#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hky n TYR 2 N 0.00 -2.28 -3.64 2.11 0.18 -1.26 -5.13 117.16 107.14 1hky n TYR 2 Ca 0.00 0.00 -0.03 0.00 1.88 0.00 0.00 57.90 59.75 1hky n TYR 2 Cb 0.00 0.00 -0.01 0.00 -0.38 0.00 0.00 39.34 38.95 1hky n TYR 2 CO 0.00 0.00 0.00 0.36 -2.08 0.00 0.00 176.86 175.14 1hky n LYS 3 N -0.61 0.14 -0.06 -3.48 2.85 -1.26 -5.07 118.16 110.67 1hky n LYS 3 Ca 0.00 -0.52 -0.09 0.00 -1.05 0.00 0.00 58.31 56.64 1hky n LYS 3 Cb 0.00 0.51 -0.15 0.00 -0.65 0.00 0.00 35.03 34.74 1hky n LYS 3 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1hky n ASP 4 N -2.00 0.43 0.00 -5.58 9.92 -1.26 -4.98 116.55 113.09 1hky n ASP 4 Ca 0.00 0.21 0.00 0.00 -0.53 0.00 0.00 54.79 54.47 1hky n ASP 4 Cb 0.11 0.47 0.00 0.00 -0.64 0.00 0.00 41.12 41.06 1hky n ASP 4 CO 0.00 0.00 0.00 -0.67 0.13 0.00 0.00 177.20 176.66 1hky n ASP 5 N -2.90 0.00 0.00 -2.24 2.03 -1.26 -3.79 116.55 108.40 1hky n ASP 5 Ca -0.25 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.06 1hky n ASP 5 Cb 1.11 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.51 1hky n ASP 5 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 1hky n ASP 6 N 2.88 0.00 -4.09 1.67 -0.08 -1.26 -5.16 116.55 110.52 1hky n ASP 6 Ca 0.00 0.00 -0.10 0.00 -1.51 0.00 0.00 54.79 53.18 1hky n ASP 6 Cb 0.00 0.00 -0.07 0.00 2.34 0.00 0.00 41.12 43.39 1hky n ASP 6 CO 0.00 0.00 0.00 -1.81 0.12 0.00 0.00 177.20 175.51 1hky s ASP 7 N 1.00 0.02 0.00 1.67 1.11 -1.25 -5.12 116.67 114.10 1hky s ASP 7 Ca 0.00 -1.14 0.00 0.00 0.18 0.00 0.00 52.55 51.59 1hky s ASP 7 Cb 0.00 0.49 0.00 0.00 1.07 0.00 0.00 42.92 44.48 1hky s ASP 7 CO 0.00 -1.00 0.00 0.29 1.18 0.00 0.00 175.17 175.64 1hky n LYS 8 N -0.33 0.00 -3.82 8.23 4.76 -1.26 -4.88 118.16 120.86 1hky n LYS 8 Ca 0.00 0.13 -0.30 0.00 -2.87 0.00 0.00 58.31 55.27 1hky n LYS 8 Cb 0.64 -0.57 -0.15 0.00 -1.84 0.00 0.00 35.03 33.11 1hky n LYS 8 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 1hky s VAL 9 N -0.32 1.47 0.23 -0.18 -7.23 -1.26 -5.09 120.40 108.01 1hky s VAL 9 Ca 0.00 -2.02 -0.02 0.00 -1.81 0.00 0.00 61.98 58.13 1hky s VAL 9 Cb 0.00 -2.08 0.01 0.00 0.56 0.00 0.00 36.38 34.87 1hky s VAL 9 CO 0.00 -0.71 0.33 0.29 -0.31 0.00 0.00 175.10 174.70 1hky n LYS 10 N 4.30 0.48 -2.95 4.82 4.76 -1.26 -5.04 118.16 123.27 1hky n LYS 10 Ca 0.02 -1.81 -0.11 0.00 -2.87 0.00 0.00 58.31 53.54 1hky n LYS 10 Cb 0.40 1.77 0.01 0.00 -1.84 0.00 0.00 35.03 35.37 1hky n LYS 10 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 1hky n LEU 11 N 0.00 -6.95 0.00 -0.35 4.77 -1.26 -5.01 117.00 108.20 1hky n LEU 11 Ca 0.00 0.57 0.00 0.00 -0.03 0.00 0.00 56.01 