#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 1.05 0.24 2.11 -0.85 -1.26 -5.08 117.35 113.56 1hky s TYR 2 Ca 0.00 0.60 -0.11 0.00 -0.52 0.00 0.00 57.07 57.04 1hky s TYR 2 Cb 0.00 -3.47 0.04 0.00 0.38 0.00 0.00 41.96 38.91 1hky s TYR 2 CO 0.00 -3.48 0.59 0.36 -1.52 0.00 0.00 175.55 171.50 1hky n LYS 3 N -4.49 0.71 0.00 -3.49 2.85 -1.26 -4.98 118.16 107.49 1hky n LYS 3 Ca 0.11 -1.42 0.00 0.00 -1.05 0.00 0.00 58.31 55.95 1hky n LYS 3 Cb 0.59 1.80 0.00 0.00 -0.65 0.00 0.00 35.03 36.77 1hky n LYS 3 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 1hky n ASP 4 N -1.30 0.00 0.00 -5.58 -0.08 -1.26 -5.13 116.55 103.20 1hky n ASP 4 Ca -0.05 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.23 1hky n ASP 4 Cb 0.41 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.87 1hky n ASP 4 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 1hky n ASP 5 N -1.04 0.00 -0.06 1.67 9.92 -1.26 -4.99 116.55 120.78 1hky n ASP 5 Ca 0.00 0.00 -0.04 0.00 -0.53 0.00 0.00 54.79 54.22 1hky n ASP 5 Cb 0.00 0.00 -0.13 0.00 -0.64 0.00 0.00 41.12 40.35 1hky n ASP 5 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 1hky n ASP 6 N -0.93 0.87 -4.57 -2.24 8.00 -1.26 -4.88 116.55 111.53 1hky n ASP 6 Ca 0.00 0.00 -0.42 0.00 0.71 0.00 0.00 54.79 55.08 1hky n ASP 6 Cb 0.00 1.14 -0.03 0.00 -0.02 0.00 0.00 41.12 42.22 1hky n ASP 6 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1hky s ASP 7 N -4.81 6.24 0.00 -2.24 1.11 -1.26 -4.92 116.67 110.79 1hky s ASP 7 Ca -0.08 0.14 0.00 0.00 0.18 0.00 0.00 52.55 52.79 1hky s ASP 7 Cb 0.07 -2.55 0.00 0.00 1.07 0.00 0.00 42.92 41.51 1hky s ASP 7 CO 0.70 -1.65 0.07 0.29 1.18 0.00 0.00 175.17 175.76 1hky n LYS 8 N 8.66 0.00 -3.99 8.23 4.76 -1.26 -4.17 118.16 130.40 1hky n LYS 8 Ca 0.10 0.01 -0.24 0.00 -2.87 0.00 0.00 58.31 55.31 1hky n LYS 8 Cb 0.49 -0.58 -0.05 0.00 -1.84 0.00 0.00 35.03 33.05 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 -0.16 2.25 -0.29 -0.18 -7.23 -1.26 -4.84 120.40 108.69 1hky s VAL 9 Ca 0.00 -1.60 0.03 0.00 -1.81 0.00 0.00 61.98 58.60 1hky s VAL 9 Cb 0.00 -2.85 0.18 0.00 0.56 0.00 0.00 36.38 34.27 1hky s VAL 9 CO 0.00 0.00 0.52 -1.59 -0.31 0.00 0.00 175.10 173.72 1hky s LYS 10 N -4.01 0.50 -0.27 4.82 -2.85 -1.26 -5.01 119.74 111.66 1hky s LYS 10 Ca 0.40 0.53 0.12 0.00 -1.00 0.00 0.00 55.97 56.03 1hky s LYS 10 Cb 0.01 0.09 0.60 0.00 -2.06 0.00 0.00 37.83 36.47 1hky s LYS 10 CO 0.23 -0.91 1.58 1.28 0.10 0.00 0.00 175.35 177.62 1hky n LEU 11 N 5.40 4.77 -0.00 2.77 4.32 -1.26 -4.35 117.00 128.65 1hky n LEU 11 Ca 0.02 -3.32 0.08 0.00 -0.02 0.00 