#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 -0.07 0.00 -0.67 0.18 -1.26 -4.91 117.16 110.43 1hky n TYR 2 Ca 0.00 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.78 1hky n TYR 2 Cb 0.00 0.01 0.00 0.00 -0.38 0.00 0.00 39.34 38.97 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 -0.00 0.00 0.00 -3.48 2.85 -1.26 -5.13 118.16 111.14 1hky n LYS 3 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1hky n LYS 3 Cb 0.00 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.38 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 -0.66 0.00 -2.26 -5.58 -0.08 -1.26 -5.17 116.55 101.54 1hky n ASP 4 Ca 0.00 0.00 -0.03 0.00 -1.51 0.00 0.00 54.79 53.25 1hky n ASP 4 Cb 0.00 0.01 -0.01 0.00 2.34 0.00 0.00 41.12 43.46 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 -1.05 2.10 0.00 1.67 9.92 -1.26 -5.12 116.55 122.81 1hky n ASP 5 Ca 0.00 -1.24 0.00 0.00 -0.53 0.00 0.00 54.79 53.02 1hky n ASP 5 Cb 0.00 0.04 0.00 0.00 -0.64 0.00 0.00 41.12 40.52 1hky n ASP 5 CO 0.00 0.00 0.00 -0.67 0.13 0.00 0.00 177.20 176.66 1hky n ASP 6 N -1.07 0.00 -4.83 -2.24 2.03 -1.26 -5.14 116.55 104.04 1hky n ASP 6 Ca -0.02 0.00 -0.25 0.00 0.52 0.00 0.00 54.79 55.04 1hky n ASP 6 Cb 0.07 0.00 0.08 0.00 -0.72 0.00 0.00 41.12 40.55 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 0.72 4.69 -0.27 1.67 1.01 -1.26 -5.05 116.67 118.19 1hky s ASP 7 Ca 0.00 0.20 -0.08 0.00 0.71 0.00 0.00 52.55 53.37 1hky s ASP 7 Cb 0.00 -0.80 -0.13 0.00 1.01 0.00 0.00 42.92 43.00 1hky s ASP 7 CO 0.00 -1.64 -0.31 0.29 0.21 0.00 0.00 175.17 173.72 1hky n LYS 8 N -2.85 0.60 -3.87 8.23 5.02 -1.26 -5.02 118.16 119.01 1hky n LYS 8 Ca 0.10 0.22 -0.11 0.00 -2.02 0.00 0.00 58.31 56.49 1hky n LYS 8 Cb 0.60 -1.48 -0.12 0.00 -0.02 0.00 0.00 35.03 34.01 1hky n LYS 8 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1hky s VAL 9 N -2.50 0.04 -0.03 -0.18 -7.23 -1.26 -5.16 120.40 104.08 1hky s VAL 9 Ca -0.37 -0.31 0.06 0.00 -1.81 0.00 0.00 61.98 59.56 1hky s VAL 9 Cb 0.13 -0.23 -0.01 0.00 0.56 0.00 0.00 36.38 36.82 1hky s VAL 9 CO 0.52 -0.17 -0.21 -1.59 -0.31 0.00 0.00 175.10 173.34 1hky s LYS 10 N -0.53 1.86 0.00 4.82 -2.85 -1.26 -5.02 119.74 116.76 1hky s LYS 10 Ca -0.06 -0.76 0.00 0.00 -1.00 0.00 0.00 55.97 54.15 1hky s LYS 10 Cb -0.04 -1.73 0.00 0.00 -2.06 0.00 0.00 37.83 34.00 1hky s LYS 10 CO 0.00 0.42 0.00 1.28 0.10 0.00 0.00 175.35 177.15 1hky n LEU 11 N 2.70 0.00 -4.74 2.77 4.32 -1.26 -5.14 117.00 115.65 1hky n LEU 11 Ca -0.16 0.00 -0.27 0.00 -0.02 0.00 0.00 56.01 55.56 1hky n LEU 11 Cb 0.53 0.06 -0.07 0.00 -1.62 0.00 