56.56 1hky n LEU 11 Cb 0.38 -3.05 0.00 0.00 -2.33 0.00 0.00 43.42 38.43 1hky n LEU 11 CO 0.19 -2.11 0.00 0.35 -1.33 0.00 0.00 177.39 174.49 1hky n THR 12 N -0.05 0.00 1.01 -5.08 -2.24 -1.26 -4.76 114.28 101.90 1hky n THR 12 Ca 0.06 0.00 0.10 0.00 -2.27 0.00 0.00 64.05 61.95 1hky n THR 12 Cb 0.42 0.00 0.53 0.00 -2.10 0.00 0.00 70.33 69.19 1hky n THR 12 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1hky s TYR 14 N -2.55 3.69 -0.08 0.00 5.04 -1.26 -4.26 117.35 117.94 1hky s TYR 14 Ca 0.20 0.90 -0.03 0.00 -2.44 0.00 0.00 57.07 55.71 1hky s TYR 14 Cb 0.14 -2.24 0.04 0.00 0.35 0.00 0.00 41.96 40.25 1hky s TYR 14 CO 0.32 0.63 0.16 -0.65 -1.34 0.00 0.00 175.55 174.67 1hky s GLN 15 N -0.97 0.06 -0.26 4.97 -1.52 -1.08 -4.95 119.66 115.90 1hky s GLN 15 Ca 0.22 0.50 0.00 0.00 -1.95 0.00 0.00 55.36 54.13 1hky s GLN 15 Cb -0.16 -0.24 0.25 0.00 -0.22 0.00 0.00 33.01 32.65 1hky s GLN 15 CO 0.11 -0.26 1.74 -1.71 -0.25 0.00 0.00 175.29 174.92 1hky n ASN 16 N 4.93 4.98 0.00 5.90 2.85 -1.26 -1.81 115.26 130.85 1hky n ASN 16 Ca -0.12 -2.89 0.11 0.00 -0.11 0.00 0.00 54.58 51.56 1hky n ASN 16 Cb 0.50 -0.87 0.57 0.00 1.24 0.00 0.00 39.78 41.22 1hky n ASN 16 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1hky n GLY 17 N 0.10 -1.02 7.00 8.20 0.00 -1.26 -4.90 105.19 113.32 1hky n GLY 17 Ca 0.28 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1hky n GLY 17 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1hky n VAL 18 N -1.28 0.00 -1.68 1.61 0.24 -1.26 -4.28 118.33 111.68 1hky n VAL 18 Ca 0.11 0.00 -0.46 0.00 -2.04 0.00 0.00 64.34 61.95 1hky n VAL 18 Cb 0.18 0.00 -0.04 0.00 -1.47 0.00 0.00 33.84 32.51 1hky n VAL 18 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 1hky n SER 19 N -3.72 3.54 -4.94 -1.34 2.88 -1.26 -4.36 113.62 104.42 1hky n SER 19 Ca 0.00 1.00 -0.24 0.00 -1.33 0.00 0.00 58.87 58.30 1hky n SER 19 Cb 0.00 -1.44 0.03 0.00 -0.75 0.00 0.00 64.21 62.05 1hky n SER 19 CO 0.00 0.00 0.00 -0.36 -1.23 0.00 0.00 175.04 173.45 1hky s PHE 20 N 2.89 3.16 0.24 0.66 0.08 -1.26 -2.08 117.98 121.68 1hky s PHE 20 Ca 0.86 0.37 -0.15 0.00 0.12 0.00 0.00 56.93 58.13 1hky s PHE 20 Cb -0.62 -2.59 0.00 0.00 -0.57 0.00 0.00 43.02 39.24 1hky s PHE 20 CO 0.44 -0.67 0.51 0.95 -0.10 0.00 0.00 175.22 176.35 1hky s THR 21 N -2.79 0.01 0.00 0.64 -4.23 0.21 -4.82 115.64 104.65 1hky s THR 21 Ca 0.52 -1.24 0.00 0.00 -1.18 0.00 0.00 61.69 59.79 1hky s THR 21 Cb -0.10 -2.05 0.00 0.00 1.34 0.00 0.00 72.50 71.69 1hky s THR 21 CO 0.41 -0.04 0.00 0.61 -0.54 0.00 0.00 174.62 175.06 1hky n GLY 22 N -0.38 1.79 3.80 3.99 0.00 -1.26 -0.65 105.19 112.48 1hky n GLY 22 Ca -0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.67 1hky n GLY 22 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1hky s GLY 23 N 0.00 1.70 -1.10 -0.02 0.00 -1.25 -4.76 107.32 101.89 1hky s GLY 23 Ca 0.00 0.16 -0.12 0.00 0.00 0.00 0.00 44.72 44.76 1hky s GLY 23 CO 0.00 0.48 1.18 0.54 0.00 0.00 0.00 173.10 175.31 1hky s LYS 24 N -4.94 4.07 0.21 2.90 -0.14 -1.26 -4.96 119.74 115.61 1hky s LYS 24 Ca 0.59 -2.84 -0.32 0.00 -1.36 0.00 0.00 55.97 52.04 1hky s LYS 24 Cb -0.15 -4.74 -0.14 0.00 -1.68 0.00 0.00 37.83 31.12 1hky s LYS 24 CO 0.54 -1.45 1.40 0.00 -0.76 0.00 0.00 175.35 175.08 1hky n ALA 25 N 4.05 0.81 0.11 5.17 0.00 -1.26 -4.78 120.51 124.62 1hky n ALA 25 Ca 0.27 0.43 0.05 0.00 0.00 0.00 0.00 53.44 54.19 1hky n ALA 25 Cb 0.42 -2.24 0.01 0.00 0.00 0.00 0.00 19.45 17.63 1hky n ALA 25 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.50 176.66 1hky h ILE 26 N 3.10 0.48 -1.46 0.00 -0.00 -1.86 -3.48 117.51 114.28 1hky h ILE 26 Ca -0.45 -1.76 0.13 0.00 -0.00 0.00 0.00 64.86 62.78 1hky h ILE 26 Cb 1.28 2.08 -0.24 0.00 -0.00 0.00 0.00 36.82 39.95 1hky h ILE 26 CO 0.77 0.27 0.65 -0.55 -0.00 0.00 0.00 178.15 179.29 1hky s SER 27 N -6.03 -0.28 0.01 2.16 0.15 -1.19 -5.06 113.70 103.45 1hky s SER 27 Ca 0.02 0.29 0.01 0.00 0.70 0.00 0.00 55.95 56.96 1hky s SER 27 Cb 0.08 0.23 -0.01 0.00 -1.71 0.00 0.00 66.02 64.62 1hky s SER 27 CO 0.76 -0.27 -0.03 -1.61 1.20 0.00 0.00 173.24 173.29 1hky s GLU 28 N -1.21 0.24 0.54 5.44 2.02 -1.26 -1.15 118.70 123.33 1hky s GLU 28 Ca 0.01 -0.24 0.04 0.00 0.02 0.00 0.00 54.97 54.81 1hky s GLU 28 Cb -0.01 -0.14 0.03 0.00 0.10 0.00 0.00 34.13 34.11 1hky s GLU 28 CO -0.01 0.03 0.33 0.00 0.02 0.00 0.00 175.26 175.63 1hky s ALA 29 N -0.43 4.41 -0.53 5.21 0.00 -0.15 -4.91 121.76 125.36 1hky s ALA 29 Ca -0.03 -1.03 0.07 0.00 0.00 0.00 0.00 51.96 50.97 1hky s ALA 29 Cb -0.03 -0.59 0.25 0.00 0.00 0.00 0.00 23.12 22.75 1hky s ALA 29 CO -0.00 -0.37 0.66 1.63 0.00 0.00 0.00 175.76 177.67 1hky n LYS 30 N -1.69 1.79 -4.42 0.00 5.02 -1.26 -0.72 118.16 116.87 1hky n LYS 30 Ca -0.05 -4.07 -0.26 0.00 -2.02 0.00 0.00 58.31 51.90 1hky n LYS 30 Cb 0.65 -1.83 -0.09 0.00 -0.02 0.00 0.00 35.03 33.74 1hky n LYS 30 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1hky s ALA 31 N -1.97 3.21 -0.34 7.82 0.00 -1.26 -4.91 121.76 124.31 1hky s ALA 31 Ca 0.38 -2.12 0.22 0.00 0.00 0.00 0.00 51.96 50.44 1hky s ALA 31 Cb 0.16 -0.15 -0.29 0.00 0.00 0.00 0.00 23.12 22.84 1hky s ALA 31 CO -0.05 -0.03 0.62 0.00 0.00 0.00 0.00 175.76 176.30 1hky n ALA 32 N -0.98 3.41 -2.59 0.00 0.00 -1.26 -2.97 120.51 116.12 1hky n ALA 32 Ca -0.04 -0.54 -0.22 0.00 