#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y3f s LYS 21 N nan 3.84 0.00 0.00 2.47 -1.26 -4.86 119.74 nan 1y3f s LYS 21 Ca nan 0.74 0.00 0.00 -1.56 0.00 0.00 55.97 nan 1y3f s LYS 21 Cb nan -3.85 0.00 0.00 -1.46 0.00 0.00 37.83 nan 1y3f s LYS 21 CO nan -1.22 0.55 0.25 0.16 0.00 0.00 175.35 nan 1y3f n THR 22 N 6.51 0.25 -3.87 3.43 -2.24 -1.26 -4.99 114.28 112.12 1y3f n THR 22 Ca 0.12 -0.51 -0.11 0.00 -2.27 0.00 0.00 64.05 61.28 1y3f n THR 22 Cb 0.48 1.03 -0.10 0.00 -2.10 0.00 0.00 70.33 69.64 1y3f n THR 22 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1y3f s GLU 23 N -0.25 0.48 -0.49 -0.78 2.02 -1.26 -1.14 118.70 117.28 1y3f s GLU 23 Ca 0.00 -0.39 0.08 0.00 0.02 0.00 0.00 54.97 54.68 1y3f s GLU 23 Cb 0.00 0.20 0.31 0.00 0.10 0.00 0.00 34.13 34.74 1y3f s GLU 23 CO 0.00 -0.11 0.76 0.91 0.02 0.00 0.00 175.26 176.84 1y3f n TRP 24 N 1.47 1.96 0.30 1.61 8.01 -0.21 -4.93 117.44 125.64 1y3f n TRP 24 Ca -0.23 -3.89 0.16 0.00 -1.31 0.00 0.00 57.50 52.23 1y3f n TRP 24 Cb 0.56 -0.46 0.93 0.00 -2.01 0.00 0.00 31.31 30.33 1y3f n TRP 24 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.69 175.68 1y3f h PRO 25 N 3.40 0.00 0.00 -0.99 0.13 -1.94 -0.89 132.00 131.71 1y3f h PRO 25 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1y3f h PRO 25 Cb 0.75 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.88 1y3f h PRO 25 CO 0.66 0.01 0.00 -0.85 -0.23 0.00 0.00 178.00 177.58 1y3f n GLU 26 N -3.77 0.10 0.00 0.86 0.00 -1.26 -2.66 120.64 113.91 1y3f n GLU 26 Ca -0.03 0.32 0.13 0.00 0.00 0.00 0.00 57.16 57.57 1y3f n GLU 26 Cb 0.09 -1.68 0.36 0.00 0.00 0.00 0.00 31.44 30.21 1y3f n GLU 26 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 1y3f n LEU 27 N -1.86 0.38 -4.73 -1.84 4.77 -0.34 -4.82 117.00 108.56 1y3f n LEU 27 Ca 0.03 0.13 -0.42 0.00 -0.03 0.00 0.00 56.01 55.72 1y3f n LEU 27 Cb 0.21 -0.31 -0.02 0.00 -2.33 0.00 0.00 43.42 40.96 1y3f n LEU 27 CO 0.17 0.09 1.23 -0.69 -1.33 0.00 0.00 177.39 176.86 1y3f s VAL 28 N -2.98 2.39 0.00 4.08 1.01 -1.09 -1.38 120.40 122.43 1y3f s VAL 28 Ca 0.13 0.30 0.00 0.00 0.00 0.00 0.00 61.98 62.41 1y3f s VAL 28 Cb 0.18 -3.19 0.00 0.00 0.00 0.00 0.00 36.38 33.37 1y3f s VAL 28 CO 0.64 0.04 0.00 0.61 0.00 0.00 0.00 175.10 176.39 1y3f n GLY 29 N 3.01 1.68 3.90 4.51 0.00 0.10 -4.96 105.19 113.43 1y3f n GLY 29 Ca 0.11 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.85 1y3f n GLY 29 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1y3f s LYS 30 N -0.28 3.11 0.65 1.61 -0.14 -0.48 -4.71 119.74 119.50 1y3f s LYS 30 Ca 0.00 0.25 -0.17 0.00 -1.36 0.00 0.00 55.97 54.69 1y3f s