0.00 56.01 52.76 1hky n LEU 11 Cb 0.52 -0.65 -0.09 0.00 -1.62 0.00 0.00 43.42 41.58 1hky n LEU 11 CO -0.02 0.90 -0.05 0.35 -1.22 0.00 0.00 177.39 177.35 1hky n THR 12 N -0.61 0.00 -2.68 -5.08 -2.24 -1.26 -4.99 114.28 97.41 1hky n THR 12 Ca 0.33 -0.12 -0.08 0.00 -2.27 0.00 0.00 64.05 61.91 1hky n THR 12 Cb 1.12 0.98 0.04 0.00 -2.10 0.00 0.00 70.33 70.37 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 -0.73 0.00 0.00 0.00 6.14 -1.26 -5.01 117.35 116.49 1hky s TYR 14 Ca 0.25 -0.00 0.00 0.00 0.64 0.00 0.00 57.07 57.95 1hky s TYR 14 Cb -0.02 -0.00 0.00 0.00 0.42 0.00 0.00 41.96 42.36 1hky s TYR 14 CO 0.16 -0.01 0.00 0.00 0.64 0.00 0.00 175.55 176.34 1hky n GLN 15 N 3.03 0.00 0.00 4.97 10.64 -1.14 -4.35 117.38 130.54 1hky n GLN 15 Ca -0.12 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.05 1hky n GLN 15 Cb 0.60 -0.06 0.00 0.00 -0.86 0.00 0.00 30.24 29.92 1hky n GLN 15 CO 0.00 0.00 0.00 -1.71 -1.83 0.00 0.00 177.06 173.52 1hky n ASN 16 N 0.00 0.00 0.00 2.61 5.15 -0.82 -1.78 115.26 120.42 1hky n ASN 16 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 1hky n ASN 16 Cb 0.04 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.29 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 0.00 1.89 3.54 8.20 0.00 -1.26 -4.99 105.19 112.58 1hky n GLY 17 Ca 0.00 -0.15 -0.26 0.00 0.00 0.00 0.00 46.02 45.61 1hky n GLY 17 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1hky s VAL 18 N 0.00 0.75 0.00 1.61 -7.23 -1.04 -4.27 120.40 110.23 1hky s VAL 18 Ca 0.00 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.17 1hky s VAL 18 Cb 0.00 -2.39 0.00 0.00 0.56 0.00 0.00 36.38 34.55 1hky s VAL 18 CO 0.00 0.00 0.00 -0.24 -0.31 0.00 0.00 175.10 174.55 1hky n SER 19 N -1.22 -0.36 -4.12 4.85 2.88 -1.25 -4.31 113.62 110.09 1hky n SER 19 Ca -0.07 -0.14 -0.16 0.00 -1.33 0.00 0.00 58.87 57.17 1hky n SER 19 Cb 0.65 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.99 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 -0.32 0.97 0.32 0.66 0.08 -1.26 -4.37 117.98 114.07 1hky s PHE 20 Ca 0.00 -0.45 -0.13 0.00 0.12 0.00 0.00 56.93 56.47 1hky s PHE 20 Cb 0.00 -0.56 0.02 0.00 -0.57 0.00 0.00 43.02 41.91 1hky s PHE 20 CO 0.00 -0.00 0.64 -0.08 -0.10 0.00 0.00 175.22 175.67 1hky s THR 21 N -1.23 0.00 0.00 0.64 -1.32 -0.59 -4.93 115.64 108.21 1hky s THR 21 Ca -0.05 -1.22 0.00 0.00 -1.21 0.00 0.00 61.69 59.21 1hky s THR 21 Cb -0.09 -2.50 0.00 0.00 -1.51 0.00 0.00 72.50 68.40 1hky s THR 21 CO 0.01 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.03 1hky n GLY 22 N -0.49 2.46 3.15 6.08 0.00 -1.26 -0.60 