0.00 0.00 0.00 53.44 52.64 1hky n ALA 32 Cb 0.64 -0.76 -0.14 0.00 0.00 0.00 0.00 19.45 19.18 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 -4.06 1.71 0.53 0.00 1.04 -1.26 -4.88 113.70 106.78 1hky s SER 33 Ca -0.03 -0.34 0.19 0.00 0.48 0.00 0.00 55.95 56.25 1hky s SER 33 Cb 0.15 -0.16 1.34 0.00 0.10 0.00 0.00 66.02 67.45 1hky s SER 33 CO 0.89 0.12 2.14 0.28 0.98 0.00 0.00 173.24 177.65 1hky h SER 34 N 5.43 0.00 -0.86 7.02 0.02 -1.92 -2.13 113.55 121.12 1hky h SER 34 Ca -0.36 0.00 0.18 0.00 -0.84 0.00 0.00 61.79 60.76 1hky h SER 34 Cb 1.17 0.00 -0.11 0.00 0.14 0.00 0.00 62.40 63.60 1hky h SER 34 CO 0.47 0.00 0.40 -0.61 -1.14 0.00 0.00 176.83 175.95 1hky h GLN 35 N 0.00 0.50 -0.20 3.45 4.15 -1.99 0.31 115.11 121.33 1hky h GLN 35 Ca 0.04 -0.03 -0.14 0.00 0.77 0.00 0.00 58.65 59.29 1hky h GLN 35 Cb 0.16 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 27.72 1hky h GLN 35 CO -0.00 0.33 -0.47 0.00 -1.93 0.00 0.00 178.83 176.76 1hky h ALA 36 N 1.62 0.81 0.00 3.38 0.00 -1.82 -2.67 119.26 120.57 1hky h ALA 36 Ca 0.50 -0.47 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 1hky h ALA 36 Cb 0.81 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 1hky h ALA 36 CO -0.43 0.66 -0.21 0.00 0.00 0.00 0.00 179.25 179.27 1hky h GLN 38 N 0.00 -0.04 0.00 0.00 1.08 -0.29 -2.14 115.11 113.73 1hky h GLN 38 Ca -0.00 0.00 -0.06 0.00 -1.45 0.00 0.00 58.65 57.14 1hky h GLN 38 Cb 0.57 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 28.00 1hky h GLN 38 CO 0.03 0.62 -0.29 0.93 -0.95 0.00 0.00 178.83 179.17 1hky h GLU 39 N -0.76 0.00 0.43 1.46 4.39 -1.41 -0.13 114.58 118.56 1hky h GLU 39 Ca -0.00 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.68 1hky h GLU 39 Cb 0.68 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.33 1hky h GLU 39 CO 0.01 0.29 -0.20 1.25 -1.16 0.00 0.00 179.01 179.20 1hky h LEU 40 N 0.00 -0.48 -1.86 1.33 7.12 -1.20 -3.09 115.31 117.13 1hky h LEU 40 Ca -0.00 -0.09 -0.03 0.00 0.13 0.00 0.00 57.88 57.89 1hky h LEU 40 Cb 0.55 0.13 -0.00 0.00 -0.53 0.00 0.00 40.66 40.80 1hky h LEU 40 CO 0.04 -0.07 -0.13 0.00 -0.13 0.00 0.00 178.44 178.15 1hky h GLU 42 N 0.00 0.00 0.00 0.00 5.08 -0.99 0.29 114.58 118.96 1hky h GLU 42 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1hky h GLU 42 Cb 0.34 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1hky h GLU 42 CO 0.02 0.11 0.00 1.63 -1.00 0.00 0.00 179.01 179.77 1hky n LYS 43 N -4.04 0.24 -3.94 2.33 4.76 -0.63 -4.80 118.16 112.09 1hky n LYS 43 Ca -0.02 0.24 -0.28 0.00 -2.87 0.00 0.00 58.31 55.37 1hky n LYS 43 Cb 0.20 -1.80 -0.04 0.00 -1.84 0.00 0.00 35.03 31.55 