#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ysh n VAL 11 N 0.00 0.75 0.29 7.28 0.24 -1.26 -3.48 118.33 122.15 1ysh n VAL 11 Ca 0.00 0.19 0.17 0.00 -2.04 0.00 0.00 64.34 62.66 1ysh n VAL 11 Cb 0.00 -1.00 0.96 0.00 -1.47 0.00 0.00 33.84 32.34 1ysh n VAL 11 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 1ysh h GLY 12 N 1.91 0.00 2.00 7.63 0.00 -1.95 -1.13 103.07 111.52 1ysh h GLY 12 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1ysh h GLY 12 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 176.54 176.61 1ysh h LYS 13 N 0.00 0.00 -0.01 4.80 2.10 -2.04 -2.68 116.57 118.75 1ysh h LYS 13 Ca 0.02 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.67 1ysh h LYS 13 Cb 0.12 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.45 1ysh h LYS 13 CO -0.00 0.00 -0.03 0.66 -2.00 0.00 0.00 179.45 178.08 1ysh n TYR 14 N -2.58 0.00 -3.55 0.07 0.53 -0.43 -5.03 117.16 106.18 1ysh n TYR 14 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.88 1ysh n TYR 14 Cb 0.19 -0.04 0.00 0.00 -1.03 0.00 0.00 39.34 38.46 1ysh n TYR 14 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1ysh n GLY 15 N 1.13 2.14 1.48 2.72 0.00 -1.01 -2.05 105.19 109.60 1ysh n GLY 15 Ca 0.20 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.82 1ysh n GLY 15 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ysh n THR 16 N 0.00 1.91 -3.86 2.61 -2.24 -1.26 -4.94 114.28 106.50 1ysh n THR 16 Ca 0.00 -0.97 -0.22 0.00 -2.27 0.00 0.00 64.05 60.59 1ysh n THR 16 Cb 0.00 -0.42 -0.02 0.00 -2.10 0.00 0.00 70.33 67.79 1ysh n THR 16 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1ysh s ARG 17 N -2.13 3.45 0.00 -0.78 3.00 -0.87 -4.65 118.95 116.97 1ysh s ARG 17 Ca 0.35 -0.65 0.00 0.00 0.00 0.00 0.00 55.73 55.44 1ysh s ARG 17 Cb 0.28 -2.86 0.00 0.00 0.00 0.00 0.00 34.95 32.37 1ysh s ARG 17 CO 0.10 0.39 0.00 0.66 0.00 0.00 0.00 175.30 176.45 1ysh n TYR 18 N -1.33 0.00 0.00 -0.53 4.02 -1.26 -4.91 117.16 113.15 1ysh n TYR 18 Ca -0.08 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.81 1ysh n TYR 18 Cb 0.56 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.88 1ysh n TYR 18 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1ysh n GLY 19 N -1.38 0.23 0.22 2.72 0.00 -1.26 -4.56 105.19 101.16 1ysh n GLY 19 Ca 0.00 -1.80 -0.08 0.00 0.00 0.00 0.00 46.02 44.14 1ysh n GLY 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ysh h ALA 20 N 0.00 -1.05 -0.29 4.61 0.00 -1.99 -3.03 119.26 117.52 1ysh h ALA 20 Ca 0.00 -0.10 0.06 0.00 0.00 0.00 0.00 54.91 54.87 1ysh h ALA 20 Cb 0.00 0.32 -0.06 0.00 0.00 0.00 0.00 