0.00 43.42 42.32 1hky n LEU 11 CO 0.24 -0.36 -0.27 0.28 -1.22 0.00 0.00 177.39 176.06 1hky s THR 12 N -0.72 4.15 0.84 -5.08 -1.32 -1.26 -5.11 115.64 107.14 1hky s THR 12 Ca 0.00 -1.21 -0.11 0.00 -1.21 0.00 0.00 61.69 59.16 1hky s THR 12 Cb 0.00 -3.10 0.10 0.00 -1.51 0.00 0.00 72.50 67.99 1hky s THR 12 CO 0.00 -0.09 1.09 0.00 -2.21 0.00 0.00 174.62 173.41 1hky s TYR 14 N -2.89 2.63 -0.19 0.00 1.13 -1.26 -4.90 117.35 111.86 1hky s TYR 14 Ca 0.63 -0.53 -0.13 0.00 -1.41 0.00 0.00 57.07 55.62 1hky s TYR 14 Cb -0.18 -1.88 0.06 0.00 -1.10 0.00 0.00 41.96 38.85 1hky s TYR 14 CO 0.57 0.21 0.49 -0.65 -2.51 0.00 0.00 175.55 173.66 1hky s GLN 15 N -3.89 0.51 1.91 -3.49 -1.52 0.19 -4.93 119.66 108.43 1hky s GLN 15 Ca 0.40 0.83 0.00 0.00 -1.95 0.00 0.00 55.36 54.65 1hky s GLN 15 Cb 0.02 0.10 0.00 0.00 -0.22 0.00 0.00 33.01 32.91 1hky s GLN 15 CO 0.23 -0.13 0.00 0.09 -0.25 0.00 0.00 175.29 175.23 1hky n ASN 16 N 3.80 -4.16 -0.60 5.90 5.03 -1.26 -1.66 115.26 122.31 1hky n ASN 16 Ca -0.20 0.00 -0.02 0.00 0.87 0.00 0.00 54.58 55.23 1hky n ASN 16 Cb 0.56 0.00 -0.02 0.00 -1.02 0.00 0.00 39.78 39.30 1hky n ASN 16 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1hky n GLY 17 N 0.00 0.46 3.16 7.41 0.00 -1.26 -4.40 105.19 110.56 1hky n GLY 17 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 1hky n GLY 17 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1hky s VAL 18 N 0.00 1.41 0.61 1.61 1.01 -1.26 -3.48 120.40 120.30 1hky s VAL 18 Ca 0.00 -0.75 -0.19 0.00 0.00 0.00 0.00 61.98 61.04 1hky s VAL 18 Cb 0.00 -1.18 -0.02 0.00 0.00 0.00 0.00 36.38 35.17 1hky s VAL 18 CO 0.00 0.40 1.32 -0.55 0.00 0.00 0.00 175.10 176.27 1hky s SER 19 N -0.30 4.84 0.04 3.32 0.15 -0.75 -4.79 113.70 116.20 1hky s SER 19 Ca 0.04 2.67 0.03 0.00 0.70 0.00 0.00 55.95 59.39 1hky s SER 19 Cb -0.08 -2.62 -0.04 0.00 -1.71 0.00 0.00 66.02 61.57 1hky s SER 19 CO 0.00 -1.85 0.00 -0.36 1.20 0.00 0.00 173.24 172.23 1hky s PHE 20 N -1.36 3.04 0.12 3.44 0.08 -1.26 -2.26 117.98 119.78 1hky s PHE 20 Ca 0.79 0.04 -0.12 0.00 0.12 0.00 0.00 56.93 57.76 1hky s PHE 20 Cb -0.39 -1.62 0.01 0.00 -0.57 0.00 0.00 43.02 40.46 1hky s PHE 20 CO 0.42 0.47 0.30 0.95 -0.10 0.00 0.00 175.22 177.27 1hky s THR 21 N -1.18 0.10 0.00 0.64 -4.23 0.41 -4.88 115.64 106.49 1hky s THR 21 Ca 0.22 -0.98 0.00 0.00 -1.18 0.00 0.00 61.69 59.75 1hky s THR 21 Cb -0.12 -1.39 0.00 0.00 1.34 0.00 0.00 72.50 72.34 1hky s THR 21 CO 0.14 -0.43 0.00 0.61 -0.54 0.00 0.00 174.62 174.39 1hky n GLY 22 N -0.17 3.00 3.67 3.99 0.00 -1.26 -1.37 105.19 113.05 1hky n GLY 22 Ca -0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.59 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 -1.13 1.61 -1.39 -0.02 0.00 -1.18 -4.53 107.32 100.68 1hky s GLY 23 Ca 0.00 -0.03 -0.07 0.00 0.00 0.00 0.00 44.72 44.62 1hky s GLY 23 CO 0.00 0.50 2.45 0.28 0.00 0.00 0.00 173.10 176.34 1hky n LYS 24 N -4.14 4.22 -1.57 2.90 4.76 -1.26 -4.90 118.16 118.17 1hky n LYS 24 Ca 0.07 -3.15 -0.41 0.00 -2.87 0.00 0.00 58.31 51.94 1hky n LYS 24 Cb 0.55 -2.73 -0.03 0.00 -1.84 0.00 0.00 35.03 30.98 1hky n LYS 24 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1hky n ALA 25 N 2.55 1.40 0.71 7.82 0.00 -1.26 -4.63 120.51 127.10 1hky n ALA 25 Ca 0.63 -0.47 0.09 0.00 0.00 0.00 0.00 53.44 53.69 1hky n ALA 25 Cb 0.26 -2.99 0.41 0.00 0.00 0.00 0.00 19.45 17.13 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 7.81 0.65 -3.65 0.00 -0.00 -1.15 -4.76 119.36 118.27 1hky n ILE 26 Ca 0.34 0.16 -0.04 0.00 -0.00 0.00 0.00 62.75 63.21 1hky n ILE 26 Cb 0.46 -0.85 -0.07 0.00 -0.00 0.00 0.00 39.64 39.18 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 -2.84 -0.11 0.00 7.28 0.15 -1.26 -5.06 113.70 111.86 1hky s SER 27 Ca 0.12 0.21 0.01 0.00 0.70 0.00 0.00 55.95 56.99 1hky s SER 27 Cb 0.12 0.21 -0.00 0.00 -1.71 0.00 0.00 66.02 64.64 1hky s SER 27 CO 0.31 -0.04 -0.02 -1.61 1.20 0.00 0.00 173.24 173.08 1hky s GLU 28 N 0.02 0.20 -0.23 5.44 2.02 -1.26 -1.39 118.70 123.50 1hky s GLU 28 Ca 0.07 -0.13 -0.02 0.00 0.02 0.00 0.00 54.97 54.92 1hky s GLU 28 Cb -0.05 -0.17 0.07 0.00 0.10 0.00 0.00 34.13 34.08 1hky s GLU 28 CO -0.14 0.05 0.03 0.00 0.02 0.00 0.00 175.26 175.22 1hky s ALA 29 N -0.16 1.31 -0.69 5.21 0.00 -0.58 -4.94 121.76 121.91 1hky s ALA 29 Ca -0.00 -1.04 -0.26 0.00 0.00 0.00 0.00 51.96 50.66 1hky s ALA 29 Cb -0.02 -1.33 -0.12 0.00 0.00 0.00 0.00 23.12 21.66 1hky s ALA 29 CO -0.00 -1.29 2.42 1.63 0.00 0.00 0.00 175.76 178.52 1hky n LYS 30 N 4.93 0.71 -4.48 0.00 5.02 -1.26 -0.99 118.16 122.09 1hky n LYS 30 Ca -0.08 -0.51 -0.23 0.00 -2.02 0.00 0.00 58.31 55.47 1hky n LYS 30 Cb 0.45 -3.51 -0.14 0.00 -0.02 0.00 0.00 35.03 31.82 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 13.46 1.51 -2.23 7.82 0.00 -1.13 -4.79 121.76 136.40 1hky s ALA 31 Ca 0.97 -0.98 0.27 0.00 0.00 0.00 0.00 51.96 52.22 1hky s ALA 31 Cb -0.18 -0.26 1.33 0.00 0.00 0.00 0.00 23.12 24.00 1hky s ALA 31 CO 0.17 0.32 1.89 0.00 0.00 0.00 0.00 175.76 178.13 1hky n ALA 32 N 1.78 2.61 -3.53 0.00 0.00 -1.26 -2.05 120.51 118.06 1hky n ALA 32 Ca -0.18 -0.33 -0.14 0.00 0.00 0.00 0.00 53.44 52.80 1hky n ALA 32 Cb 0.54 -1.30 -0.15 