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 -4.41 6.33 -0.17 4.39 2.15 0.09 -5.01 116.67 120.04 1hky s ASP 44 Ca 0.10 0.21 0.16 0.00 0.43 0.00 0.00 52.55 53.45 1hky s ASP 44 Cb 0.12 -1.92 0.75 0.00 -0.30 0.00 0.00 42.92 41.57 1hky s ASP 44 CO 0.56 0.11 1.67 0.00 -0.17 0.00 0.00 175.17 177.34 1hky n ALA 45 N -0.14 3.43 -0.40 3.66 0.00 -1.26 -4.11 120.51 121.69 1hky n ALA 45 Ca -0.06 -1.79 0.00 0.00 0.00 0.00 0.00 53.44 51.58 1hky n ALA 45 Cb 0.53 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.95 1hky n ALA 45 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1hky n LYS 46 N 0.78 1.22 -3.40 0.00 5.02 -1.26 -5.06 118.16 115.46 1hky n LYS 46 Ca 0.26 -0.91 -0.35 0.00 -2.02 0.00 0.00 58.31 55.29 1hky n LYS 46 Cb 1.03 -0.80 -0.06 0.00 -0.02 0.00 0.00 35.03 35.18 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 0.89 0.00 -3.26 0.00 1.74 -0.69 -4.94 116.66 110.41 1hky n ARG 48 Ca -0.06 0.00 -0.46 0.00 -0.77 0.00 0.00 57.85 56.56 1hky n ARG 48 Cb 0.52 0.00 -0.01 0.00 -1.02 0.00 0.00 32.46 31.94 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 -0.28 3.80 1.04 -1.55 0.08 -0.44 -3.35 117.98 117.29 1hky s PHE 49 Ca 0.00 -2.11 -0.13 0.00 0.12 0.00 0.00 56.93 54.81 1hky s PHE 49 Cb 0.00 -3.92 0.21 0.00 -0.57 0.00 0.00 43.02 38.75 1hky s PHE 49 CO 0.00 -1.07 1.08 -0.59 -0.10 0.00 0.00 175.22 174.54 1hky s PHE 50 N 0.19 1.93 -0.29 0.36 -0.71 -1.24 -2.21 117.98 116.01 1hky s PHE 50 Ca 0.25 0.98 0.05 0.00 -1.04 0.00 0.00 56.93 57.16 1hky s PHE 50 Cb -0.09 -3.25 0.20 0.00 -1.21 0.00 0.00 43.02 38.67 1hky s PHE 50 CO -0.08 -3.13 0.62 0.99 -1.34 0.00 0.00 175.22 172.28 1hky s THR 51 N -2.90 -0.95 0.40 -4.49 2.01 0.42 -2.47 115.64 107.66 1hky s THR 51 Ca 0.66 0.00 -0.05 0.00 0.31 0.00 0.00 61.69 62.61 1hky s THR 51 Cb -0.19 -0.96 -0.04 0.00 0.01 0.00 0.00 72.50 71.32 1hky s THR 51 CO 0.59 0.00 0.68 -0.22 -0.69 0.00 0.00 174.62 174.98 1hky s LEU 52 N 2.84 3.84 0.00 4.42 2.96 -0.23 -0.32 118.68 132.18 1hky s LEU 52 Ca 0.12 0.80 0.00 0.00 -0.22 0.00 0.00 54.13 54.83 1hky s LEU 52 Cb -0.10 -3.70 0.00 0.00 0.50 0.00 0.00 46.19 42.89 1hky s LEU 52 CO -0.25 -0.41 0.00 0.00 -1.32 0.00 0.00 176.35 174.37 1hky n ALA 53 N -1.73 0.00 0.16 5.97 0.00 -0.01 -1.05 120.51 123.85 1hky n ALA 53 Ca -0.01 0.00 0.19 0.00 0.00 0.00 0.00 53.44 53.62 1hky n ALA 53 Cb 0.55 0.00 0.76 0.00 0.00 0.00 0.00 19.45 20.76 1hky n ALA 53 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1hky h SER 54 N 0.00 0.00 0.00 0.00 0.87 -1.93 -3.34 113.55 109.15 1hky h SER 54 Ca 0.00 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.54 1hky h SER 54 Cb 0.00 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 