#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 -3.85 -1.70 1.24 4.11 -1.26 -4.91 117.16 110.79 1hky n TYR 2 Ca 0.00 -0.93 -0.43 0.00 -0.00 0.00 0.00 57.90 56.54 1hky n TYR 2 Cb 0.00 -1.07 -0.03 0.00 -0.00 0.00 0.00 39.34 38.24 1hky n TYR 2 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.86 178.49 1hky n LYS 3 N -4.64 2.66 0.13 -3.48 5.02 -1.26 -4.87 118.16 111.73 1hky n LYS 3 Ca 0.14 0.96 0.06 0.00 -2.02 0.00 0.00 58.31 57.45 1hky n LYS 3 Cb 0.55 -2.82 0.52 0.00 -0.02 0.00 0.00 35.03 33.27 1hky n LYS 3 CO 0.00 0.00 0.00 0.22 -0.52 0.00 0.00 177.40 177.10 1hky h ASP 4 N 7.41 0.23 -3.04 4.39 3.58 -2.06 -3.41 116.42 123.50 1hky h ASP 4 Ca -0.45 -0.01 -0.60 0.00 0.42 0.00 0.00 57.03 56.39 1hky h ASP 4 Cb 1.22 -0.06 -0.05 0.00 1.72 0.00 0.00 39.33 42.17 1hky h ASP 4 CO 0.94 0.19 -0.30 1.51 -2.88 0.00 0.00 179.24 178.70 1hky s ASP 5 N -6.88 6.58 0.00 2.28 1.47 -1.26 -4.93 116.67 113.93 1hky s ASP 5 Ca -0.06 0.69 0.00 0.00 1.18 0.00 0.00 52.55 54.36 1hky s ASP 5 Cb 0.17 -2.14 0.00 0.00 -0.34 0.00 0.00 42.92 40.61 1hky s ASP 5 CO 0.70 0.19 0.00 -0.67 0.68 0.00 0.00 175.17 176.07 1hky n ASP 6 N 0.90 0.00 -4.90 2.11 2.03 -1.26 -5.12 116.55 110.30 1hky n ASP 6 Ca -0.09 0.00 -0.31 0.00 0.52 0.00 0.00 54.79 54.91 1hky n ASP 6 Cb 0.52 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.88 1hky n ASP 6 CO 0.00 0.00 0.00 -1.81 -1.92 0.00 0.00 177.20 173.47 1hky s ASP 7 N -1.14 6.26 0.96 1.67 1.01 -1.26 -5.11 116.67 119.06 1hky s ASP 7 Ca 0.00 0.24 -0.16 0.00 0.71 0.00 0.00 52.55 53.34 1hky s ASP 7 Cb 0.00 -1.90 0.20 0.00 1.01 0.00 0.00 42.92 42.22 1hky s ASP 7 CO 0.00 0.17 1.31 -0.54 0.21 0.00 0.00 175.17 176.33 1hky s LYS 8 N -2.48 0.62 -0.06 8.23 -0.14 -1.26 -4.97 119.74 119.68 1hky s LYS 8 Ca 0.34 -0.39 0.17 0.00 -1.36 0.00 0.00 55.97 54.73 1hky s LYS 8 Cb -0.13 -1.84 0.59 0.00 -1.68 0.00 0.00 37.83 34.77 1hky s LYS 8 CO 0.27 -2.43 1.49 1.33 -0.76 0.00 0.00 175.35 175.25 1hky n VAL 9 N -3.78 1.29 -3.74 3.17 0.24 -1.26 -4.87 118.33 109.37 1hky n VAL 9 Ca 0.15 -0.94 -0.37 0.00 -2.04 0.00 0.00 64.34 61.15 1hky n VAL 9 Cb 0.59 0.19 -0.12 0.00 -1.47 0.00 0.00 33.84 33.04 1hky n VAL 9 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 1hky s LYS 10 N -1.57 3.74 -0.12 7.34 1.02 -1.26 -4.95 119.74 123.94 1hky s LYS 10 Ca 0.43 -0.43 0.16 0.00 0.02 0.00 0.00 55.97 56.15 1hky s LYS 10 Cb 0.26 -3.38 0.63 0.00 -0.52 0.00 0.00 37.83 34.81 1hky s LYS 10 CO 0.24 -0.15 1.54 1.28 -0.92 0.00 0.00 175.35 177.34 1hky n LEU 11 N 4.83 4.38 -4.76 3.17 4.77 -1.26 -5.00 117.00 123.13 1hky n