17.79 18.04 1ysh h ALA 20 CO 0.00 -1.03 -0.13 0.77 0.00 0.00 0.00 179.25 178.86 1ysh h SER 21 N -0.50 -0.43 -0.22 0.00 0.02 -1.98 0.22 113.55 110.65 1ysh h SER 21 Ca -0.04 0.11 0.06 0.00 -0.84 0.00 0.00 61.79 61.07 1ysh h SER 21 Cb 0.40 0.24 -0.07 0.00 0.14 0.00 0.00 62.40 63.12 1ysh h SER 21 CO 0.04 -0.16 -0.24 0.25 -1.14 0.00 0.00 176.83 175.58 1ysh h LEU 22 N -0.08 -0.77 0.00 5.07 7.12 -1.80 -1.59 115.31 123.26 1ysh h LEU 22 Ca 0.15 0.13 -0.04 0.00 0.13 0.00 0.00 57.88 58.26 1ysh h LEU 22 Cb 0.31 0.36 -0.01 0.00 -0.53 0.00 0.00 40.66 40.79 1ysh h LEU 22 CO -0.34 -0.28 -0.59 0.08 -0.13 0.00 0.00 178.44 177.18 1ysh h ARG 23 N -0.26 0.00 -0.39 1.25 0.11 -1.33 -2.83 114.38 110.92 1ysh h ARG 23 Ca 0.13 0.00 -0.10 0.00 0.10 0.00 0.00 59.98 60.11 1ysh h ARG 23 Cb 0.46 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.52 1ysh h ARG 23 CO -0.37 0.11 -0.16 0.87 0.10 0.00 0.00 179.97 180.52 1ysh h LYS 24 N 0.00 0.74 -0.00 0.08 1.79 -0.26 -2.35 116.57 116.57 1ysh h LYS 24 Ca -0.02 -0.26 -0.17 0.00 -2.18 0.00 0.00 60.65 58.01 1ysh h LYS 24 Cb 1.13 -0.05 -0.02 0.00 -1.58 0.00 0.00 32.23 31.71 1ysh h LYS 24 CO 0.02 0.86 -0.80 -0.56 -1.08 0.00 0.00 179.45 177.88 1ysh h GLN 25 N 0.66 0.04 -0.48 3.15 3.07 -1.31 -1.52 115.11 118.72 1ysh h GLN 25 Ca 0.10 -0.04 -0.12 0.00 0.09 0.00 0.00 58.65 58.68 1ysh h GLN 25 Cb 0.65 0.01 -0.02 0.00 0.08 0.00 0.00 27.48 28.20 1ysh h GLN 25 CO 0.05 0.82 -0.17 0.82 0.09 0.00 0.00 178.83 180.44 1ysh h ILE 26 N 0.02 1.27 -0.20 1.86 1.08 -1.27 0.09 117.51 120.36 1ysh h ILE 26 Ca -0.01 -1.31 -0.09 0.00 -0.39 0.00 0.00 64.86 63.06 1ysh h ILE 26 Cb 1.41 1.07 -0.00 0.00 -3.07 0.00 0.00 36.82 36.23 1ysh h ILE 26 CO 0.11 0.45 -0.22 0.50 -0.69 0.00 0.00 178.15 178.30 1ysh h LYS 27 N 0.82 0.50 0.32 2.37 3.64 -1.36 -0.82 116.57 122.04 1ysh h LYS 27 Ca 0.12 -0.27 -0.01 0.00 -1.27 0.00 0.00 60.65 59.22 1ysh h LYS 27 Cb 0.72 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.54 1ysh h LYS 27 CO 0.05 0.85 -0.19 -0.22 -2.27 0.00 0.00 179.45 177.68 1ysh h LYS 28 N 0.17 -0.47 -0.02 1.90 3.11 -1.13 0.20 116.57 120.34 1ysh h LYS 28 Ca 0.03 0.03 0.00 0.00 -2.81 0.00 0.00 60.65 57.91 1ysh h LYS 28 Cb 0.77 0.11 -0.00 0.00 -1.00 0.00 0.00 32.23 32.10 1ysh h LYS 28 CO 0.05 -0.31 -0.00 0.52 -2.81 0.00 0.00 179.45 176.90 1ysh h MET 29 N -0.49 0.00 0.00 1.90 2.86 -1.01 -2.82 114.93 115.38 1ysh h MET 29 Ca -0.03 -0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.53 1ysh h MET 29 Cb 0.40 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.05 1ysh h MET 29 CO 0.04 0.00 -0.38 1.49 