61.93 1hky h SER 54 CO 0.00 0.00 0.10 0.61 -0.53 0.00 0.00 176.83 177.01 1hky n GLY 55 N -1.41 -1.00 3.59 5.77 0.00 -1.26 -4.89 105.19 105.98 1hky n GLY 55 Ca 0.05 -0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.05 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 0.00 0.51 0.37 1.61 2.20 -1.16 -4.25 119.74 119.02 1hky s LYS 56 Ca 0.00 1.15 -0.11 0.00 -0.36 0.00 0.00 55.97 56.66 1hky s LYS 56 Cb 0.01 0.56 -0.07 0.00 -1.51 0.00 0.00 37.83 36.81 1hky s LYS 56 CO -0.00 -0.15 0.74 0.00 -0.36 0.00 0.00 175.35 175.57 1hky s SER 58 N -2.92 1.92 -0.18 0.00 0.01 0.56 -0.97 113.70 112.13 1hky s SER 58 Ca 0.51 -0.76 -0.17 0.00 1.31 0.00 0.00 55.95 56.84 1hky s SER 58 Cb -0.10 0.36 -0.04 0.00 0.21 0.00 0.00 66.02 66.45 1hky s SER 58 CO 0.27 -0.39 0.45 -1.48 0.41 0.00 0.00 173.24 172.51 1hky s LEU 59 N 2.32 4.19 0.14 2.44 2.34 -0.30 0.16 118.68 129.96 1hky s LEU 59 Ca 0.09 0.64 0.08 0.00 0.06 0.00 0.00 54.13 55.00 1hky s LEU 59 Cb -0.14 -2.61 -0.04 0.00 -0.56 0.00 0.00 46.19 42.83 1hky s LEU 59 CO -0.31 -0.08 -0.10 -0.36 -1.06 0.00 0.00 176.35 174.44 1hky s PHE 60 N 1.21 2.67 0.00 3.48 0.40 -0.94 -2.73 117.98 122.07 1hky s PHE 60 Ca 0.22 -0.20 0.00 0.00 -0.60 0.00 0.00 56.93 56.35 1hky s PHE 60 Cb -0.15 -1.35 0.00 0.00 0.51 0.00 0.00 43.02 42.03 1hky s PHE 60 CO 0.09 0.46 0.00 0.00 0.70 0.00 0.00 175.22 176.47 1hky n ALA 61 N 0.38 0.30 -3.68 5.36 0.00 -1.24 -1.33 120.51 120.30 1hky n ALA 61 Ca -0.12 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.02 1hky n ALA 61 Cb 0.54 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.84 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 -0.64 3.86 -0.29 0.00 2.15 -1.26 -4.67 116.67 115.81 1hky s ASP 62 Ca 0.00 -1.68 -0.15 0.00 0.43 0.00 0.00 52.55 51.16 1hky s ASP 62 Cb 0.00 -0.75 0.10 0.00 -0.30 0.00 0.00 42.92 41.97 1hky s ASP 62 CO 0.00 -0.40 0.72 -0.62 -0.17 0.00 0.00 175.17 174.70 1hky s ASP 63 N 1.59 -0.93 -0.68 -0.34 2.15 -1.26 -5.00 116.67 112.19 1hky s ASP 63 Ca 0.11 1.43 -0.08 0.00 0.43 0.00 0.00 52.55 54.44 1hky s ASP 63 Cb -0.18 1.57 0.18 0.00 -0.30 0.00 0.00 42.92 44.19 1hky s ASP 63 CO -0.24 -0.22 0.56 0.00 -0.17 0.00 0.00 175.17 175.09 1hky s ALA 64 N 1.90 3.75 0.00 3.66 0.00 -1.26 -4.47 121.76 125.34 1hky s ALA 64 Ca -0.09 -3.20 0.00 0.00 0.00 0.00 0.00 51.96 48.67 1hky s ALA 64 Cb -0.06 -3.01 0.00 0.00 0.00 0.00 0.00 23.12 20.05 1hky s ALA 64 CO -0.19 -2.15 0.00 0.00 0.00 0.00 0.00 175.76 173.42 1hky n ALA 65 N 3.84 0.00 -1.68 0.00 0.00 -1.26 -5.01 120.51 116.39 1hky n ALA 65 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.10 1hky n ALA 65 Cb 0.42 