0.00 0.00 0.00 0.00 19.45 18.54 1hky n ALA 32 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1hky s SER 33 N -1.90 -0.05 0.39 0.00 0.01 -1.26 -4.69 113.70 106.20 1hky s SER 33 Ca 0.40 0.18 0.07 0.00 1.31 0.00 0.00 55.95 57.91 1hky s SER 33 Cb 0.20 0.10 0.81 0.00 0.21 0.00 0.00 66.02 67.34 1hky s SER 33 CO 0.33 -0.11 2.02 0.28 0.41 0.00 0.00 173.24 176.17 1hky h SER 34 N 6.92 0.55 -1.00 2.44 0.02 -1.93 -1.86 113.55 118.70 1hky h SER 34 Ca -0.39 -0.01 0.15 0.00 -0.84 0.00 0.00 61.79 60.71 1hky h SER 34 Cb 1.15 -0.13 -0.09 0.00 0.14 0.00 0.00 62.40 63.47 1hky h SER 34 CO 0.45 0.38 0.62 -0.61 -1.14 0.00 0.00 176.83 176.54 1hky h GLN 35 N 0.64 0.84 -0.66 3.45 4.15 -1.99 0.75 115.11 122.30 1hky h GLN 35 Ca 0.21 -0.05 -0.06 0.00 0.77 0.00 0.00 58.65 59.52 1hky h GLN 35 Cb 0.05 -0.19 -0.03 0.00 0.21 0.00 0.00 27.48 27.52 1hky h GLN 35 CO -0.05 0.56 0.19 0.00 -1.93 0.00 0.00 178.83 177.59 1hky h ALA 36 N 1.59 1.09 0.00 3.38 0.00 -1.76 -1.99 119.26 121.57 1hky h ALA 36 Ca 0.53 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 55.16 1hky h ALA 36 Cb 0.69 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1hky h ALA 36 CO -0.31 0.62 -0.29 0.00 0.00 0.00 0.00 179.25 179.28 1hky h GLN 38 N 0.00 0.39 -0.73 0.00 4.20 -0.52 -0.86 115.11 117.59 1hky h GLN 38 Ca -0.00 -0.18 -0.04 0.00 0.06 0.00 0.00 58.65 58.49 1hky h GLN 38 Cb 0.59 -0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.33 1hky h GLN 38 CO 0.04 0.71 0.31 0.93 -0.67 0.00 0.00 178.83 180.15 1hky h GLU 39 N 0.07 1.08 -0.44 1.46 4.39 -1.29 -1.43 114.58 118.41 1hky h GLU 39 Ca 0.04 -0.18 -0.09 0.00 0.34 0.00 0.00 59.36 59.46 1hky h GLU 39 Cb 0.61 -0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 29.06 1hky h GLU 39 CO 0.03 0.87 -0.10 1.25 -1.16 0.00 0.00 179.01 179.91 1hky h LEU 40 N 1.04 0.84 -1.44 1.33 6.46 -1.44 -2.85 115.31 119.24 1hky h LEU 40 Ca 0.24 -0.36 -0.04 0.00 -0.12 0.00 0.00 57.88 57.61 1hky h LEU 40 Cb 0.18 -0.23 -0.01 0.00 -0.73 0.00 0.00 40.66 39.87 1hky h LEU 40 CO -0.02 1.00 -0.01 0.00 -0.62 0.00 0.00 178.44 178.79 1hky h GLU 42 N 0.34 0.22 0.00 0.00 4.39 -1.03 -2.06 114.58 116.43 1hky h GLU 42 Ca 0.08 -0.06 -0.04 0.00 0.34 0.00 0.00 59.36 59.68 1hky h GLU 42 Cb 0.25 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 1hky h GLU 42 CO 0.01 0.42 -0.18 0.87 -1.16 0.00 0.00 179.01 178.97 1hky h LYS 43 N 0.20 0.00 0.00 2.33 1.79 -1.24 -3.44 116.57 116.22 1hky h LYS 43 Ca 0.04 0.00 -0.18 0.00 -2.18 0.00 0.00 60.65 58.33 1hky h LYS 43 Cb 0.48 0.00 0.06 0.00 -1.58 0.00 0.00 32.23 31.19 1hky h LYS 43 CO 