105.19 114.53 1hky n GLY 22 Ca -0.04 -0.51 -0.22 0.00 0.00 0.00 0.00 46.02 45.26 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 -0.60 3.27 -0.02 0.00 -0.62 -4.72 105.19 102.50 1hky n GLY 23 Ca 0.00 -1.83 -0.35 0.00 0.00 0.00 0.00 46.02 43.85 1hky n GLY 23 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1hky s LYS 24 N -5.07 3.29 0.72 1.61 2.47 -1.26 -4.78 119.74 116.72 1hky s LYS 24 Ca 0.59 -0.67 -0.12 0.00 -1.56 0.00 0.00 55.97 54.20 1hky s LYS 24 Cb -0.02 -2.91 0.03 0.00 -1.46 0.00 0.00 37.83 33.46 1hky s LYS 24 CO 0.40 -0.20 1.09 0.00 0.16 0.00 0.00 175.35 176.81 1hky s ALA 25 N 1.44 2.39 -0.10 3.13 0.00 -1.26 -4.91 121.76 122.44 1hky s ALA 25 Ca 0.06 0.37 0.21 0.00 0.00 0.00 0.00 51.96 52.60 1hky s ALA 25 Cb -0.14 -3.28 -0.24 0.00 0.00 0.00 0.00 23.12 19.46 1hky s ALA 25 CO -0.05 -1.50 0.58 0.44 0.00 0.00 0.00 175.76 175.23 1hky n ILE 26 N -3.01 0.37 -3.63 0.00 -6.64 -1.18 -4.97 119.36 100.30 1hky n ILE 26 Ca 0.09 -0.56 -0.11 0.00 -1.77 0.00 0.00 62.75 60.40 1hky n ILE 26 Cb 0.53 -0.18 -0.07 0.00 -1.44 0.00 0.00 39.64 38.48 1hky n ILE 26 CO 0.00 0.00 0.00 -0.55 -1.77 0.00 0.00 176.55 174.23 1hky s SER 27 N -4.90 -0.53 0.00 7.28 0.15 -1.12 -5.06 113.70 109.52 1hky s SER 27 Ca -0.06 1.00 0.00 0.00 0.70 0.00 0.00 55.95 57.59 1hky s SER 27 Cb 0.12 1.00 -0.00 0.00 -1.71 0.00 0.00 66.02 65.43 1hky s SER 27 CO 0.87 -0.20 -0.01 -1.61 1.20 0.00 0.00 173.24 173.48 1hky s GLU 28 N 0.16 0.12 0.48 5.44 2.02 -1.26 -0.42 118.70 125.24 1hky s GLU 28 Ca 0.02 -0.15 0.05 0.00 0.02 0.00 0.00 54.97 54.91 1hky s GLU 28 Cb -0.05 -0.04 -0.01 0.00 0.10 0.00 0.00 34.13 34.13 1hky s GLU 28 CO -0.03 0.01 0.22 0.00 0.02 0.00 0.00 175.26 175.47 1hky s ALA 29 N -0.30 4.01 -0.51 5.21 0.00 -0.03 -4.91 121.76 125.22 1hky s ALA 29 Ca -0.03 -1.41 0.06 0.00 0.00 0.00 0.00 51.96 50.58 1hky s ALA 29 Cb -0.02 -0.41 0.37 0.00 0.00 0.00 0.00 23.12 23.05 1hky s ALA 29 CO -0.00 -0.23 0.97 1.63 0.00 0.00 0.00 175.76 178.13 1hky n LYS 30 N -1.43 2.98 -3.44 0.00 5.02 -1.26 -0.31 118.16 119.72 1hky n LYS 30 Ca -0.05 -4.55 -0.19 0.00 -2.02 0.00 0.00 58.31 51.49 1hky n LYS 30 Cb 0.65 -2.15 -0.02 0.00 -0.02 0.00 0.00 35.03 33.50 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 -3.38 4.18 -0.07 7.82 0.00 -1.26 -4.85 121.76 124.20 1hky s ALA 31 Ca 0.47 -1.70 0.20 0.00 0.00 0.00 0.00 51.96 50.92 1hky s ALA 31 Cb 0.33 -1.34 -0.30 0.00 0.00 0.00 0.00 23.12 21.81 1hky s ALA 31 CO -0.14 -0.16 0.45 0.00 0.00 0.00 0.00 175.76 175.91 1hky n ALA 32 N -1.61 2.81 -2.49 0.00 0.00 -1.26 -2.74 120.51 115.21 1hky n ALA 32 Ca 0.03 -0.47 -0.25 0.00 0.00 0.00 0.00 53.44 52.75 1hky n ALA 32 Cb 0.60 -0.68 -0.15 0.00 0.00 0.00 0.00 19.45 19.22 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 -4.20 2.13 0.55 0.00 1.04 -1.26 -4.83 113.70 107.13 1hky s SER 33 Ca -0.07 -0.36 0.23 0.00 0.48 0.00 0.00 55.95 56.24 1hky s SER 33 Cb 0.13 -0.22 1.48 0.00 0.10 0.00 0.00 66.02 67.50 1hky s SER 33 CO 0.82 0.20 2.12 0.28 0.98 0.00 0.00 173.24 177.64 1hky h SER 34 N 5.55 0.00 -0.75 7.02 0.02 -1.95 -2.09 113.55 121.35 1hky h SER 34 Ca -0.38 0.00 0.15 0.00 -0.84 0.00 0.00 61.79 60.73 1hky h SER 34 Cb 1.15 0.00 -0.10 0.00 0.14 0.00 0.00 62.40 63.59 1hky h SER 34 CO 0.47 0.00 0.26 -0.61 -1.14 0.00 0.00 176.83 175.81 1hky h GLN 35 N 0.00 0.36 -0.29 3.45 -0.00 -1.99 0.43 115.11 117.06 1hky h GLN 35 Ca 0.07 -0.02 -0.12 0.00 -0.00 0.00 0.00 58.65 58.58 1hky h GLN 35 Cb 0.32 -0.08 -0.01 0.00 0.00 0.00 0.00 27.48 27.71 1hky h GLN 35 CO -0.00 0.24 -0.33 0.00 0.00 0.00 0.00 178.83 178.74 1hky h ALA 36 N 1.58 0.88 0.00 3.38 0.00 -1.81 -2.45 119.26 120.84 1hky h ALA 36 Ca 0.42 -0.41 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 1hky h ALA 36 Cb 0.69 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 1hky h ALA 36 CO -0.45 0.63 -0.16 0.00 0.00 0.00 0.00 179.25 179.27 1hky h GLN 38 N 0.00 0.59 -0.65 0.00 1.08 0.13 -1.86 115.11 114.40 1hky h GLN 38 Ca -0.00 -0.71 -0.06 0.00 -1.45 0.00 0.00 58.65 56.42 1hky h GLN 38 Cb 0.57 0.22 -0.03 0.00 -0.05 0.00 0.00 27.48 28.19 1hky h GLN 38 CO 0.02 1.30 0.15 0.93 -0.95 0.00 0.00 178.83 180.29 1hky h GLU 39 N 0.20 1.04 -0.03 1.46 4.39 -1.25 -1.54 114.58 118.85 1hky h GLU 39 Ca -0.14 -0.24 -0.17 0.00 0.34 0.00 0.00 59.36 59.15 1hky h GLU 39 Cb 1.71 -0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 30.20 1hky h GLU 39 CO 0.20 0.92 -0.74 1.37 -1.16 0.00 0.00 179.01 179.60 1hky h LEU 40 N 0.99 0.24 -1.20 1.33 8.10 -1.53 -3.04 115.31 120.20 1hky h LEU 40 Ca 0.21 -0.17 -0.07 0.00 0.11 0.00 0.00 57.88 57.96 1hky h LEU 40 Cb 0.36 -0.07 -0.01 0.00 -0.44 0.00 0.00 40.66 40.49 1hky h LEU 40 CO 0.00 0.90 -0.23 0.00 -4.11 0.00 0.00 178.44 175.00 1hky h GLU 42 N 0.23 1.00 0.00 0.00 4.81 -1.17 -2.33 114.58 117.12 1hky h GLU 42 Ca 0.04 -0.28 -0.02 0.00 -0.13 0.00 0.00 59.36 58.98 1hky h GLU 42 Cb 0.55 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 29.81 1hky h GLU 42 CO 0.04 0.95 -0.08 0.87 -0.73 0.00 0.00 179.01 180.05 1hky h LYS 43 N 0.93 0.00 -5.25 1.92 1.79 -1.45 -3.41 116.57 111.09 1hky h LYS 43 Ca 0.18 0.00 -0.66 0.00 -2.18 0.00 0.00 60.65 57.99 1hky h LYS 43 Cb 0.47 0.00 -0.16 0.00 -1.58 0.00 0.00 