1.06 0.00 0.00 176.91 179.12 1ysh h GLU 30 N 0.00 0.00 -0.15 1.72 4.22 -1.05 -0.18 114.58 119.14 1ysh h GLU 30 Ca 0.01 0.00 -0.03 0.00 0.08 0.00 0.00 59.36 59.42 1ysh h GLU 30 Cb 0.01 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.26 1ysh h GLU 30 CO -0.02 0.38 -0.03 -0.24 -2.18 0.00 0.00 179.01 176.93 1ysh h VAL 31 N 0.00 1.28 -0.03 0.32 3.04 -0.45 0.64 116.25 121.05 1ysh h VAL 31 Ca -0.00 -0.95 0.00 0.00 -1.01 0.00 0.00 66.70 64.74 1ysh h VAL 31 Cb 0.72 1.60 -0.00 0.00 -2.01 0.00 0.00 31.29 31.59 1ysh h VAL 31 CO 0.05 0.28 0.02 0.28 -1.01 0.00 0.00 177.57 177.19 1ysh h SER 32 N 0.00 0.03 -0.74 3.17 0.02 -1.37 -1.70 113.55 112.96 1ysh h SER 32 Ca 0.04 -0.00 0.14 0.00 -0.84 0.00 0.00 61.79 61.13 1ysh h SER 32 Cb 0.44 -0.01 -0.14 0.00 0.14 0.00 0.00 62.40 62.84 1ysh h SER 32 CO 0.01 0.02 -0.27 -0.61 -1.14 0.00 0.00 176.83 174.85 1ysh h GLN 33 N 0.04 -0.06 -0.01 3.45 -0.00 -0.81 -0.58 115.11 117.14 1ysh h GLN 33 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.66 1ysh h GLN 33 Cb -0.00 0.01 0.00 0.00 0.00 0.00 0.00 27.48 27.49 1ysh h GLN 33 CO -0.00 -0.04 -0.06 1.58 0.00 0.00 0.00 178.83 180.31 1ysh n HIS 34 N -5.48 0.00 -0.81 3.99 -0.00 0.20 -4.78 115.22 108.34 1ysh n HIS 34 Ca 0.08 0.00 -0.31 0.00 0.46 0.00 0.00 57.72 57.95 1ysh n HIS 34 Cb 0.38 -0.06 0.15 0.00 -0.12 0.00 0.00 29.99 30.35 1ysh n HIS 34 CO 0.00 0.00 0.00 -1.12 0.46 0.00 0.00 176.34 175.68 1ysh s SER 35 N -2.17 3.24 0.17 0.26 0.01 -0.23 -4.93 113.70 110.04 1ysh s SER 35 Ca 0.36 2.12 -0.30 0.00 1.31 0.00 0.00 55.95 59.43 1ysh s SER 35 Cb 0.21 -2.56 -0.09 0.00 0.21 0.00 0.00 66.02 63.79 1ysh s SER 35 CO 0.40 -2.89 1.34 -0.54 0.41 0.00 0.00 173.24 171.96 1ysh s LYS 36 N -4.70 4.36 -0.02 12.44 -0.14 -1.26 -4.97 119.74 125.44 1ysh s LYS 36 Ca 0.66 2.08 0.08 0.00 -1.36 0.00 0.00 55.97 57.42 1ysh s LYS 36 Cb -0.22 -3.21 -0.02 0.00 -1.68 0.00 0.00 37.83 32.71 1ysh s LYS 36 CO 0.58 -0.33 -0.26 0.71 -0.76 0.00 0.00 175.35 175.29 1ysh s TYR 37 N 0.44 2.34 -0.40 3.18 1.51 -1.25 -5.00 117.35 118.17 1ysh s TYR 37 Ca 0.59 -0.44 -0.25 0.00 -1.01 0.00 0.00 57.07 55.97 1ysh s TYR 37 Cb -0.37 -1.50 0.02 0.00 -0.11 0.00 0.00 41.96 39.99 1ysh s TYR 37 CO 0.36 -0.04 0.88 -0.59 -1.11 0.00 0.00 175.55 175.05 1ysh s PHE 38 N -0.61 3.04 0.32 2.71 -0.12 -1.26 -2.02 117.98 120.04 1ysh s PHE 38 Ca 0.10 0.57 -0.29 0.00 -0.05 0.00 0.00 56.93 57.26 1ysh s PHE 38 Cb -0.10 -3.68 -0.13 0.00 -0.63 0.00 0.00 43.02 38.49 1ysh s PHE 38 CO -0.01 -0.89 1.31 0.00 -0.05 0.00 0.00 175.22 175.58 1ysh h GLU 40 N 2.88 0.81 0.00 0.00 4.39 -1.95 -3.36 