0.03 0.18 0.15 -0.25 -1.08 0.00 0.00 179.45 178.48 1hky n ASP 44 N -3.45 0.15 -0.23 0.86 9.92 -0.78 -5.04 116.55 117.98 1hky n ASP 44 Ca -0.01 -1.26 0.00 0.00 -0.53 0.00 0.00 54.79 53.00 1hky n ASP 44 Cb 0.36 -0.39 0.00 0.00 -0.64 0.00 0.00 41.12 40.45 1hky n ASP 44 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1hky n ALA 45 N -3.27 1.47 -0.73 2.24 0.00 -1.26 -4.81 120.51 114.14 1hky n ALA 45 Ca -0.08 -0.64 0.00 0.00 0.00 0.00 0.00 53.44 52.72 1hky n ALA 45 Cb 0.24 -0.20 0.00 0.00 0.00 0.00 0.00 19.45 19.49 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 0.00 0.69 -3.09 0.00 5.02 -1.26 -5.03 118.16 114.50 1hky n LYS 46 Ca 0.00 -0.70 -0.43 0.00 -2.02 0.00 0.00 58.31 55.15 1hky n LYS 46 Cb 0.58 -0.63 -0.06 0.00 -0.02 0.00 0.00 35.03 34.90 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 6.39 0.77 -4.09 0.00 1.74 -1.20 -4.96 116.66 115.30 1hky n ARG 48 Ca -0.03 -0.01 -0.21 0.00 -0.77 0.00 0.00 57.85 56.84 1hky n ARG 48 Cb 0.47 -1.51 -0.07 0.00 -1.02 0.00 0.00 32.46 30.34 1hky n ARG 48 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1hky n PHE 49 N -2.74 -0.15 -3.54 -1.55 3.72 0.16 -4.89 117.46 108.47 1hky n PHE 49 Ca -0.32 -2.39 -0.14 0.00 -0.05 0.00 0.00 57.45 54.55 1hky n PHE 49 Cb 1.14 0.08 -0.05 0.00 -0.94 0.00 0.00 39.48 39.72 1hky n PHE 49 CO 0.00 0.00 0.00 -0.59 -0.05 0.00 0.00 176.76 176.12 1hky s PHE 50 N -3.02 -0.45 -0.28 1.38 -0.71 -1.23 -2.05 117.98 111.62 1hky s PHE 50 Ca 0.24 0.45 0.02 0.00 -1.04 0.00 0.00 56.93 56.60 1hky s PHE 50 Cb 0.01 0.38 0.16 0.00 -1.21 0.00 0.00 43.02 42.37 1hky s PHE 50 CO 0.17 -0.68 0.43 0.99 -1.34 0.00 0.00 175.22 174.78 1hky s THR 51 N -2.70 -0.68 0.43 -4.49 2.01 0.12 -2.15 115.64 108.19 1hky s THR 51 Ca -0.04 -0.23 -0.02 0.00 0.31 0.00 0.00 61.69 61.71 1hky s THR 51 Cb -0.00 -0.97 -0.03 0.00 0.01 0.00 0.00 72.50 71.51 1hky s THR 51 CO -0.04 -0.23 0.68 -0.22 -0.69 0.00 0.00 174.62 174.13 1hky s LEU 52 N 2.58 3.77 -0.24 4.42 2.96 0.04 -0.85 118.68 131.36 1hky s LEU 52 Ca 0.10 0.65 0.17 0.00 -0.22 0.00 0.00 54.13 54.84 1hky s LEU 52 Cb -0.13 -3.55 0.48 0.00 0.50 0.00 0.00 46.19 43.49 1hky s LEU 52 CO -0.28 -0.50 1.15 0.00 -1.32 0.00 0.00 176.35 175.41 1hky n ALA 53 N -2.06 3.44 -0.46 5.97 0.00 0.75 -0.90 120.51 127.25 1hky n ALA 53 Ca -0.01 -3.09 0.00 0.00 0.00 0.00 0.00 53.44 50.34 1hky n ALA 53 Cb 0.56 -0.64 0.00 0.00 0.00 0.00 0.00 19.45 19.37 1hky n ALA 53 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1hky n SER 54 N -0.55 0.00 0.00 0.00 2.88 -1.26 -4.04 113.62 110.66 1hky n SER 54 Ca 0.20 