32.23 30.95 1hky h LYS 43 CO 0.02 0.08 0.16 0.34 -1.08 0.00 0.00 179.45 178.97 1hky s ASP 44 N -6.07 6.27 0.51 0.86 -1.08 -0.80 -4.90 116.67 111.46 1hky s ASP 44 Ca 0.04 -0.64 0.29 0.00 -0.52 0.00 0.00 52.55 51.72 1hky s ASP 44 Cb 0.07 -2.32 1.27 0.00 -1.46 0.00 0.00 42.92 40.48 1hky s ASP 44 CO 0.63 -0.91 1.97 0.00 0.52 0.00 0.00 175.17 177.38 1hky h ALA 45 N 9.01 1.08 -0.19 3.66 0.00 -1.81 -2.02 119.26 128.99 1hky h ALA 45 Ca -0.27 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1hky h ALA 45 Cb 1.09 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1hky h ALA 45 CO 0.96 0.15 0.00 1.63 0.00 0.00 0.00 179.25 181.99 1hky n LYS 46 N -3.34 1.53 -3.82 0.00 5.02 -1.26 -4.86 118.16 111.42 1hky n LYS 46 Ca -0.00 -0.81 -0.28 0.00 -2.02 0.00 0.00 58.31 55.19 1hky n LYS 46 Cb 0.33 -1.25 -0.03 0.00 -0.02 0.00 0.00 35.03 34.05 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 -0.32 0.00 -3.75 0.00 0.63 -0.70 -4.90 116.66 107.63 1hky n ARG 48 Ca -0.05 0.00 -0.35 0.00 -0.92 0.00 0.00 57.85 56.53 1hky n ARG 48 Cb 0.53 0.00 -0.10 0.00 0.45 0.00 0.00 32.46 33.34 1hky n ARG 48 CO 0.00 0.00 0.00 -0.06 -2.51 0.00 0.00 177.63 175.06 1hky s PHE 49 N -2.00 3.44 0.86 -0.14 0.08 -0.49 -4.71 117.98 115.03 1hky s PHE 49 Ca 0.00 -2.88 -0.11 0.00 0.12 0.00 0.00 56.93 54.06 1hky s PHE 49 Cb 0.00 -3.11 0.11 0.00 -0.57 0.00 0.00 43.02 39.44 1hky s PHE 49 CO 0.00 -0.79 1.09 -0.59 -0.10 0.00 0.00 175.22 174.83 1hky s PHE 50 N -0.39 2.32 -0.37 0.36 -0.71 -1.17 -1.76 117.98 116.27 1hky s PHE 50 Ca 0.19 1.40 0.06 0.00 -1.04 0.00 0.00 56.93 57.55 1hky s PHE 50 Cb -0.18 -3.13 0.18 0.00 -1.21 0.00 0.00 43.02 38.67 1hky s PHE 50 CO -0.05 -2.26 0.57 0.99 -1.34 0.00 0.00 175.22 173.13 1hky s THR 51 N -2.88 -0.88 0.35 -4.49 2.01 0.41 -2.42 115.64 107.73 1hky s THR 51 Ca 0.63 -0.15 -0.12 0.00 0.31 0.00 0.00 61.69 62.35 1hky s THR 51 Cb -0.18 -0.40 -0.08 0.00 0.01 0.00 0.00 72.50 71.85 1hky s THR 51 CO 0.57 -0.10 0.73 -0.22 -0.69 0.00 0.00 174.62 174.91 1hky s LEU 52 N 2.08 3.97 0.00 4.42 2.96 0.67 -0.27 118.68 132.50 1hky s LEU 52 Ca 0.14 1.17 0.00 0.00 -0.22 0.00 0.00 54.13 55.23 1hky s LEU 52 Cb -0.08 -4.01 0.00 0.00 0.50 0.00 0.00 46.19 42.61 1hky s LEU 52 CO -0.13 -0.28 0.00 0.00 -1.32 0.00 0.00 176.35 174.62 1hky n ALA 53 N -0.78 0.00 0.25 5.97 0.00 0.34 -0.09 120.51 126.19 1hky n ALA 53 Ca 0.03 0.00 0.17 0.00 0.00 0.00 0.00 53.44 53.64 1hky n ALA 53 Cb 0.53 0.00 0.80 0.00 0.00 0.00 0.00 19.45 20.79 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 -3.33 113.55 109.15 1hky h SER 54 Ca 0.00 