LEU 11 Ca -0.16 -2.53 -0.38 0.00 -0.03 0.00 0.00 56.01 52.91 1hky n LEU 11 Cb 0.52 -0.52 0.02 0.00 -2.33 0.00 0.00 43.42 41.10 1hky n LEU 11 CO 0.32 0.76 0.92 0.42 -1.33 0.00 0.00 177.39 178.48 1hky s THR 12 N -1.98 2.47 -0.36 -5.08 -4.23 -1.26 -4.67 115.64 100.53 1hky s THR 12 Ca 0.45 0.35 0.01 0.00 -1.18 0.00 0.00 61.69 61.32 1hky s THR 12 Cb 0.31 -3.18 0.11 0.00 1.34 0.00 0.00 72.50 71.08 1hky s THR 12 CO 0.19 -0.01 0.15 0.00 -0.54 0.00 0.00 174.62 174.42 1hky s TYR 14 N 1.10 2.63 -0.09 0.00 1.13 -1.26 -4.96 117.35 115.90 1hky s TYR 14 Ca 0.13 -0.35 -0.12 0.00 -1.41 0.00 0.00 57.07 55.32 1hky s TYR 14 Cb -0.20 -1.41 0.03 0.00 -1.10 0.00 0.00 41.96 39.27 1hky s TYR 14 CO -0.14 0.50 0.31 -0.65 -2.51 0.00 0.00 175.55 173.06 1hky s GLN 15 N -3.73 0.46 1.86 -3.49 -1.52 -0.26 -4.98 119.66 107.99 1hky s GLN 15 Ca 0.34 0.23 0.00 0.00 -1.95 0.00 0.00 55.36 53.99 1hky s GLN 15 Cb -0.03 0.21 0.00 0.00 -0.22 0.00 0.00 33.01 32.97 1hky s GLN 15 CO 0.20 -0.08 0.00 -1.71 -0.25 0.00 0.00 175.29 173.45 1hky n ASN 16 N 2.40 -5.03 -2.71 5.90 5.15 -1.26 -2.02 115.26 117.69 1hky n ASN 16 Ca -0.16 0.00 -0.08 0.00 -0.60 0.00 0.00 54.58 53.75 1hky n ASN 16 Cb 0.57 0.00 0.10 0.00 -0.53 0.00 0.00 39.78 39.92 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 1.33 3.60 8.20 0.00 -1.26 -4.58 105.19 112.49 1hky n GLY 17 Ca 0.00 -0.31 -0.08 0.00 0.00 0.00 0.00 46.02 45.63 1hky n GLY 17 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hky s VAL 18 N -0.34 0.00 0.00 1.61 0.11 0.12 -3.24 120.40 118.67 1hky s VAL 18 Ca 0.23 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.28 1hky s VAL 18 Cb 0.40 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 34.25 1hky s VAL 18 CO -0.07 0.00 0.00 -0.24 -3.33 0.00 0.00 175.10 171.46 1hky n SER 19 N 0.88 -0.45 -4.07 3.54 2.88 -1.26 -4.42 113.62 110.71 1hky n SER 19 Ca -0.08 -0.17 -0.07 0.00 -1.33 0.00 0.00 58.87 57.21 1hky n SER 19 Cb 0.58 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.94 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 -0.40 0.48 0.32 0.66 0.08 -1.26 -4.04 117.98 113.82 1hky s PHE 20 Ca 0.00 -1.01 -0.15 0.00 0.12 0.00 0.00 56.93 55.90 1hky s PHE 20 Cb 0.00 -0.36 0.02 0.00 -0.57 0.00 0.00 43.02 42.11 1hky s PHE 20 CO 0.00 -0.37 0.65 -0.08 -0.10 0.00 0.00 175.22 175.31 1hky s THR 21 N -3.75 0.00 0.00 0.64 -1.32 0.13 -4.89 115.64 106.45 1hky s THR 21 Ca 0.05 -1.19 0.00 0.00 -1.21 0.00 0.00 61.69 59.35 1hky s THR 21 Cb 0.07 -2.44 0.00 0.00 -1.51 0.00 0.00 72.50 68.62 1hky s THR 21 CO -0.09 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 