Cb -0.14 -3.09 0.19 0.00 -1.21 0.00 0.00 43.02 38.76 1hky s PHE 50 CO -0.08 -2.03 0.54 0.99 -1.34 0.00 0.00 175.22 173.30 1hky s THR 51 N -2.93 -0.88 0.48 -4.49 2.01 0.37 -2.44 115.64 107.76 1hky s THR 51 Ca 0.62 -0.12 -0.09 0.00 0.31 0.00 0.00 61.69 62.42 1hky s THR 51 Cb -0.17 -0.84 -0.05 0.00 0.01 0.00 0.00 72.50 71.45 1hky s THR 51 CO 0.56 -0.10 0.84 -0.22 -0.69 0.00 0.00 174.62 175.01 1hky s LEU 52 N 2.56 3.62 0.00 4.42 2.96 0.12 -0.33 118.68 132.03 1hky s LEU 52 Ca 0.11 1.13 0.00 0.00 -0.22 0.00 0.00 54.13 55.15 1hky s LEU 52 Cb -0.10 -4.07 0.00 0.00 0.50 0.00 0.00 46.19 42.52 1hky s LEU 52 CO -0.23 -0.57 0.00 0.00 -1.32 0.00 0.00 176.35 174.22 1hky n ALA 53 N -1.98 0.00 0.25 5.97 0.00 0.19 0.11 120.51 125.05 1hky n ALA 53 Ca 0.03 0.00 0.18 0.00 0.00 0.00 0.00 53.44 53.64 1hky n ALA 53 Cb 0.54 0.00 0.83 0.00 0.00 0.00 0.00 19.45 20.82 1hky n ALA 53 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1hky h SER 54 N 0.00 0.00 0.00 0.00 0.02 -1.92 -3.34 113.55 108.32 1hky h SER 54 Ca 0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 1hky h SER 54 Cb 0.00 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 1hky h SER 54 CO 0.00 0.00 -0.02 0.61 -1.14 0.00 0.00 176.83 176.28 1hky n GLY 55 N -1.31 -0.79 3.47 -3.77 0.00 -1.26 -4.83 105.19 96.70 1hky n GLY 55 Ca 0.01 -0.01 0.01 0.00 0.00 0.00 0.00 46.02 46.03 1hky n GLY 55 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1hky s LYS 56 N 0.01 0.38 0.55 1.61 2.20 -0.92 -4.20 119.74 119.37 1hky s LYS 56 Ca 0.01 0.96 -0.08 0.00 -0.36 0.00 0.00 55.97 56.50 1hky s LYS 56 Cb 0.03 0.58 -0.03 0.00 -1.51 0.00 0.00 37.83 36.89 1hky s LYS 56 CO -0.01 -0.14 0.89 0.00 -0.36 0.00 0.00 175.35 175.73 1hky s SER 58 N -4.15 -0.74 -0.11 0.00 0.01 0.55 -1.46 113.70 107.79 1hky s SER 58 Ca 0.51 0.66 -0.13 0.00 1.31 0.00 0.00 55.95 58.29 1hky s SER 58 Cb -0.11 1.76 -0.05 0.00 0.21 0.00 0.00 66.02 67.84 1hky s SER 58 CO 0.48 -0.27 0.31 -1.48 0.41 0.00 0.00 173.24 172.69 1hky s LEU 59 N 2.74 4.33 -0.06 2.44 2.34 0.57 0.14 118.68 131.17 1hky s LEU 59 Ca 0.17 0.63 0.05 0.00 0.06 0.00 0.00 54.13 55.04 1hky s LEU 59 Cb -0.15 -2.40 -0.01 0.00 -0.56 0.00 0.00 46.19 43.08 1hky s LEU 59 CO -0.19 0.20 -0.23 -0.36 -1.06 0.00 0.00 176.35 174.72 1hky s PHE 60 N -0.15 2.24 0.00 3.48 0.40 -0.52 -2.01 117.98 121.41 1hky s PHE 60 Ca 0.19 -0.70 0.00 0.00 -0.60 0.00 0.00 56.93 55.81 1hky s PHE 60 Cb -0.14 -1.48 0.00 0.00 0.51 0.00 0.00 43.02 41.91 1hky s PHE 60 CO 0.07 -0.23 0.00 0.00 0.70 0.00 0.00 175.22 175.75 1hky n ALA 61 N 3.10 0.00 -1.69 5.36 0.00 -1.25 -1.78 120.51 124.26 1hky n ALA 61 Ca -0.18 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 52.99 1hky n ALA 61 Cb 0.52 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.93 1hky n ALA 61 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1hky s ASP 62 N -1.00 4.42 0.03 0.00 -1.08 -1.26 -4.83 116.67 112.95 1hky s ASP 62 Ca 0.00 0.38 -0.00 0.00 -0.52 0.00 0.00 52.55 52.41 1hky s ASP 62 Cb 0.00 -2.53 0.00 0.00 -1.46 0.00 0.00 42.92 38.93 1hky s ASP 62 CO 0.00 -3.18 0.04 -0.67 0.52 0.00 0.00 175.17 171.89 1hky n ASP 63 N 16.31 -0.13 0.00 -0.34 2.03 -1.26 -5.07 116.55 128.09 1hky n ASP 63 Ca 0.39 -1.14 0.00 0.00 0.52 0.00 0.00 54.79 54.56 1hky n ASP 63 Cb 0.49 0.23 0.00 0.00 -0.72 0.00 0.00 41.12 41.12 1hky n ASP 63 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1hky n ALA 64 N -2.82 0.61 0.71 -1.67 0.00 -1.26 -4.93 120.51 111.15 1hky n ALA 64 Ca -0.01 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.56 1hky n ALA 64 Cb 0.05 0.00 0.36 0.00 0.00 0.00 0.00 19.45 19.85 1hky n ALA 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1hky n ALA 65 N 0.00 2.60 -2.23 0.00 0.00 -1.26 -4.83 120.51 114.79 1hky n ALA 65 Ca 0.00 -0.13 -0.38 0.00 0.00 0.00 0.00 53.44 52.93 1hky n ALA 65 Cb 0.35 -1.35 -0.06 0.00 0.00 0.00 0.00 19.45 18.39 1hky n ALA 65 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 1hky s LEU 66 N -4.03 4.48 0.12 0.00 2.34 -1.26 -3.00 118.68 117.33 1hky s LEU 66 Ca 0.10 1.30 -0.03 0.00 0.06 0.00 0.00 54.13 55.56 1hky s LEU 66 Cb 0.14 -3.10 -0.03 0.00 -0.56 0.00 0.00 46.19 42.64 1hky s LEU 66 CO 0.63 0.21 0.10 -0.13 -1.06 0.00 0.00 176.35 176.10 1hky s ARG 67 N -1.37 0.91 0.02 1.48 3.00 -0.68 -4.85 118.95 117.46 1hky s ARG 67 Ca 0.33 -1.30 -0.00 0.00 0.00 0.00 0.00 55.73 54.76 1hky s ARG 67 Cb -0.19 0.27 0.00 0.00 0.00 0.00 0.00 34.95 35.04 1hky s ARG 67 CO 0.20 -0.27 0.02 -0.35 0.00 0.00 0.00 175.30 174.90 1hky n PRO 68 N -0.08 -0.90 0.11 3.54 -0.04 -1.26 -0.67 135.00 135.70 1hky n PRO 68 Ca -0.08 -0.03 0.00 0.00 -0.04 0.00 0.00 63.50 63.35 1hky n PRO 68 Cb 0.63 -0.02 0.00 0.00 -0.04 0.00 0.00 33.50 34.07 1hky n PRO 68 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 1hky n THR 69 N -2.47 0.00 -3.56 0.52 5.66 -1.15 -4.60 114.28 108.68 1hky n THR 69 Ca 0.00 0.00 -0.07 0.00 -3.05 0.00 0.00 64.05 60.93 1hky n THR 69 Cb 0.01 0.00 -0.02 0.00 -1.55 0.00 0.00 70.33 68.77 1hky n THR 69 CO 0.00 0.00 0.00 -1.59 -3.05 0.00 0.00 175.07 170.43 1hky s LYS 70 N -2.00 0.95 -0.65 1.09 -2.85 -1.26 -5.03 119.74 109.98 1hky s LYS 70 Ca 0.00 -0.40 0.03 0.00 -1.00 0.00 0.00 55.97 54.60 1hky s LYS 70 Cb 0.00 0.40 0.16 0.00 -2.06 0.00 0.00 37.83 36.33 1hky s LYS 70 CO 0.00 -0.42 0.44 -1.54 0.10 0.00 0.00 175.35 173.92 1hky s SER 71 N -2.61 4.80 -0.01 0.03 1.04 -1.26 -2.09 113.70 113.59 1hky s SER 71 Ca 0.06 -3.47 0.19 0.00 0.48 0.00 0.00 55.95 53.21 1hky s SER 71 Cb -0.01 -1.68 0.54 0.00 0.10 0.00 0.00 66.02 64.97 1hky s SER 71 CO -0.07 -0.17 1.46 -0.67 0.98 0.00 0.00 173.24 174.77 1hky n ASP 72 N 2.53 3.69 0.00 7.02 2.03 -1.26 -4.81 116.55 125.75 1hky n ASP 72 Ca 0.14 -2.04 0.00 0.00 0.52 0.00 0.00 54.79 53.41 1hky n ASP 72 Cb 0.34 -0.42 0.00 0.00 -0.72 0.00 0.00 41.12 40.33 1hky n ASP 72 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1hky n GLY 73 N 1.23 -0.11 3.86 0.27 0.00 -1.26 -4.92 105.19 104.27 1hky n GLY 73 Ca 0.21 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.87 1hky n GLY 