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.74 1hky n SER 54 Cb 0.89 -1.78 0.00 0.00 -0.75 0.00 0.00 64.21 62.57 1hky n SER 54 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1hky n GLY 55 N -2.00 0.82 3.13 0.46 0.00 -0.87 -4.18 105.19 102.54 1hky n GLY 55 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 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 0.35 0.26 1.61 2.20 -1.14 -2.86 119.74 120.16 1hky s LYS 56 Ca 0.00 0.85 -0.00 0.00 -0.36 0.00 0.00 55.97 56.45 1hky s LYS 56 Cb 0.00 0.04 -0.04 0.00 -1.51 0.00 0.00 37.83 36.32 1hky s LYS 56 CO 0.00 -0.43 0.45 0.00 -0.36 0.00 0.00 175.35 175.01 1hky s SER 58 N -3.51 -0.81 0.14 0.00 0.01 -0.03 -1.53 113.70 107.97 1hky s SER 58 Ca 0.39 0.84 -0.12 0.00 1.31 0.00 0.00 55.95 58.36 1hky s SER 58 Cb -0.10 1.84 -0.07 0.00 0.21 0.00 0.00 66.02 67.90 1hky s SER 58 CO 0.31 -0.26 0.51 -1.48 0.41 0.00 0.00 173.24 172.73 1hky s LEU 59 N 2.76 4.31 -0.07 2.44 0.05 -0.49 0.16 118.68 127.85 1hky s LEU 59 Ca 0.12 0.97 0.01 0.00 0.05 0.00 0.00 54.13 55.29 1hky s LEU 59 Cb -0.14 -3.27 0.02 0.00 -2.05 0.00 0.00 46.19 40.74 1hky s LEU 59 CO -0.18 0.09 -0.09 -0.36 -0.55 0.00 0.00 176.35 175.25 1hky s PHE 60 N -1.51 1.24 0.00 3.48 0.08 -0.87 -2.93 117.98 117.47 1hky s PHE 60 Ca 0.38 -0.46 0.00 0.00 0.12 0.00 0.00 56.93 56.97 1hky s PHE 60 Cb -0.14 -0.97 0.00 0.00 -0.57 0.00 0.00 43.02 41.34 1hky s PHE 60 CO 0.19 -0.29 0.07 0.00 -0.10 0.00 0.00 175.22 175.09 1hky n ALA 61 N 4.10 0.00 -3.06 5.36 0.00 -1.25 -0.66 120.51 125.00 1hky n ALA 61 Ca -0.21 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.09 1hky n ALA 61 Cb 0.51 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.92 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 -1.61 -0.16 0.02 0.00 2.15 -1.26 -4.33 116.67 111.49 1hky s ASP 62 Ca 0.00 -2.24 -0.05 0.00 0.43 0.00 0.00 52.55 50.69 1hky s ASP 62 Cb 0.00 0.89 -0.01 0.00 -0.30 0.00 0.00 42.92 43.50 1hky s ASP 62 CO 0.00 -0.11 0.09 -0.62 -0.17 0.00 0.00 175.17 174.36 1hky s ASP 63 N 0.61 0.13 -0.50 -0.34 -1.08 -1.26 -5.12 116.67 109.10 1hky s ASP 63 Ca 0.30 -0.40 -0.00 0.00 -0.52 0.00 0.00 52.55 51.93 1hky s ASP 63 Cb 0.01 0.20 0.13 0.00 -1.46 0.00 0.00 42.92 41.79 1hky s ASP 63 CO -0.11 -0.42 0.28 0.00 0.52 0.00 0.00 175.17 175.45 1hky s ALA 64 N -1.91 3.31 0.00 3.66 0.00 -1.26 -4.66 121.76 120.90 1hky s ALA 64 Ca -0.11 -2.96 0.00 0.00 0.00 0.00 0.00 51.96 48.89 1hky s ALA 64 Cb -0.05 -2.39 0.00 0.00 0.00 0.00 0.00 23.12 20.67 1hky s ALA 64 CO -0.01 -1.94 0.00 0.00 0.00 0.00 0.00 175.76 173.80 1hky n ALA 65 N 3.82 0.12 -2.58 0.00 