172.93 1hky n GLY 22 N -0.48 1.42 3.35 6.08 0.00 -1.26 -0.83 105.19 113.46 1hky n GLY 22 Ca -0.04 -0.11 -0.28 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.55 3.00 -0.02 0.00 -1.26 -4.82 105.19 99.53 1hky n GLY 23 Ca 0.00 -1.53 -0.32 0.00 0.00 0.00 0.00 46.02 44.18 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 -5.40 2.07 -0.08 1.61 -0.14 -1.26 -4.97 119.74 111.57 1hky s LYS 24 Ca 0.68 -2.51 -0.30 0.00 -1.36 0.00 0.00 55.97 52.47 1hky s LYS 24 Cb -0.06 -3.42 -0.08 0.00 -1.68 0.00 0.00 37.83 32.60 1hky s LYS 24 CO 0.51 -1.11 2.07 0.00 -0.76 0.00 0.00 175.35 176.06 1hky n ALA 25 N 3.34 1.58 0.35 5.17 0.00 -1.26 -4.82 120.51 124.88 1hky n ALA 25 Ca 0.05 0.04 0.05 0.00 0.00 0.00 0.00 53.44 53.59 1hky n ALA 25 Cb 0.35 -2.75 0.24 0.00 0.00 0.00 0.00 19.45 17.28 1hky n ALA 25 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1hky n ILE 26 N 6.37 1.27 -3.64 0.00 -0.00 -1.15 -4.71 119.36 117.50 1hky n ILE 26 Ca 0.25 0.33 -0.06 0.00 -0.00 0.00 0.00 62.75 63.26 1hky n ILE 26 Cb 0.41 -1.16 -0.06 0.00 -0.00 0.00 0.00 39.64 38.82 1hky n ILE 26 CO 0.00 0.00 0.00 -0.55 -0.00 0.00 0.00 176.55 176.00 1hky s SER 27 N -3.08 -0.24 0.01 7.28 0.15 -1.26 -5.06 113.70 111.51 1hky s SER 27 Ca 0.05 0.42 0.05 0.00 0.70 0.00 0.00 55.95 57.17 1hky s SER 27 Cb 0.07 0.41 -0.02 0.00 -1.71 0.00 0.00 66.02 64.77 1hky s SER 27 CO 0.20 -0.11 -0.16 -1.61 1.20 0.00 0.00 173.24 172.76 1hky s GLU 28 N -0.15 1.23 -0.38 5.44 2.02 -1.26 -1.24 118.70 124.36 1hky s GLU 28 Ca 0.05 -0.67 0.03 0.00 0.02 0.00 0.00 54.97 54.40 1hky s GLU 28 Cb -0.04 -1.22 0.11 0.00 0.10 0.00 0.00 34.13 33.07 1hky s GLU 28 CO -0.09 0.33 0.10 0.00 0.02 0.00 0.00 175.26 175.61 1hky s ALA 29 N -0.54 2.99 -0.86 5.21 0.00 -0.16 -4.93 121.76 123.47 1hky s ALA 29 Ca 0.05 -2.66 -0.26 0.00 0.00 0.00 0.00 51.96 49.10 1hky s ALA 29 Cb -0.07 -2.05 -0.16 0.00 0.00 0.00 0.00 23.12 20.84 1hky s ALA 29 CO 0.00 -1.76 2.35 1.17 0.00 0.00 0.00 175.76 177.52 1hky n LYS 30 N 4.11 0.45 -4.20 0.00 4.81 -1.26 -0.69 118.16 121.37 1hky n LYS 30 Ca 0.04 -1.04 -0.14 0.00 -0.87 0.00 0.00 58.31 56.30 1hky n LYS 30 Cb 0.40 -3.73 -0.10 0.00 0.02 0.00 0.00 35.03 31.62 1hky n LYS 30 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1hky s ALA 31 N 15.35 1.20 -1.29 3.14 0.00 -1.26 -4.93 121.76 133.98 1hky s ALA 31 Ca 0.91 -1.32 0.23 0.00 0.00 0.00 0.00 51.96 51.78 1hky s ALA 31 Cb -0.12 0.06 0.07 0.00 0.00 0.00 0.00 23.12 23.12 1hky s ALA 31 CO 0.11 -0.09 1.11 0.00 0.00 0.00 0.00 175.76 176.89 1hky n ALA 32 N 0.21 4.10 -2.85 0.00 0.00 -1.26 -2.04 120.51 118.67 1hky n ALA 32 Ca -0.13 -0.54 -0.19 0.00 0.00 0.00 0.00 53.44 52.58 1hky n ALA 32 Cb 0.59 -0.88 -0.15 0.00 0.00 0.00 0.00 19.45 19.01 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 -2.84 1.07 0.41 0.00 1.04 -1.26 -4.81 113.70 107.31 1hky s SER 33 Ca 0.12 -0.16 0.09 0.00 0.48 0.00 0.00 55.95 56.48 1hky s SER 33 Cb 0.17 -0.20 0.90 0.00 0.10 0.00 0.00 66.02 66.99 1hky s SER 33 CO 0.74 0.08 2.03 0.28 0.98 0.00 0.00 173.24 177.36 1hky h SER 34 N 6.14 0.45 -0.97 7.02 0.02 -1.92 -2.06 113.55 122.24 1hky h SER 34 Ca -0.32 -0.01 0.19 0.00 -0.84 0.00 0.00 61.79 60.82 1hky h SER 34 Cb 1.18 -0.11 -0.11 0.00 0.14 0.00 0.00 62.40 63.50 1hky h SER 34 CO 0.49 0.31 0.57 -0.61 -1.14 0.00 0.00 176.83 176.45 1hky h GLN 35 N 0.53 0.67 -0.44 3.45 4.15 -1.99 0.22 115.11 121.69 1hky h GLN 35 Ca 0.19 -0.04 -0.11 0.00 0.77 0.00 0.00 58.65 59.46 1hky h GLN 35 Cb 0.11 -0.15 -0.02 0.00 0.21 0.00 0.00 27.48 27.64 1hky h GLN 35 CO -0.05 0.44 -0.16 0.00 -1.93 0.00 0.00 178.83 177.13 1hky h ALA 36 N 1.65 0.88 0.00 3.38 0.00 -1.80 -2.42 119.26 120.95 1hky h ALA 36 Ca 0.57 -0.35 -0.05 0.00 0.00 0.00 0.00 54.91 55.08 1hky h ALA 36 Cb 0.92 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 1hky h ALA 36 CO -0.41 0.63 -0.25 0.00 0.00 0.00 0.00 179.25 179.23 1hky h GLN 38 N 0.00 0.11 -0.23 0.00 4.20 -0.48 -1.55 115.11 117.16 1hky h GLN 38 Ca -0.00 -0.06 -0.10 0.00 0.06 0.00 0.00 58.65 58.54 1hky h GLN 38 Cb 0.61 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.38 1hky h GLN 38 CO 0.03 0.61 -0.31 0.93 -0.67 0.00 0.00 178.83 179.42 1hky h GLU 39 N -0.39 0.46 0.68 1.46 5.08 -1.36 -1.35 114.58 119.15 1hky h GLU 39 Ca 0.00 -0.19 -0.03 0.00 -1.00 0.00 0.00 59.36 58.14 1hky h GLU 39 Cb 0.60 -0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.84 1hky h GLU 39 CO 0.01 0.72 -0.33 1.25 -1.00 0.00 0.00 179.01 179.67 1hky h LEU 40 N 0.40 -0.77 -2.33 1.33 7.12 -1.28 -2.87 115.31 116.91 1hky h LEU 40 Ca 0.05 -0.00 -0.00 0.00 0.13 0.00 0.00 57.88 58.06 1hky h LEU 40 Cb 0.74 0.20 -0.00 0.00 -0.53 0.00 0.00 40.66 41.07 1hky h LEU 40 CO 0.06 -0.41 -0.01 0.00 -0.13 0.00 0.00 178.44 177.95 1hky h GLU 42 N 0.00 0.00 0.00 0.00 4.39 -1.08 -1.70 114.58 116.19 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 0.01 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.66 1hky h GLU 42 CO 0.00 0.28 -0.11 1.63 -1.16 0.00 0.00 179.01 179.65 1hky n LYS 43 N -4.18 0.08 -3.08 2.33 4.76 -0.33 -4.85 118.16 112.90 1hky n LYS 43 Ca -0.02 0.05 -0.25 0.00 -2.87 0.00 0.00 58.31 55.22 1hky n LYS 43 Cb 0.33 -1.58 -0.00 0.00 -1.84 0.00 0.00 35.03 31.93 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 -3.42 6.20 -0.07 4.39 2.15 -0.64 -5.01 116.67 120.27 1hky s ASP 44 Ca 0.12 0.57 0.10 0.00 0.43 0.00 0.00 52.55 53.78 1hky s ASP 44 Cb 0.17 -2.01 0.20 0.00 -0.30 0.00 0.00 42.92 40.98 1hky s ASP 44 CO 0.58 -0.46 1.13 0.00 -0.17 0.00 0.00 175.17 176.25 1hky n ALA 45 N -1.99 2.23 -0.40 3.66 0.00 -1.26 -4.53 120.51 118.22 1hky n ALA 45 Ca -0.02 -1.78 0.00 0.00 0.00 0.00 0.00 53.44 51.64 1hky n ALA 45 Cb 0.56 -0.27 0.00 0.00 0.00 0.00 0.00 19.45 19.74 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 -0.75 1.30 -3.71 0.00 5.02 -1.26 -5.06 118.16 113.70 1hky n LYS 46 Ca 0.10 -0.93 -0.33 0.00 -2.02 0.00 0.00 58.31 55.12 1hky n LYS 46 Cb 0.49 -0.80 -0.05 0.00 -0.02 0.00 0.00 35.03 34.65 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 0.61 0.00 -3.64 0.00 1.74 -1.21 -4.90 116.66 109.26 1hky n ARG 48 Ca -0.07 0.00 -0.29 0.00 -0.77 0.00 0.00 57.85 56.72 1hky n ARG 48 Cb 0.52 -0.28 -0.12 0.00 -1.02 0.00 0.00 32.46 31.55 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 -1.01 1.75 0.88 -1.55 0.08 -0.45 -3.84 117.98 113.84 1hky s PHE 49 Ca 0.00 -2.33 -0.11 0.00 0.12 0.00 0.00 56.93 54.61 1hky s PHE 49 Cb 0.00 -1.64 0.12 0.00 -0.57 0.00 0.00 43.02 40.93 1hky s PHE 49 CO 0.00 -0.78 1.09 -0.59 -0.10 0.00 0.00 175.22 174.84 1hky s PHE 50 N 0.31 2.35 -0.31 0.36 -0.71 -1.25 -1.75 117.98 116.98 1hky s PHE 50 Ca 0.20 1.29 0.05 0.00 -1.04 0.00 0.00 56.93 57.43 1hky s PHE 50 Cb -0.19 -3.15 0.18 0.00 -1.21 0.00 0.00 43.02 38.66 1hky s PHE 50 CO -0.04 -2.32 0.53 0.99 -1.34 0.00 0.00 175.22 173.04 1hky s THR 51 N -2.93 -0.86 0.41 -4.49 2.01 0.22 -2.25 115.64 107.75 1hky s THR 51 Ca 0.63 -0.14 -0.06 0.00 0.31 0.00 0.00 61.69 62.44 1hky s THR 51 Cb -0.18 -0.84 -0.05 0.00 0.01 0.00 0.00 72.50 71.44 1hky s THR 51 CO 0.57 -0.12 0.70 -0.22 -0.69 0.00 0.00 174.62 174.86 1hky s LEU 52 N 2.54 3.82 0.00 4.42 2.96 0.36 -0.58 118.68 132.20 1hky s LEU 52 Ca 0.11 0.87 0.00 0.00 -0.22 0.00 0.00 54.13 54.89 1hky s LEU 52 Cb -0.10 -3.76 0.00 0.00 0.50 0.00 0.00 46.19 42.83 1hky s LEU 52 CO -0.24 -0.42 0.00 0.00 -1.32 0.00 0.00 176.35 174.38 1hky n ALA 53 N -1.70 0.00 0.06 5.97 0.00 0.72 -0.96 120.51 124.61 1hky n ALA 53 Ca -0.00 0.00 0.20 0.00 0.00 0.00 0.00 53.44 53.64 1hky n ALA 53 Cb 0.55 0.00 0.74 0.00 0.00 0.00 0.00 19.45 20.74 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 -1.88 -3.34 113.55 108.35 1hky h SER 54 Ca 0.00 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 60.89 1hky h SER 54 