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.55 1hky h SER 54 Cb 0.00 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 61.95 1hky h SER 54 CO 0.00 0.00 0.02 0.61 -0.53 0.00 0.00 176.83 176.93 1hky n GLY 55 N -1.32 -0.95 3.53 5.77 0.00 -1.26 -4.88 105.19 106.08 1hky n GLY 55 Ca 0.01 -0.00 0.00 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 0.00 0.52 0.44 1.61 2.20 -1.11 -4.14 119.74 119.26 1hky s LYS 56 Ca 0.00 1.25 -0.16 0.00 -0.36 0.00 0.00 55.97 56.69 1hky s LYS 56 Cb 0.01 0.74 -0.09 0.00 -1.51 0.00 0.00 37.83 36.99 1hky s LYS 56 CO -0.00 -0.24 0.89 0.00 -0.36 0.00 0.00 175.35 175.64 1hky s SER 58 N -2.70 2.19 -0.25 0.00 0.01 0.62 -0.85 113.70 112.72 1hky s SER 58 Ca 0.57 -1.11 -0.17 0.00 1.31 0.00 0.00 55.95 56.56 1hky s SER 58 Cb -0.10 0.23 -0.03 0.00 0.21 0.00 0.00 66.02 66.33 1hky s SER 58 CO 0.24 -0.38 0.46 -1.48 0.41 0.00 0.00 173.24 172.49 1hky s LEU 59 N 2.08 4.07 0.07 2.44 2.34 0.45 0.15 118.68 130.28 1hky s LEU 59 Ca 0.11 0.48 0.03 0.00 0.06 0.00 0.00 54.13 54.81 1hky s LEU 59 Cb -0.15 -2.59 -0.04 0.00 -0.56 0.00 0.00 46.19 42.85 1hky s LEU 59 CO -0.28 -0.22 0.04 -0.36 -1.06 0.00 0.00 176.35 174.47 1hky s PHE 60 N 2.04 3.09 0.00 3.48 0.40 -0.72 -2.78 117.98 123.49 1hky s PHE 60 Ca 0.20 0.04 0.00 0.00 -0.60 0.00 0.00 56.93 56.57 1hky s PHE 60 Cb -0.16 -1.60 0.00 0.00 0.51 0.00 0.00 43.02 41.78 1hky s PHE 60 CO 0.09 0.50 0.00 0.00 0.70 0.00 0.00 175.22 176.51 1hky n ALA 61 N 0.65 0.00 -2.58 5.36 0.00 -1.20 -1.39 120.51 121.34 1hky n ALA 61 Ca -0.10 -0.01 -0.29 0.00 0.00 0.00 0.00 53.44 53.04 1hky n ALA 61 Cb 0.52 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.90 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 -1.83 4.23 -1.10 0.00 2.15 -1.26 -4.48 116.67 114.38 1hky s ASP 62 Ca 0.00 -1.37 -0.20 0.00 0.43 0.00 0.00 52.55 51.40 1hky s ASP 62 Cb 0.00 0.03 0.08 0.00 -0.30 0.00 0.00 42.92 42.72 1hky s ASP 62 CO 0.00 -0.72 1.48 -0.62 -0.17 0.00 0.00 175.17 175.15 1hky s ASP 63 N -3.91 6.66 0.00 -0.34 2.15 -1.26 -4.82 116.67 115.15 1hky s ASP 63 Ca 0.26 -1.94 0.00 0.00 0.43 0.00 0.00 52.55 51.30 1hky s ASP 63 Cb 0.04 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 40.12 1hky s ASP 63 CO 0.14 -1.29 0.00 0.00 -0.17 0.00 0.00 175.17 173.85 1hky n ALA 64 N 8.16 0.00 -1.76 3.66 0.00 -1.26 -4.88 120.51 124.43 1hky n ALA 64 Ca 0.37 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.79 1hky n ALA 64 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.94 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 -1.65 1.52 -1.77 0.00 0.00 -1.26 -5.00 120.51 112.34 1hky n ALA 