LYS 30 Cb 0.00 -2.20 -0.01 0.00 -1.68 0.00 0.00 37.83 33.94 1y3f s LYS 30 CO 0.00 -0.67 1.23 -1.54 -0.76 0.00 0.00 175.35 173.61 1y3f s SER 31 N -4.26 4.72 0.40 2.83 1.04 -1.26 0.13 113.70 117.30 1y3f s SER 31 Ca 0.54 2.45 0.08 0.00 0.48 0.00 0.00 55.95 59.50 1y3f s SER 31 Cb -0.11 -2.60 0.87 0.00 0.10 0.00 0.00 66.02 64.28 1y3f s SER 31 CO 0.48 -1.91 2.01 1.62 0.98 0.00 0.00 173.24 176.42 1y3f h VAL 32 N 0.43 1.03 -0.20 5.02 3.04 -1.60 -1.62 116.25 122.36 1y3f h VAL 32 Ca -0.50 -0.20 -0.01 0.00 -1.01 0.00 0.00 66.70 64.98 1y3f h VAL 32 Cb 1.31 0.41 -0.01 0.00 -2.01 0.00 0.00 31.29 30.99 1y3f h VAL 32 CO 0.53 0.11 0.08 -0.33 -1.01 0.00 0.00 177.57 176.94 1y3f h GLU 33 N 0.58 0.29 -0.59 4.17 3.07 -1.92 -1.46 114.58 118.72 1y3f h GLU 33 Ca 0.22 -0.05 -0.10 0.00 -0.50 0.00 0.00 59.36 58.93 1y3f h GLU 33 Cb 0.17 -0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 28.01 1y3f h GLU 33 CO -0.06 0.35 -0.01 1.49 -1.40 0.00 0.00 179.01 179.38 1y3f h GLU 34 N 0.17 1.05 -0.55 2.33 4.81 -1.85 -2.13 114.58 118.40 1y3f h GLU 34 Ca 0.07 -0.34 0.02 0.00 -0.13 0.00 0.00 59.36 58.97 1y3f h GLU 34 Cb 0.17 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.43 1y3f h GLU 34 CO -0.01 1.04 0.35 0.00 -0.73 0.00 0.00 179.01 179.66 1y3f h ALA 35 N 0.97 0.71 -0.70 2.92 0.00 -1.16 -0.30 119.26 121.69 1y3f h ALA 35 Ca 0.17 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 1y3f h ALA 35 Cb 0.57 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 1y3f h ALA 35 CO 0.03 0.09 0.37 0.87 0.00 0.00 0.00 179.25 180.61 1y3f h LYS 36 N 0.69 0.99 -0.31 0.00 1.57 -1.09 -0.78 116.57 117.65 1y3f h LYS 36 Ca 0.22 -0.12 -0.01 0.00 -1.87 0.00 0.00 60.65 58.86 1y3f h LYS 36 Cb -0.02 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.09 1y3f h LYS 36 CO -0.08 0.75 0.13 -0.22 -0.57 0.00 0.00 179.45 179.47 1y3f h LYS 37 N 0.97 0.45 -0.24 3.15 3.64 -0.69 -1.02 116.57 122.84 1y3f h LYS 37 Ca 0.25 -0.07 -0.03 0.00 -1.27 0.00 0.00 60.65 59.52 1y3f h LYS 37 Cb 0.06 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.80 1y3f h LYS 37 CO -0.04 0.44 0.02 0.28 -2.27 0.00 0.00 179.45 177.88 1y3f h VAL 38 N 0.35 1.24 -0.76 2.00 2.07 -0.92 -2.00 116.25 118.24 1y3f h VAL 38 Ca 0.10 -0.84 -0.03 0.00 0.82 0.00 0.00 66.70 66.75 1y3f h VAL 38 Cb 0.15 1.33 -0.03 0.00 -1.52 0.00 0.00 31.29 31.22 1y3f h VAL 38 CO -0.01 0.26 0.34 0.40 0.02 0.00 0.00 177.57 178.58 1y3f h ILE 39 N 0.20 1.24 0.00 4.57 2.04 -1.05 -2.03 117.51 122.49 1y3f h ILE 39 Ca 0.07 -0.72 -0.03 0.00 1.00 0.00 0.00 64.86 65.18 1y3f h ILE 39 Cb 0.37 0.30 -0.00 0.00 -0.74 0.00 0.00 36.82 36.75 1y3f