Cb 0.00 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.48 1hky h SER 54 CO 0.00 0.00 -0.10 0.61 -1.14 0.00 0.00 176.83 176.20 1hky n GLY 55 N -1.54 0.12 3.56 -3.77 0.00 -1.26 -4.79 105.19 97.51 1hky n GLY 55 Ca 0.08 -0.06 -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 0.04 0.47 0.17 1.61 2.20 -0.86 -3.98 119.74 119.39 1hky s LYS 56 Ca 0.03 1.03 -0.01 0.00 -0.36 0.00 0.00 55.97 56.66 1hky s LYS 56 Cb 0.15 0.47 -0.04 0.00 -1.51 0.00 0.00 37.83 36.90 1hky s LYS 56 CO -0.04 -0.14 0.36 0.00 -0.36 0.00 0.00 175.35 175.17 1hky s SER 58 N -2.94 -0.00 0.17 0.00 0.01 0.26 -0.99 113.70 110.20 1hky s SER 58 Ca 0.38 0.61 -0.08 0.00 1.31 0.00 0.00 55.95 58.18 1hky s SER 58 Cb -0.11 1.21 -0.06 0.00 0.21 0.00 0.00 66.02 67.26 1hky s SER 58 CO 0.28 -0.26 0.46 -1.48 0.41 0.00 0.00 173.24 172.64 1hky s LEU 59 N 2.57 4.24 -0.06 2.44 2.34 -0.37 0.72 118.68 130.55 1hky s LEU 59 Ca 0.05 0.76 -0.01 0.00 0.06 0.00 0.00 54.13 55.00 1hky s LEU 59 Cb -0.14 -3.43 0.03 0.00 -0.56 0.00 0.00 46.19 42.09 1hky s LEU 59 CO -0.14 0.01 0.01 -0.36 -1.06 0.00 0.00 176.35 174.81 1hky s PHE 60 N -1.69 0.55 0.00 3.48 0.08 -0.72 -2.95 117.98 116.74 1hky s PHE 60 Ca 0.43 -0.09 0.00 0.00 0.12 0.00 0.00 56.93 57.38 1hky s PHE 60 Cb -0.12 -0.71 0.00 0.00 -0.57 0.00 0.00 43.02 41.62 1hky s PHE 60 CO 0.22 -0.28 0.48 0.00 -0.10 0.00 0.00 175.22 175.54 1hky n ALA 61 N 4.99 -0.01 -2.82 5.36 0.00 -1.22 -1.34 120.51 125.47 1hky n ALA 61 Ca -0.10 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.01 1hky n ALA 61 Cb 0.50 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.89 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 -1.94 5.88 -0.48 0.00 -1.08 -1.26 -4.44 116.67 113.36 1hky s ASP 62 Ca 0.00 0.21 -0.28 0.00 -0.52 0.00 0.00 52.55 51.97 1hky s ASP 62 Cb 0.00 -1.75 -0.01 0.00 -1.46 0.00 0.00 42.92 39.71 1hky s ASP 62 CO 0.00 0.28 1.64 -1.81 0.52 0.00 0.00 175.17 175.80 1hky s ASP 63 N -1.73 5.89 0.00 -0.34 1.01 -1.26 -4.87 116.67 115.36 1hky s ASP 63 Ca 0.23 0.70 0.00 0.00 0.71 0.00 0.00 52.55 54.20 1hky s ASP 63 Cb -0.12 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 41.27 1hky s ASP 63 CO 0.14 -1.82 0.00 0.00 0.21 0.00 0.00 175.17 173.70 1hky n ALA 64 N 10.42 0.00 -2.02 5.23 0.00 -1.26 -4.96 120.51 127.92 1hky n ALA 64 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.62 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 -1.44 2.07 -1.72 0.00 0.00 -1.26 -5.07 120.51 113.09 1hky n ALA 65 Ca 0.00 -0.72 -0.40 0.00 0.00 0.00 0.00 53.44 52.32 1hky n ALA 65 Cb 0.00 -0.34 -0.03 0.00 0.00 0.00 