114.58 117.36 1ysh h GLU 40 Ca -0.46 -0.59 0.00 0.00 0.34 0.00 0.00 59.36 58.65 1ysh h GLU 40 Cb 1.28 0.10 0.00 0.00 -0.10 0.00 0.00 28.75 30.03 1ysh h GLU 40 CO 0.65 1.21 0.00 0.34 -1.16 0.00 0.00 179.01 180.05 1ysh n PHE 41 N -3.96 0.00 -0.27 4.33 7.35 -1.26 -4.83 117.46 118.82 1ysh n PHE 41 Ca -0.06 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.63 1ysh n PHE 41 Cb 0.69 -0.27 0.00 0.00 0.35 0.00 0.00 39.48 40.25 1ysh n PHE 41 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1ysh n GLY 43 N 5.00 0.72 3.78 0.00 0.00 -1.26 -4.56 105.19 108.88 1ysh n GLY 43 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 1ysh n GLY 43 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ysh s LYS 44 N -0.49 3.81 -1.40 1.61 1.02 -1.26 -4.44 119.74 118.59 1ysh s LYS 44 Ca 0.00 1.64 -0.09 0.00 0.02 0.00 0.00 55.97 57.53 1ysh s LYS 44 Cb 0.00 -2.35 0.07 0.00 -0.52 0.00 0.00 37.83 35.04 1ysh s LYS 44 CO 0.00 -0.48 2.32 1.19 -0.92 0.00 0.00 175.35 177.47 1ysh n PHE 45 N -0.56 2.84 -2.40 3.18 3.01 -1.26 -0.67 117.46 121.61 1ysh n PHE 45 Ca 0.08 -2.90 -0.04 0.00 1.01 0.00 0.00 57.45 55.60 1ysh n PHE 45 Cb 0.49 -2.15 0.06 0.00 -0.01 0.00 0.00 39.48 37.87 1ysh n PHE 45 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1ysh n ALA 46 N 3.63 3.22 -2.68 4.37 0.00 -0.95 -4.41 120.51 123.70 1ysh n ALA 46 Ca 0.57 -2.96 -0.37 0.00 0.00 0.00 0.00 53.44 50.67 1ysh n ALA 46 Cb 0.31 -0.65 -0.08 0.00 0.00 0.00 0.00 19.45 19.03 1ysh n ALA 46 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1ysh s VAL 47 N -2.96 5.27 0.08 0.00 1.01 -0.86 -1.22 120.40 121.71 1ysh s VAL 47 Ca 0.36 0.52 0.07 0.00 0.00 0.00 0.00 61.98 62.92 1ysh s VAL 47 Cb 0.36 -3.64 -0.03 0.00 0.00 0.00 0.00 36.38 33.07 1ysh s VAL 47 CO -0.06 0.30 -0.18 -0.75 0.00 0.00 0.00 175.10 174.41 1ysh s LYS 48 N 1.11 1.06 0.20 2.72 2.47 0.48 -3.80 119.74 123.97 1ysh s LYS 48 Ca 0.15 -1.04 -0.30 0.00 -1.56 0.00 0.00 55.97 53.22 1ysh s LYS 48 Cb -0.14 -1.21 -0.09 0.00 -1.46 0.00 0.00 37.83 34.93 1ysh s LYS 48 CO 0.06 0.28 1.31 0.50 0.16 0.00 0.00 175.35 177.67 1ysh s ARG 49 N -1.69 4.38 -0.02 4.03 3.52 -1.26 -1.11 118.95 126.80 1ysh s ARG 49 Ca 0.04 2.06 0.18 0.00 -0.13 0.00 0.00 55.73 57.87 1ysh s ARG 49 Cb -0.10 -3.20 -0.26 0.00 -1.56 0.00 0.00 34.95 29.84 1ysh s ARG 49 CO 0.03 -0.26 0.45 1.63 -0.81 0.00 0.00 175.30 176.34 1ysh n LYS 50 N 2.68 0.67 0.00 5.12 4.76 0.16 -4.90 118.16 126.65 1ysh n LYS 50 Ca 0.06 -0.13 0.00 0.00 -2.87 0.00 0.00 58.31 55.37 1ysh n LYS 50 Cb 0.43 -1.40 0.00 0.00 -1.84 0.00 0.00 35.03 32.21 1ysh n LYS 50 