0.00 -1.26 -5.07 120.51 115.53 1hky n ALA 65 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.07 1hky n ALA 65 Cb 0.38 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.76 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 4.22 0.31 0.00 2.34 -1.26 -3.09 118.68 121.20 1hky s LEU 66 Ca 0.00 0.24 0.10 0.00 0.06 0.00 0.00 54.13 54.53 1hky s LEU 66 Cb 0.00 -2.75 -0.06 0.00 -0.56 0.00 0.00 46.19 42.82 1hky s LEU 66 CO 0.00 -0.51 -0.13 -0.13 -1.06 0.00 0.00 176.35 174.52 1hky s ARG 67 N 2.58 1.73 1.12 1.48 0.52 -0.47 -4.86 118.95 121.05 1hky s ARG 67 Ca 0.23 -1.85 -0.16 0.00 -0.52 0.00 0.00 55.73 53.44 1hky s ARG 67 Cb -0.15 -1.65 0.25 0.00 0.52 0.00 0.00 34.95 33.92 1hky s ARG 67 CO 0.13 0.20 1.08 -1.25 0.02 0.00 0.00 175.30 175.48 1hky s PRO 68 N -3.59 -0.57 0.00 3.54 0.04 -1.26 -0.44 135.00 132.72 1hky s PRO 68 Ca 0.31 0.30 0.00 0.00 0.04 0.00 0.00 61.00 61.65 1hky s PRO 68 Cb -0.00 -1.64 0.00 0.00 0.04 0.00 0.00 34.50 32.90 1hky s PRO 68 CO 0.15 -3.35 0.00 -2.37 0.04 0.00 0.00 177.00 171.47 1hky n THR 69 N -4.57 0.00 -3.64 1.26 5.66 -0.96 -4.68 114.28 107.35 1hky n THR 69 Ca 0.08 0.00 -0.08 0.00 -3.05 0.00 0.00 64.05 61.00 1hky n THR 69 Cb 0.58 -0.11 -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 -1.50 0.66 -0.99 1.09 2.36 -1.26 -5.01 119.74 115.08 1hky s LYS 70 Ca 0.00 0.97 -0.03 0.00 -2.55 0.00 0.00 55.97 54.36 1hky s LYS 70 Cb 0.00 0.22 0.28 0.00 -1.05 0.00 0.00 37.83 37.28 1hky s LYS 70 CO 0.00 -0.11 1.19 -1.13 1.55 0.00 0.00 175.35 176.85 1hky n SER 71 N 3.45 5.51 -1.10 1.43 3.41 -1.26 -1.82 113.62 123.23 1hky n SER 71 Ca -0.17 -3.30 0.09 0.00 -0.26 0.00 0.00 58.87 55.23 1hky n SER 71 Cb 0.57 -1.17 0.26 0.00 -0.26 0.00 0.00 64.21 63.62 1hky n SER 71 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1hky n ASP 72 N 1.67 3.19 0.00 4.04 2.03 -1.26 -4.78 116.55 121.43 1hky n ASP 72 Ca 0.26 -2.01 0.00 0.00 0.52 0.00 0.00 54.79 53.55 1hky n ASP 72 Cb 0.36 -0.40 0.00 0.00 -0.72 0.00 0.00 41.12 40.36 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 1.43 1.15 3.78 0.27 0.00 -1.26 -5.04 105.19 105.52 1hky n GLY 73 Ca 0.20 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.89 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 -1.15 2.50 -0.09 4.61 0.00 -1.23 -4.06 121.76 122.33 1hky s ALA 74 Ca 0.00 0.51 -0.03 0.00 0.00 0.00 0.00 51.96 52.44 1hky s ALA 74 Cb 0.00 -3.30 0.04 0.00 0.00 0.00 0.00 23.12 19.86 1hky s ALA 74 CO 0.00 -1.24 0.07 0.08 0.00 0.00 0.00 175.76 174.67 1hky s VAL 75 N -2.39 -0.05 0.50 0.00 1.01 -0.07 -4.01 120.40 115.39 1hky s VAL 75 