0.00 19.45 19.08 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 3.42 0.29 0.00 0.05 -1.26 -4.28 118.68 116.89 1hky s LEU 66 Ca 0.02 1.27 0.07 0.00 0.05 0.00 0.00 54.13 55.54 1hky s LEU 66 Cb 0.02 -3.00 -0.03 0.00 -2.05 0.00 0.00 46.19 41.12 1hky s LEU 66 CO -0.01 -2.32 0.24 -0.13 -0.55 0.00 0.00 176.35 173.58 1hky s ARG 67 N 7.04 2.85 0.96 1.48 0.52 -0.01 -4.74 118.95 127.06 1hky s ARG 67 Ca 0.91 -1.15 -0.12 0.00 -0.52 0.00 0.00 55.73 54.85 1hky s ARG 67 Cb -0.22 -2.54 0.17 0.00 0.52 0.00 0.00 34.95 32.88 1hky s ARG 67 CO 0.29 0.27 1.10 -1.25 0.02 0.00 0.00 175.30 175.73 1hky s PRO 68 N -3.91 0.70 0.00 3.54 0.04 -1.26 0.22 135.00 134.33 1hky s PRO 68 Ca 0.36 0.55 0.00 0.00 0.04 0.00 0.00 61.00 61.96 1hky s PRO 68 Cb -0.07 -1.77 0.00 0.00 0.04 0.00 0.00 34.50 32.70 1hky s PRO 68 CO 0.26 -2.55 0.00 -2.37 0.04 0.00 0.00 177.00 172.37 1hky n THR 69 N -4.06 0.00 -0.84 1.26 5.66 -1.26 -4.72 114.28 110.33 1hky n THR 69 Ca 0.06 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.06 1hky n THR 69 Cb 0.57 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.35 1hky n THR 69 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 1hky n LYS 70 N -0.08 2.26 0.00 1.09 4.76 -1.26 -4.98 118.16 119.94 1hky n LYS 70 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1hky n LYS 70 Cb 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 1hky n LYS 70 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 1hky n SER 71 N 0.00 0.60 0.22 4.39 7.64 -1.26 -4.73 113.62 120.48 1hky n SER 71 Ca 0.00 0.00 0.15 0.00 1.01 0.00 0.00 58.87 60.03 1hky n SER 71 Cb 0.00 0.00 0.77 0.00 -1.01 0.00 0.00 64.21 63.97 1hky n SER 71 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 1hky h ASP 72 N 0.00 0.00 0.52 6.43 5.19 -1.98 -1.80 116.42 124.78 1hky h ASP 72 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1hky h ASP 72 Cb 0.00 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.51 1hky h ASP 72 CO 0.00 0.00 0.00 0.61 -3.12 0.00 0.00 179.24 176.73 1hky n GLY 73 N -0.87 -1.13 3.46 2.75 0.00 -1.26 -4.64 105.19 103.50 1hky n GLY 73 Ca -0.01 0.09 -0.33 0.00 0.00 0.00 0.00 46.02 45.77 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 -3.32 2.64 -0.02 4.61 0.00 -0.68 -2.83 121.76 122.16 1hky s ALA 74 Ca 0.03 -0.98 0.03 0.00 0.00 0.00 0.00 51.96 51.04 1hky s ALA 74 Cb 0.08 -0.96 -0.00 0.00 0.00 0.00 0.00 23.12 22.24 1hky s ALA 74 CO 0.32 0.54 -0.11 0.08 0.00 0.00 0.00 175.76 176.59 1hky s VAL 75 N -0.68 0.93 0.25 0.00 1.01 -0.13 -0.70 120.40 121.08 1hky s VAL 75 Ca 0.10 -0.48 0.00 0.00 0.00 