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1ysh n ALA 51 N -1.99 0.00 -1.65 7.82 0.00 -1.16 -4.98 120.51 118.55 1ysh n ALA 51 Ca -0.02 0.00 -0.48 0.00 0.00 0.00 0.00 53.44 52.93 1ysh n ALA 51 Cb 0.43 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.83 1ysh n ALA 51 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1ysh n VAL 52 N -0.05 0.10 0.00 0.00 0.24 -1.26 -1.63 118.33 115.73 1ysh n VAL 52 Ca 0.00 -0.02 0.00 0.00 -2.04 0.00 0.00 64.34 62.28 1ysh n VAL 52 Cb 0.00 -1.38 0.00 0.00 -1.47 0.00 0.00 33.84 30.99 1ysh n VAL 52 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1ysh n GLY 53 N 3.37 2.79 3.57 7.63 0.00 -0.79 -4.85 105.19 116.91 1ysh n GLY 53 Ca 0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.85 1ysh n GLY 53 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ysh s ILE 54 N -2.35 4.85 0.08 -0.61 -1.09 -0.64 -1.38 121.20 120.06 1ysh s ILE 54 Ca 0.00 0.00 0.08 0.00 -2.23 0.00 0.00 60.65 58.50 1ysh s ILE 54 Cb 0.00 -3.25 -0.03 0.00 -1.58 0.00 0.00 42.46 37.60 1ysh s ILE 54 CO 0.00 0.36 -0.21 0.26 -1.23 0.00 0.00 174.94 174.12 1ysh s TRP 55 N 1.13 1.86 -0.03 3.97 0.52 -0.26 0.37 118.94 126.49 1ysh s TRP 55 Ca 0.06 -0.40 -0.08 0.00 0.02 0.00 0.00 56.10 55.69 1ysh s TRP 55 Cb -0.14 -1.05 0.01 0.00 -1.15 0.00 0.00 33.47 31.14 1ysh s TRP 55 CO 0.04 0.17 0.19 0.20 0.02 0.00 0.00 176.95 177.57 1ysh s GLY 56 N -1.63 -0.07 -0.24 0.98 0.00 -0.27 0.70 107.32 106.79 1ysh s GLY 56 Ca 0.08 0.24 -0.12 0.00 0.00 0.00 0.00 44.72 44.91 1ysh s GLY 56 CO 0.03 0.11 0.24 0.00 0.00 0.00 0.00 173.10 173.49 1ysh n LYS 58 N 4.48 0.16 -0.04 0.00 2.85 -0.36 0.33 118.16 125.58 1ysh n LYS 58 Ca -0.13 0.32 -0.00 0.00 -1.05 0.00 0.00 58.31 57.45 1ysh n LYS 58 Cb 0.52 -1.77 -0.00 0.00 -0.65 0.00 0.00 35.03 33.13 1ysh n LYS 58 CO 0.00 0.00 0.00 0.38 -0.05 0.00 0.00 177.40 177.73 1ysh h ASP 59 N 0.00 -0.01 -0.00 -5.58 2.03 -1.93 -3.41 116.42 107.52 1ysh h ASP 59 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1ysh h ASP 59 Cb 0.44 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.94 1ysh h ASP 59 CO 0.00 0.46 -0.61 0.00 -1.03 0.00 0.00 179.24 178.05 1ysh n GLY 61 N 1.30 1.19 3.71 0.00 0.00 0.15 -5.01 105.19 106.53 1ysh n GLY 61 Ca 0.03 0.00 -0.57 0.00 0.00 0.00 0.00 46.02 45.48 1ysh n GLY 61 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1ysh n LYS 62 N -2.00 1.23 -3.70 1.61 0.00 -1.25 -4.47 118.16 109.57 1ysh n LYS 62 Ca 0.00 0.45 -0.38 0.00 -0.00 0.00 0.00 58.31 58.38 1ysh n LYS 62 Cb 0.00 -2.15 -0.12 0.00 -0.00 0.00 0.00 35.03 32.76 1ysh n LYS 62 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 