Ca 0.66 0.17 0.07 0.00 0.00 0.00 0.00 61.98 62.88 1hky s VAL 75 Cb -0.20 -0.35 0.02 0.00 0.00 0.00 0.00 36.38 35.85 1hky s VAL 75 CO 0.42 0.01 0.44 -0.94 0.00 0.00 0.00 175.10 175.02 1hky s SER 76 N 2.14 4.82 0.10 3.32 1.04 -0.67 -0.78 113.70 123.67 1hky s SER 76 Ca 0.04 -1.03 -0.27 0.00 0.48 0.00 0.00 55.95 55.18 1hky s SER 76 Cb -0.14 0.04 0.08 0.00 0.10 0.00 0.00 66.02 66.11 1hky s SER 76 CO -0.05 -0.97 1.05 -0.83 0.98 0.00 0.00 173.24 173.42 1hky s GLY 77 N -4.27 -0.28 0.00 7.32 0.00 -0.91 -0.64 107.32 108.54 1hky s GLY 77 Ca 0.43 0.29 0.00 0.00 0.00 0.00 0.00 44.72 45.44 1hky s GLY 77 CO 0.26 0.04 0.00 1.16 0.00 0.00 0.00 173.10 174.55 1hky n ASN 78 N -0.48 0.00 -2.91 1.64 0.23 -1.26 -3.50 115.26 108.98 1hky n ASN 78 Ca -0.07 0.00 -0.09 0.00 -0.53 0.00 0.00 54.58 53.90 1hky n ASN 78 Cb 0.61 0.00 0.01 0.00 -2.08 0.00 0.00 39.78 38.32 1hky n ASN 78 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 1hky n LYS 79 N 0.00 -2.54 -0.48 -3.83 5.02 -1.26 -4.87 118.16 110.20 1hky n LYS 79 Ca 0.00 2.16 0.00 0.00 -2.02 0.00 0.00 58.31 58.45 1hky n LYS 79 Cb 0.00 -4.82 0.00 0.00 -0.02 0.00 0.00 35.03 30.19 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 0.15 0.00 -2.57 1.97 1.74 -1.26 -4.91 116.66 111.78 1hky n ARG 80 Ca 0.05 -0.87 -0.30 0.00 -0.77 0.00 0.00 57.85 55.96 1hky n ARG 80 Cb 0.35 -0.44 -0.01 0.00 -1.02 0.00 0.00 32.46 31.34 1hky n ARG 80 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1hky h ILE 82 N 2.61 1.20 0.00 0.00 3.07 -1.91 -3.44 117.51 119.04 1hky h ILE 82 Ca 0.30 -2.25 0.00 0.00 1.55 0.00 0.00 64.86 64.46 1hky h ILE 82 Cb 0.63 2.30 0.00 0.00 -0.27 0.00 0.00 36.82 39.47 1hky h ILE 82 CO 0.94 0.59 0.00 0.18 -1.05 0.00 0.00 178.15 178.81 1hky n LEU 83 N -3.49 0.00 0.00 0.16 4.77 -1.26 -5.06 117.00 112.13 1hky n LEU 83 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1hky n LEU 83 Cb 0.68 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.77 1hky n LEU 83 CO 0.41 0.00 0.00 0.00 -1.33 0.00 0.00 177.39 176.47 1hky n LEU 84 N -0.67 0.00 -4.67 2.23 -0.00 -1.26 -5.13 117.00 107.50 1hky n LEU 84 Ca 0.00 0.00 -0.30 0.00 -0.00 0.00 0.00 56.01 55.71 1hky n LEU 84 Cb 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 43.42 43.34 1hky n LEU 84 CO 0.00 0.14 -0.34 -1.61 -0.00 0.00 0.00 177.39 175.58 1hky s GLU 85 N 0.00 2.53 0.00 1.47 2.02 -1.26 -5.10 118.70 118.36 1hky s GLU 85 Ca 0.00 -0.82 0.08 0.00 0.02 0.00 0.00 54.97 54.25 1hky s GLU 85 Cb 0.00 -2.53 0.07 0.00 0.10 0.00 0.00 34.13 31.77 1hky s GLU 85 CO 0.00 0.55 0.76 -0.25 0.02 0.00 0.00 175.26 176.34