0.00 0.00 61.98 61.61 1hky s VAL 75 Cb -0.11 -0.79 -0.00 0.00 0.00 0.00 0.00 36.38 35.48 1hky s VAL 75 CO 0.01 0.27 0.00 -1.54 0.00 0.00 0.00 175.10 173.84 1hky n SER 76 N 2.99 2.62 -3.56 3.32 3.41 -0.86 -0.49 113.62 121.05 1hky n SER 76 Ca -0.16 -2.09 -0.06 0.00 -0.26 0.00 0.00 58.87 56.30 1hky n SER 76 Cb 0.55 0.19 -0.00 0.00 -0.26 0.00 0.00 64.21 64.69 1hky n SER 76 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1hky s GLY 77 N -2.36 0.02 0.20 5.00 0.00 -0.95 -1.10 107.32 108.12 1hky s GLY 77 Ca 0.00 -0.34 -0.15 0.00 0.00 0.00 0.00 44.72 44.24 1hky s GLY 77 CO 0.00 0.09 0.48 0.54 0.00 0.00 0.00 173.10 174.21 1hky s ASN 78 N -3.00 -0.16 -1.42 1.64 4.22 -1.26 -3.82 114.94 111.13 1hky s ASN 78 Ca 0.13 -0.66 -0.08 0.00 -2.14 0.00 0.00 52.86 50.11 1hky s ASN 78 Cb -0.05 0.56 0.04 0.00 1.28 0.00 0.00 41.25 43.09 1hky s ASN 78 CO 0.07 -1.06 0.95 0.29 -2.04 0.00 0.00 177.10 175.31 1hky n LYS 79 N -0.33 -5.87 0.00 3.55 5.02 -1.25 -4.27 118.16 115.00 1hky n LYS 79 Ca -0.07 0.66 0.00 0.00 -2.02 0.00 0.00 58.31 56.88 1hky n LYS 79 Cb 0.62 -5.50 0.00 0.00 -0.02 0.00 0.00 35.03 30.13 1hky n LYS 79 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1hky n ARG 80 N -4.60 0.00 -2.86 1.97 1.74 -1.25 -4.86 116.66 106.80 1hky n ARG 80 Ca -0.08 0.00 -0.02 0.00 -0.77 0.00 0.00 57.85 56.98 1hky n ARG 80 Cb 0.58 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.02 1hky n ARG 80 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1hky n ILE 82 N 0.66 0.00 -1.93 0.00 -0.00 -1.26 -4.86 119.36 111.97 1hky n ILE 82 Ca 0.01 -1.94 -0.42 0.00 -0.00 0.00 0.00 62.75 60.40 1hky n ILE 82 Cb 0.18 -0.01 -0.03 0.00 -0.00 0.00 0.00 39.64 39.78 1hky n ILE 82 CO 0.00 0.00 0.00 -0.22 -0.00 0.00 0.00 176.55 176.33 1hky s LEU 83 N 0.00 3.48 -0.35 7.28 0.20 -1.26 -3.91 118.68 124.12 1hky s LEU 83 Ca 0.23 1.32 -0.10 0.00 0.69 0.00 0.00 54.13 56.28 1hky s LEU 83 Cb -0.02 -3.42 0.01 0.00 -0.43 0.00 0.00 46.19 42.33 1hky s LEU 83 CO 0.15 -1.82 0.30 -0.11 -0.29 0.00 0.00 176.35 174.58 1hky n LEU 84 N 10.80 -7.23 -4.66 -0.68 0.00 -1.26 -4.85 117.00 109.10 1hky n LEU 84 Ca 0.24 0.87 -0.42 0.00 0.00 0.00 0.00 56.01 56.69 1hky n LEU 84 Cb 0.47 -3.10 -0.03 0.00 0.00 0.00 0.00 43.42 40.76 1hky n LEU 84 CO 0.68 -2.49 1.35 -1.61 0.00 0.00 0.00 177.39 175.33 1hky s GLU 85 N -2.05 4.19 0.00 1.96 2.02 -1.25 -5.22 118.70 118.35 1hky s GLU 85 Ca 0.13 2.19 0.18 0.00 0.02 0.00 0.00 54.97 57.49 1hky s GLU 85 Cb -0.03 -3.93 1.06 0.00 0.10 0.00 0.00 34.13 31.32 1hky s GLU 85 CO 0.72 -0.82 1.46 -0.25 0.02 0.00 0.00 175.26 176.39