65 Ca 0.00 -0.38 -0.38 0.00 0.00 0.00 0.00 53.44 52.68 1hky n ALA 65 Cb 0.00 -0.13 -0.03 0.00 0.00 0.00 0.00 19.45 19.29 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 0.00 4.24 0.22 0.00 0.05 -1.26 -1.58 118.68 120.35 1hky s LEU 66 Ca 0.00 2.26 -0.22 0.00 0.05 0.00 0.00 54.13 56.22 1hky s LEU 66 Cb 0.00 -3.99 0.05 0.00 -2.05 0.00 0.00 46.19 40.20 1hky s LEU 66 CO 0.00 -0.54 0.66 -0.13 -0.55 0.00 0.00 176.35 175.79 1hky s ARG 67 N -2.20 1.52 0.99 1.48 0.52 0.23 -4.81 118.95 116.69 1hky s ARG 67 Ca 0.55 -0.72 -0.17 0.00 -0.52 0.00 0.00 55.73 54.88 1hky s ARG 67 Cb -0.29 0.60 0.25 0.00 0.52 0.00 0.00 34.95 36.03 1hky s ARG 67 CO 0.36 -0.68 0.87 -0.35 0.02 0.00 0.00 175.30 175.52 1hky n PRO 68 N -0.42 -2.80 0.00 3.54 -0.04 -1.26 -1.54 135.00 132.48 1hky n PRO 68 Ca -0.11 -1.39 0.00 0.00 -0.04 0.00 0.00 63.50 61.96 1hky n PRO 68 Cb 0.62 -1.32 0.00 0.00 -0.04 0.00 0.00 33.50 32.76 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 -4.44 0.00 -3.65 0.52 5.66 -1.26 -4.72 114.28 106.40 1hky n THR 69 Ca 0.12 0.00 -0.04 0.00 -3.05 0.00 0.00 64.05 61.08 1hky n THR 69 Cb 0.47 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 69.18 1hky n THR 69 CO 0.00 0.00 0.00 -0.75 -3.05 0.00 0.00 175.07 171.27 1hky s LYS 70 N 0.00 0.19 0.00 1.09 2.36 -1.26 -5.05 119.74 117.06 1hky s LYS 70 Ca 0.00 0.24 -0.00 0.00 -2.55 0.00 0.00 55.97 53.66 1hky s LYS 70 Cb 0.00 0.08 0.00 0.00 -1.05 0.00 0.00 37.83 36.86 1hky s LYS 70 CO 0.00 -0.03 0.00 0.45 1.55 0.00 0.00 175.35 177.33 1hky n SER 71 N 2.09 -0.00 -0.91 1.43 2.88 -1.26 -4.60 113.62 113.25 1hky n SER 71 Ca -0.12 -1.00 -0.01 0.00 -1.33 0.00 0.00 58.87 56.41 1hky n SER 71 Cb 0.57 0.01 -0.01 0.00 -0.75 0.00 0.00 64.21 64.02 1hky n SER 71 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1hky n ASP 72 N -1.10 0.04 0.00 -3.46 2.03 -1.26 -4.91 116.55 107.88 1hky n ASP 72 Ca -0.00 -1.78 0.00 0.00 0.52 0.00 0.00 54.79 53.53 1hky n ASP 72 Cb 0.00 -0.06 0.00 0.00 -0.72 0.00 0.00 41.12 40.34 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 0.14 0.00 3.69 0.27 0.00 -1.26 -5.07 105.19 102.96 1hky n GLY 73 Ca -0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.54 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 0.00 3.39 0.10 4.61 0.00 -1.26 -4.52 121.76 124.08 1hky s ALA 74 Ca 0.00 0.44 0.08 0.00 0.00 0.00 0.00 51.96 52.48 1hky s ALA 74 Cb 0.00 -3.44 -0.04 0.00 0.00 0.00 0.00 23.12 19.64 1hky s ALA 74 CO 0.00 -0.58 -0.15 0.14 0.00 0.00 0.00 175.76 175.17 1hky s VAL 75 N 1.90 3.02 -0.10 0.00 -7.23 0.87 -2.48 120.40 116.38 1hky s VAL 75 Ca 0.50 -1.36 -0.10 0.00 -1.81 0.00 0.00 61.98 59.20 1hky s VAL 75 Cb -0.20 -2.38 0.03 0.00 0.56 0.00 0.00 36.38 34.39 1hky s VAL 75 CO 0.20 0.15 0.28 -0.94 -0.31 0.00 0.00 175.10 174.48 1hky s SER 76 N -2.04 -0.28 -0.01 4.85 1.04 -0.73 -0.23 113.70 116.29 1hky s SER 76 Ca 0.18 0.50 -0.08 0.00 0.48 0.00 0.00 55.95 57.04 1hky s SER 76 Cb -0.11 0.55 0.01 0.00 0.10 0.00 0.00 66.02 66.57 1hky s SER 76 CO 0.10 -0.14 0.17 -0.83 0.98 0.00 0.00 173.24 173.53 1hky s GLY 77 N -0.04 -0.02 0.00 7.32 0.00 -1.02 -1.94 107.32 111.62 1hky s GLY 77 Ca -0.02 0.06 0.19 0.00 0.00 0.00 0.00 44.72 44.95 1hky s GLY 77 CO 0.01 -0.07 0.89 0.70 0.00 0.00 0.00 173.10 174.63 1hky n ASN 78 N 1.72 1.49 -3.28 1.64 3.02 -1.26 -3.03 115.26 115.55 1hky n ASN 78 Ca -0.21 -1.24 -0.08 0.00 -0.03 0.00 0.00 54.58 53.02 1hky n ASN 78 Cb 0.56 0.65 -0.04 0.00 -0.61 0.00 0.00 39.78 40.34 1hky n ASN 78 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1hky s LYS 79 N -2.35 0.74 1.10 3.52 2.20 -1.26 -4.74 119.74 118.95 1hky s LYS 79 Ca 0.13 -0.57 -0.12 0.00 -0.36 0.00 0.00 55.97 55.04 1hky s LYS 79 Cb 0.15 -0.31 0.25 0.00 -1.51 0.00 0.00 37.83 36.41 1hky s LYS 79 CO 0.57 -1.20 1.05 -0.98 -0.36 0.00 0.00 175.35 174.44 1hky s ARG 80 N 1.62 -0.44 -0.94 4.03 3.03 -1.26 -4.16 118.95 120.83 1hky s ARG 80 Ca 0.17 0.85 -0.01 0.00 2.03 0.00 0.00 55.73 58.77 1hky s ARG 80 Cb -0.10 -1.61 0.31 0.00 -1.03 0.00 0.00 34.95 32.52 1hky s ARG 80 CO -0.05 -3.40 1.44 0.00 -1.13 0.00 0.00 175.30 172.16 1hky s ILE 82 N -3.46 3.55 -0.03 0.00 1.10 -1.26 -5.12 121.20 115.97 1hky s ILE 82 Ca 0.37 -0.71 0.01 0.00 -0.51 0.00 0.00 60.65 59.81 1hky s ILE 82 Cb 0.14 -2.50 0.02 0.00 0.15 0.00 0.00 42.46 40.27 1hky s ILE 82 CO -0.01 0.47 -0.04 -1.48 -2.11 0.00 0.00 174.94 171.77 1hky s LEU 83 N -1.17 1.41 0.40 8.50 2.34 -1.26 -5.14 118.68 123.75 1hky s LEU 83 Ca 0.15 -0.10 -0.23 0.00 0.06 0.00 0.00 54.13 54.01 1hky s LEU 83 Cb -0.11 -0.36 -0.10 0.00 -0.56 0.00 0.00 46.19 45.06 1hky s LEU 83 CO 0.05 -0.04 0.99 -0.22 -1.06 0.00 0.00 176.35 176.07 1hky s LEU 84 N 0.75 4.11 -0.35 1.48 2.96 -1.26 -4.99 118.68 121.38 1hky s LEU 84 Ca -0.09 1.87 -0.29 0.00 -0.22 0.00 0.00 54.13 55.40 1hky s LEU 84 Cb -0.12 -4.28 0.00 0.00 0.50 0.00 0.00 46.19 42.29 1hky s LEU 84 CO -0.00 -0.37 1.36 -0.70 -1.32 0.00 0.00 176.35 175.32 1hky s GLU 85 N -2.65 3.75 0.00 1.98 2.12 -1.26 -5.36 118.70 117.28 1hky s GLU 85 Ca 0.58 1.11 0.00 0.00 0.36 0.00 0.00 54.97 57.02 1hky s GLU 85 Cb -0.17 -3.95 0.00 0.00 0.26 0.00 0.00 34.13 30.27 1hky s GLU 85 CO 0.21 -1.34 0.00 -3.47 -0.54 0.00 0.00 175.26 170.12