1ysh s VAL 63 N 3.62 4.38 0.28 0.58 0.11 -1.26 -1.29 120.40 126.82 1ysh s VAL 63 Ca 0.98 -0.47 0.10 0.00 -2.93 0.00 0.00 61.98 59.66 1ysh s VAL 63 Cb -1.05 -3.22 -0.05 0.00 -1.53 0.00 0.00 36.38 30.54 1ysh s VAL 63 CO 0.65 0.10 -0.06 -0.54 -3.33 0.00 0.00 175.10 171.92 1ysh s LYS 64 N 1.58 2.08 -0.14 1.54 3.01 0.22 -4.96 119.74 123.07 1ysh s LYS 64 Ca 0.04 -1.56 -0.13 0.00 -1.01 0.00 0.00 55.97 53.31 1ysh s LYS 64 Cb -0.17 -2.02 -0.05 0.00 -1.01 0.00 0.00 37.83 34.59 1ysh s LYS 64 CO 0.05 0.33 0.29 0.00 0.51 0.00 0.00 175.35 176.53 1ysh s ALA 65 N -2.40 3.62 0.00 5.17 0.00 -1.26 -1.11 121.76 125.78 1ysh s ALA 65 Ca 0.31 -0.45 0.00 0.00 0.00 0.00 0.00 51.96 51.83 1ysh s ALA 65 Cb -0.05 -2.36 0.00 0.00 0.00 0.00 0.00 23.12 20.71 1ysh s ALA 65 CO 0.18 0.17 0.00 0.41 0.00 0.00 0.00 175.76 176.52 1ysh n GLY 66 N 3.13 4.46 2.94 0.00 0.00 -0.48 -4.95 105.19 110.30 1ysh n GLY 66 Ca -0.13 -1.07 -0.23 0.00 0.00 0.00 0.00 46.02 44.59 1ysh n GLY 66 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ysh n GLY 67 N 0.00 -1.77 0.17 -0.02 0.00 0.16 -4.65 105.19 99.07 1ysh n GLY 67 Ca 0.00 -1.64 -0.19 0.00 0.00 0.00 0.00 46.02 44.19 1ysh n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ysh h ALA 68 N -2.04 0.12 0.00 4.61 0.00 -1.89 -2.11 119.26 117.95 1ysh h ALA 68 Ca -0.33 -0.75 0.00 0.00 0.00 0.00 0.00 54.91 53.83 1ysh h ALA 68 Cb 0.94 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1ysh h ALA 68 CO 0.23 0.74 0.00 2.48 0.00 0.00 0.00 179.25 182.70 1ysh n TYR 69 N -3.77 0.00 -3.84 0.00 0.18 -1.26 -2.06 117.16 106.41 1ysh n TYR 69 Ca -0.11 -0.21 -0.12 0.00 1.88 0.00 0.00 57.90 59.34 1ysh n TYR 69 Cb 0.93 -0.02 -0.12 0.00 -0.38 0.00 0.00 39.34 39.75 1ysh n TYR 69 CO 0.00 0.00 0.00 0.95 -2.08 0.00 0.00 176.86 175.73 1ysh s THR 70 N -0.43 0.03 0.35 -3.48 -4.23 -1.26 -3.69 115.64 102.94 1ysh s THR 70 Ca 0.00 -0.25 0.11 0.00 -1.18 0.00 0.00 61.69 60.37 1ysh s THR 70 Cb 0.00 -0.29 0.08 0.00 1.34 0.00 0.00 72.50 73.63 1ysh s THR 70 CO 0.00 -0.14 1.80 -0.03 -0.54 0.00 0.00 174.62 175.71 1ysh h MET 71 N 5.33 0.07 -5.58 3.99 4.05 -1.94 0.46 114.93 121.31 1ysh h MET 71 Ca -0.27 -0.03 -0.60 0.00 -0.28 0.00 0.00 59.70 58.52 1ysh h MET 71 Cb 1.20 -0.00 -0.31 0.00 -0.80 0.00 0.00 31.60 31.68 1ysh h MET 71 CO 0.41 0.43 -0.85 0.54 0.23 0.00 0.00 176.91 177.67 1ysh s ASN 72 N -6.92 2.45 0.28 1.39 6.03 -1.26 -3.09 114.94 113.83 1ysh s ASN 72 Ca -0.03 -0.40 0.08 0.00 -1.03 0.00 0.00 52.86 51.47 1ysh s ASN 72 Cb 0.14 -0.64 -0.04 0.00 -3.03 0.00 0.00 41.25 37.69 1ysh s ASN 72 CO 0.74 0.19 