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hky s ALA 74 N -0.39 3.77 0.28 4.61 0.00 -1.26 -3.92 121.76 124.85 1hky s ALA 74 Ca 0.00 -0.42 0.08 0.00 0.00 0.00 0.00 51.96 51.62 1hky s ALA 74 Cb 0.00 -2.21 -0.06 0.00 0.00 0.00 0.00 23.12 20.85 1hky s ALA 74 CO 0.00 0.57 -0.09 0.08 0.00 0.00 0.00 175.76 176.32 1hky s VAL 75 N -1.22 1.86 0.23 0.00 1.01 0.12 -4.22 120.40 118.18 1hky s VAL 75 Ca 0.26 -2.18 -0.16 0.00 0.00 0.00 0.00 61.98 59.90 1hky s VAL 75 Cb -0.14 -2.42 0.01 0.00 0.00 0.00 0.00 36.38 33.82 1hky s VAL 75 CO 0.14 -0.33 0.54 -0.44 0.00 0.00 0.00 175.10 175.01 1hky s SER 76 N -3.47 -0.18 -0.17 3.32 0.01 -0.48 0.15 113.70 112.89 1hky s SER 76 Ca 0.29 -0.70 -0.15 0.00 1.31 0.00 0.00 55.95 56.70 1hky s SER 76 Cb 0.02 0.61 0.04 0.00 0.21 0.00 0.00 66.02 66.90 1hky s SER 76 CO 0.12 -1.15 0.44 -0.83 0.41 0.00 0.00 173.24 172.23 1hky s GLY 77 N -2.95 -0.33 0.06 3.44 0.00 -1.02 -2.78 107.32 103.75 1hky s GLY 77 Ca 0.15 1.26 -0.09 0.00 0.00 0.00 0.00 44.72 46.05 1hky s GLY 77 CO 0.04 1.12 0.18 0.54 0.00 0.00 0.00 173.10 174.98 1hky s ASN 78 N 0.33 0.09 -0.13 1.64 2.20 -1.26 -3.55 114.94 114.26 1hky s ASN 78 Ca -0.01 -0.52 0.16 0.00 -0.94 0.00 0.00 52.86 51.56 1hky s ASN 78 Cb -0.03 0.30 -0.24 0.00 -2.00 0.00 0.00 41.25 39.28 1hky s ASN 78 CO -0.01 -0.63 0.34 0.29 -2.94 0.00 0.00 177.10 174.15 1hky n LYS 79 N 0.36 0.66 -4.44 3.55 5.02 -1.26 -4.91 118.16 117.14 1hky n LYS 79 Ca -0.17 0.11 -0.22 0.00 -2.02 0.00 0.00 58.31 56.01 1hky n LYS 79 Cb 0.60 -1.64 -0.16 0.00 -0.02 0.00 0.00 35.03 33.81 1hky n LYS 79 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1hky s ARG 80 N -2.57 1.32 -0.23 1.97 1.81 -1.26 -5.04 118.95 114.94 1hky s ARG 80 Ca -0.08 -0.31 -0.16 0.00 -1.72 0.00 0.00 55.73 53.47 1hky s ARG 80 Cb 0.07 -1.15 -0.10 0.00 -0.45 0.00 0.00 34.95 33.32 1hky s ARG 80 CO 0.83 0.02 -0.31 0.00 -0.68 0.00 0.00 175.30 175.16 1hky s ILE 82 N -2.63 0.96 0.16 0.00 -4.36 -1.26 -5.12 121.20 108.94 1hky s ILE 82 Ca -0.33 -0.81 -0.30 0.00 -0.26 0.00 0.00 60.65 58.95 1hky s ILE 82 Cb 0.10 -1.34 -0.07 0.00 1.25 0.00 0.00 42.46 42.40 1hky s ILE 82 CO 0.46 -0.13 0.98 -1.48 0.24 0.00 0.00 174.94 175.01 1hky s LEU 83 N 1.66 4.54 0.02 0.37 2.34 -1.26 -5.05 118.68 121.30 1hky s LEU 83 Ca -0.03 1.88 -0.15 0.00 0.06 0.00 0.00 54.13 55.90 1hky s LEU 83 Cb -0.18 -3.60 0.02 0.00 -0.56 0.00 0.00 46.19 41.88 1hky s LEU 83 CO -0.07 -0.03 0.32 -0.76 -1.06 0.00 0.00 176.35 174.75 1hky s LEU 84 N -0.40 0.83 -0.04 1.48 1.43 -1.26 -5.05 118.68 115.68 1hky s LEU 84 Ca 0.46 -0.06 0.06 0.00 -1.03 0.00 0.00 54.13 53.55 1hky s LEU 84 Cb -0.25 1.35 0.08 0.00 0.03 0.00 0.00 46.19 47.40 1hky s LEU 84 CO 0.31 -0.55 0.94 -0.62 0.23 0.00 0.00 176.35 176.67 1hky n GLU 85 N 0.85 0.91 0.00 1.70 1.02 -1.26 -5.28 120.64 118.58 1hky n GLU 85 Ca -0.20 -1.45 0.11 0.00 -0.02 0.00 0.00 57.16 55.60 1hky n GLU 85 Cb 0.58 -0.88 0.09 0.00 -0.02 0.00 0.00 31.44 31.21 1hky n GLU 85 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06