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.84 1hky n ALA 65 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1hky n LEU 66 N 0.00 4.12 -4.10 0.00 4.32 -1.23 -3.74 117.00 116.37 1hky n LEU 66 Ca 0.00 0.95 -0.16 0.00 -0.02 0.00 0.00 56.01 56.78 1hky n LEU 66 Cb 0.05 -1.54 -0.12 0.00 -1.62 0.00 0.00 43.42 40.19 1hky n LEU 66 CO 0.00 0.20 -0.43 -0.13 -1.22 0.00 0.00 177.39 175.81 1hky s ARG 67 N 3.47 0.67 0.84 3.23 1.81 0.18 -4.80 118.95 124.34 1hky s ARG 67 Ca 0.85 -0.79 -0.11 0.00 -1.72 0.00 0.00 55.73 53.95 1hky s ARG 67 Cb -0.46 -0.56 0.09 0.00 -0.45 0.00 0.00 34.95 33.57 1hky s ARG 67 CO 0.39 0.12 1.09 -1.25 -0.68 0.00 0.00 175.30 174.98 1hky s PRO 68 N -1.49 1.75 0.00 3.54 0.04 -1.26 0.63 135.00 138.22 1hky s PRO 68 Ca -0.05 0.75 0.00 0.00 0.04 0.00 0.00 61.00 61.74 1hky s PRO 68 Cb -0.09 -1.87 0.00 0.00 0.04 0.00 0.00 34.50 32.58 1hky s PRO 68 CO 0.01 -1.88 0.00 -2.37 0.04 0.00 0.00 177.00 172.80 1hky n THR 69 N -3.62 0.00 -1.95 1.26 5.66 -0.88 -4.81 114.28 109.93 1hky n THR 69 Ca 0.07 0.00 -0.06 0.00 -3.05 0.00 0.00 64.05 61.01 1hky n THR 69 Cb 0.56 0.00 0.04 0.00 -1.55 0.00 0.00 70.33 69.37 1hky n THR 69 CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 175.07 173.19 1hky n LYS 70 N -0.19 0.17 0.00 1.09 3.00 -1.26 -5.00 118.16 115.97 1hky n LYS 70 Ca 0.00 -0.62 0.00 0.00 -0.00 0.00 0.00 58.31 57.69 1hky n LYS 70 Cb 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 35.03 34.80 1hky n LYS 70 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.40 177.83 1hky n SER 71 N -3.06 0.81 0.31 3.14 7.64 -1.26 -4.83 113.62 116.36 1hky n SER 71 Ca 0.04 0.00 0.21 0.00 1.01 0.00 0.00 58.87 60.13 1hky n SER 71 Cb 0.15 0.00 1.10 0.00 -1.01 0.00 0.00 64.21 64.45 1hky n SER 71 CO 0.00 0.00 0.00 -2.24 -3.01 0.00 0.00 175.04 169.79 1hky h ASP 72 N 0.00 0.00 0.11 6.43 3.04 -2.00 -1.84 116.42 122.15 1hky h ASP 72 Ca 0.00 0.00 -0.02 0.00 -3.24 0.00 0.00 57.03 53.77 1hky h ASP 72 Cb 0.00 0.00 -0.00 0.00 -1.04 0.00 0.00 39.33 38.29 1hky h ASP 72 CO 0.00 0.00 -0.10 1.23 -2.04 0.00 0.00 179.24 178.33 1hky h GLY 73 N 0.14 0.00 -2.26 7.15 0.00 -1.97 -3.43 103.07 102.69 1hky h GLY 73 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 47.33 46.87 1hky h GLY 73 CO 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 176.54 176.43 1hky s ALA 74 N -4.81 3.81 -0.29 3.60 0.00 -0.69 -3.81 121.76 119.56 1hky s ALA 74 Ca -0.04 -1.11 -0.15 0.00 0.00 0.00 0.00 51.96 50.66 1hky s ALA 74 Cb 0.16 -2.10 0.12 0.00 0.00 0.00 0.00 23.12 21.30 1hky s ALA 74 CO 0.68 -0.37 0.79 0.54 0.00 0.00 0.00 175.76 177.41 1hky s VAL 75 N -2.53 -0.26 0.48 0.00 0.11 -0.22 -4.45 120.40 113.53 1hky s VAL 75 Ca 0.49 0.00 0.03 0.00 -2.93 0.00 0.00 61.98 59.57 1hky s VAL 75 Cb -0.10 -1.00 0.03 0.00 -1.53 0.00 0.00 36.38 33.79 1hky s VAL 75 CO 0.37 0.00 0.29 -1.54 -3.33 0.00 0.00 175.10 170.89 1hky n SER 76 N 4.45 2.71 -1.31 3.54 3.41 -0.75 -1.07 113.62 124.61 1hky n SER 76 Ca -0.17 -2.75 -0.01 0.00 -0.26 0.00 0.00 58.87 55.69 1hky n SER 76 Cb 0.56 0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.55 1hky n SER 76 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1hky n GLY 77 N -0.79 1.52 3.31 5.00 0.00 -1.03 -2.65 105.19 110.56 1hky n GLY 77 Ca -0.05 -1.00 -0.15 0.00 0.00 0.00 0.00 46.02 44.81 1hky n GLY 77 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hky s ASN 78 N -1.34 0.89 -0.37 1.61 2.20 -1.26 -3.66 114.94 113.01 1hky s ASN 78 Ca 0.03 -1.53 0.07 0.00 -0.94 0.00 0.00 52.86 50.49 1hky s ASN 78 Cb -0.01 0.52 0.64 0.00 -2.00 0.00 0.00 41.25 40.40 1hky s ASN 78 CO 0.01 -1.03 1.76 0.29 -2.94 0.00 0.00 177.10 175.19 1hky n LYS 79 N -0.47 2.50 -1.36 3.55 4.76 -1.21 -4.52 118.16 121.41 1hky n LYS 79 Ca 0.04 -3.07 -0.27 0.00 -2.87 0.00 0.00 58.31 52.14 1hky n LYS 79 Cb 0.63 -2.08 0.11 0.00 -1.84 0.00 0.00 35.03 31.85 1hky n LYS 79 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1hky n ARG 80 N -0.90 2.64 -0.69 1.97 5.12 -1.26 -4.48 116.66 119.07 1hky n ARG 80 Ca 0.48 -3.37 0.02 0.00 -1.93 0.00 0.00 57.85 53.04 1hky n ARG 80 Cb 1.42 -2.20 0.26 0.00 -1.16 0.00 0.00 32.46 30.78 1hky n ARG 80 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1hky h ILE 82 N 1.80 1.56 -3.33 0.00 3.07 -1.91 -3.46 117.51 115.25 1hky h ILE 82 Ca 0.13 -2.83 -0.36 0.00 1.55 0.00 0.00 64.86 63.35 1hky h ILE 82 Cb 1.73 2.57 0.16 0.00 -0.27 0.00 0.00 36.82 41.01 1hky h ILE 82 CO 0.40 0.82 0.22 -0.11 -1.05 0.00 0.00 178.15 178.43 1hky n LEU 83 N -3.57 0.00 -0.10 0.16 7.94 -1.26 -5.05 117.00 115.12 1hky n LEU 83 Ca -0.02 -1.12 -0.20 0.00 -1.11 0.00 0.00 56.01 53.56 1hky n LEU 83 Cb 0.83 -0.87 -0.07 0.00 0.53 0.00 0.00 43.42 43.84 1hky n LEU 83 CO 0.47 -1.69 -1.11 0.18 -1.11 0.00 0.00 177.39 174.14 1hky n LEU 84 N 0.00 1.60 0.00 -1.96 4.77 -1.26 -4.88 117.00 115.26 1hky n LEU 84 Ca 0.14 0.27 0.00 0.00 -0.03 0.00 0.00 56.01 56.39 1hky n LEU 84 Cb 0.50 -0.65 0.00 0.00 -2.33 0.00 0.00 43.42 40.94 1hky n LEU 84 CO 0.36 0.28 0.06 -0.62 -1.33 0.00 0.00 177.39 176.14 1hky n GLU 85 N -4.05 0.00 0.00 3.23 1.02 -1.26 -5.16 120.64 114.42 1hky n GLU 85 Ca -0.37 0.00 0.16 0.00 -0.02 0.00 0.00 57.16 56.93 1hky n GLU 85 Cb 0.72 -0.55 0.87 0.00 -0.02 0.00 0.00 31.44 32.47 1hky n GLU 85 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84