0.16 0.42 -2.03 0.00 0.00 177.10 176.58 1ysh s THR 73 N -0.07 3.83 0.57 0.54 -4.23 -1.26 -4.80 115.64 110.21 1ysh s THR 73 Ca -0.03 -1.56 0.25 0.00 -1.18 0.00 0.00 61.69 59.18 1ysh s THR 73 Cb -0.12 -3.17 0.34 0.00 1.34 0.00 0.00 72.50 70.89 1ysh s THR 73 CO 0.02 -0.30 2.15 0.00 -0.54 0.00 0.00 174.62 175.96 1ysh h ALA 74 N 1.54 1.84 0.10 3.99 0.00 -2.00 -2.18 119.26 122.55 1ysh h ALA 74 Ca -0.46 -0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.14 1ysh h ALA 74 Cb 1.25 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 1ysh h ALA 74 CO 0.61 -0.17 -1.57 0.77 0.00 0.00 0.00 179.25 178.89 1ysh h SER 75 N 0.00 0.32 0.44 0.00 0.02 -2.00 -3.22 113.55 109.10 1ysh h SER 75 Ca 0.05 -0.48 -0.03 0.00 -0.84 0.00 0.00 61.79 60.50 1ysh h SER 75 Cb 0.27 -0.10 -0.00 0.00 0.14 0.00 0.00 62.40 62.70 1ysh h SER 75 CO -0.00 1.40 -0.14 0.00 -1.14 0.00 0.00 176.83 176.95 1ysh h ALA 76 N 0.55 1.26 -0.01 3.77 0.00 -1.79 -2.30 119.26 120.73 1ysh h ALA 76 Ca -0.25 -0.13 -0.24 0.00 0.00 0.00 0.00 54.91 54.28 1ysh h ALA 76 Cb 2.00 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 19.78 1ysh h ALA 76 CO 0.14 0.18 -0.97 0.28 0.00 0.00 0.00 179.25 178.88 1ysh h VAL 77 N 0.00 1.34 -0.01 0.00 2.07 -1.54 -3.23 116.25 114.88 1ysh h VAL 77 Ca -0.00 -2.33 -0.02 0.00 0.82 0.00 0.00 66.70 65.17 1ysh h VAL 77 Cb 0.40 2.37 -0.00 0.00 -1.52 0.00 0.00 31.29 32.54 1ysh h VAL 77 CO 0.02 0.71 -0.10 0.74 0.02 0.00 0.00 177.57 178.96 1ysh h THR 78 N 0.32 1.08 0.14 2.57 2.02 -1.42 -2.80 112.91 114.81 1ysh h THR 78 Ca -0.10 -0.36 0.00 0.00 0.77 0.00 0.00 66.41 66.72 1ysh h THR 78 Cb 1.61 1.18 -0.01 0.00 -1.74 0.00 0.00 68.15 69.19 1ysh h THR 78 CO 0.18 0.10 -0.11 -0.37 0.37 0.00 0.00 175.52 175.69 1ysh h VAL 79 N 0.02 0.75 -0.78 3.16 -1.51 -1.53 -2.66 116.25 113.69 1ysh h VAL 79 Ca 0.00 0.00 0.18 0.00 -1.23 0.00 0.00 66.70 65.65 1ysh h VAL 79 Cb 0.18 0.75 -0.12 0.00 -2.13 0.00 0.00 31.29 29.97 1ysh h VAL 79 CO 0.01 0.00 0.20 0.03 -1.23 0.00 0.00 177.57 176.58 1ysh h ARG 80 N -0.26 0.26 0.00 5.19 3.08 -1.60 -3.04 114.38 118.01 1ysh h ARG 80 Ca -0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1ysh h ARG 80 Cb 0.24 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.23 1ysh h ARG 80 CO -0.02 0.17 0.00 0.43 -1.07 0.00 0.00 179.97 179.48 1ysh n SER 81 N -5.17 0.00 0.00 7.04 7.64 -1.11 -5.17 113.62 116.85 1ysh n SER 81 Ca 0.16 0.32 0.00 0.00 1.01 0.00 0.00 58.87 60.37 1ysh n SER 81 Cb 0.52 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.72 1ysh n SER 81 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38