h ILE 39 CO 0.01 0.30 -0.13 -0.07 0.00 0.00 0.00 178.15 178.26 1y3f h LEU 40 N 1.09 0.00 -0.45 1.44 3.38 -1.03 0.24 115.31 119.98 1y3f h LEU 40 Ca 0.26 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.13 1y3f h LEU 40 Cb 0.15 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1y3f h LEU 40 CO -0.03 0.13 -0.12 1.56 0.09 0.00 0.00 178.44 180.07 1y3f h GLN 41 N 0.00 0.88 0.01 1.13 4.20 -0.69 -2.69 115.11 117.95 1y3f h GLN 41 Ca -0.00 -0.34 -0.20 0.00 0.06 0.00 0.00 58.65 58.16 1y3f h GLN 41 Cb 0.65 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.36 1y3f h GLN 41 CO 0.02 0.99 -0.96 -0.44 -0.67 0.00 0.00 178.83 177.76 1y3f h ASP 42 N 0.71 0.03 -1.89 1.46 3.32 -0.84 -3.40 116.42 115.81 1y3f h ASP 42 Ca 0.11 -0.03 -0.50 0.00 0.02 0.00 0.00 57.03 56.64 1y3f h ASP 42 Cb 0.67 -0.01 -0.34 0.00 0.22 0.00 0.00 39.33 39.88 1y3f h ASP 42 CO 0.05 0.97 -0.92 1.17 -1.72 0.00 0.00 179.24 178.79 1y3f n LYS 43 N -3.43 0.44 0.30 3.56 4.81 0.79 -4.97 118.16 119.65 1y3f n LYS 43 Ca -0.01 -2.93 0.17 0.00 -0.87 0.00 0.00 58.31 54.67 1y3f n LYS 43 Cb 0.90 -1.49 0.92 0.00 0.02 0.00 0.00 35.03 35.38 1y3f n LYS 43 CO 0.00 0.00 0.00 -1.35 1.17 0.00 0.00 177.40 177.22 1y3f h PRO 44 N 4.91 0.00 -0.24 1.64 0.11 -1.68 -0.62 132.00 136.12 1y3f h PRO 44 Ca 0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.26 1y3f h PRO 44 Cb 0.94 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.05 1y3f h PRO 44 CO 0.35 0.04 0.00 0.00 -0.21 0.00 0.00 178.00 178.18 1y3f n ALA 45 N -2.23 2.49 -1.74 -0.75 0.00 -1.26 -4.97 120.51 112.05 1y3f n ALA 45 Ca -0.02 -0.54 -0.42 0.00 0.00 0.00 0.00 53.44 52.46 1y3f n ALA 45 Cb 0.15 -1.04 -0.00 0.00 0.00 0.00 0.00 19.45 18.55 1y3f n ALA 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1y3f n ALA 46 N 0.36 1.98 -2.89 0.00 0.00 -0.24 -4.95 120.51 114.77 1y3f n ALA 46 Ca 0.14 0.35 -0.44 0.00 0.00 0.00 0.00 53.44 53.49 1y3f n ALA 46 Cb 0.30 -2.36 -0.07 0.00 0.00 0.00 0.00 19.45 17.32 1y3f n ALA 46 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1y3f s GLN 47 N -1.87 2.99 -0.20 0.00 -0.21 0.10 -4.95 119.66 115.53 1y3f s GLN 47 Ca 0.55 -1.33 -0.13 0.00 0.02 0.00 0.00 55.36 54.47 1y3f s GLN 47 Cb -0.51 -4.14 -0.05 0.00 1.00 0.00 0.00 33.01 29.31 1y3f s GLN 47 CO 0.62 -1.07 0.25 0.42 -2.12 0.00 0.00 175.29 173.39 1y3f s ILE 48 N 1.74 5.31 -0.10 1.08 1.01 -1.26 -1.47 121.20 127.51 1y3f s ILE 48 Ca 0.05 0.42 0.03 0.00 0.00 0.00 0.00 60.65 61.15 1y3f s ILE 48 Cb -0.24 -3.59 0.00 0.00 0.01 0.00 0.00 42.46 38.64 1y3f s ILE 48 CO 0.07 0.35 -0.22 -0.63 0.00 0.00 0.00 174.94 174.51 1y3f s ILE 49 N 0.86 1.91 -0.20 2.92 1.09 -1.03 -5.00 121.20 121.76 1y3f s ILE 49 Ca 0.13 -0.92 -0.12 0.00 -1.10 0.00 0.00 60.65 58.64 1y3f s ILE 49 Cb -0.13 -1.67 -0.05 0.00 -1.06 0.00 0.00 42.46 39.55 1y3f s ILE 49 CO 0.04 0.53 0.20 -0.69 -0.10 0.00 0.00 174.94 174.92 1y3f s VAL 50 N 0.50 5.35 0.07 2.92 1.01 -1.26 -0.07 120.40 128.93 1y3f s VAL 50 Ca -0.16 0.33 0.03 0.00 0.00 0.00 0.00 61.98 62.19 1y3f s VAL 50 Cb -0.17 -3.54 -0.03 0.00 0.00 0.00 0.00 36.38 32.63 1y3f s VAL 50 CO 0.06 0.39 -0.09 -0.76 0.00 0.00 0.00 175.10 174.70 1y3f s LEU 51 N 0.60 2.36 0.43 3.92 1.43 0.23 -4.95 118.68 122.70 1y3f s LEU 51 Ca 0.11 -0.73 -0.25 0.00 -1.03 0.00 0.00 54.13 52.23 1y3f s LEU 51 Cb -0.12 -0.22 -0.08 0.00 0.03 0.00 0.00 46.19 45.79 1y3f s LEU 51 CO 0.02 -0.26 1.29 -2.84 0.23 0.00 0.00 176.35 174.78 1y3f s PRO 52 N -2.45 3.86 0.63 1.29 0.02 -1.26 -1.02 135.00 136.08 1y3f s PRO 52 Ca 0.00 2.11 -0.18 0.00 0.02 0.00 0.00 61.00 62.95 1y3f s PRO 52 Cb -0.05 -2.66 -0.02 0.00 0.02 0.00 0.00 34.50 31.79 1y3f s PRO 52 CO -0.01 -0.57 1.28 0.54 -0.33 0.00 0.00 177.00 177.92 1y3f s VAL 53 N -1.30 2.16 -0.41 3.83 0.11 0.75 -3.10 120.40 122.44 1y3f s VAL 53 Ca 0.59 0.10 0.00 0.00 -2.93 0.00 0.00 61.98 59.74 1y3f s VAL 53 Cb -0.37 -3.04 0.00 0.00 -1.53 0.00 0.00 36.38 31.44 1y3f s VAL 53 CO 0.47 -0.02 0.00 0.61 -3.33 0.00 0.00 175.10 172.83 1y3f n GLY 54 N 0.81 0.32 3.75 6.54 0.00 -1.26 -4.98 105.19 110.37 1y3f n GLY 54 Ca 0.15 -0.74 -0.23 0.00 0.00 0.00 0.00 46.02 45.21 1y3f n GLY 54 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1y3f s THR 55 N -2.21 3.41 -0.06 2.61 -4.23 -1.18 -5.12 115.64 108.87 1y3f s THR 55 Ca 0.00 -1.64 -0.04 0.00 -1.18 0.00 0.00 61.69 58.84 1y3f s THR 55 Cb 0.00 -3.05 -0.04 0.00 1.34 0.00 0.00 72.50 70.75 1y3f s THR 55 CO 0.00 -0.24 0.14 -0.63 -0.54 0.00 0.00 174.62 173.34 1y3f s ILE 56 N -2.34 5.26 0.15 2.99 1.01 -1.26 -5.09 121.20 121.92 1y3f s ILE 56 Ca 0.36 -0.07 0.01 0.00 0.00 0.00 0.00 60.65 60.95 1y3f s ILE 56 Cb -0.05 -3.37 -0.04 0.00 0.01 0.00 0.00 42.46 39.01 1y3f s ILE 56 CO 0.23 0.46 0.00 0.68 0.00 0.00 0.00 174.94 176.31 1y3f s VAL 57 N -1.16 0.54 0.49 2.92 -7.23 -1.26 -5.14 120.40 109.56 1y3f s VAL 57 Ca 0.21 -1.95 -0.23 0.00 -1.81 0.00 0.00 61.98 58.19 1y3f s VAL 57 Cb -0.12 -2.03 -0.07 0.00 0.56 0.00 0.00 36.38 34.73 1y3f s VAL 57 CO 0.11 -0.54 1.33 0.42 -0.31 0.00 0.00 175.10 176.11 1y3f s THR 58 N -3.74 2.35 -0.50 5.32 -4.23 -1.26 -4.96 115.64 108.62 1y3f s THR 58 Ca 0.22 0.28 0.03 0.00 -1.18 0.00 0.00 61.69 61.03 1y3f s THR 58 Cb 0.06 -3.15 0.51 0.00 1.34 0.00 0.00 72.50 71.26 1y3f s THR 58 CO 0.02 0.01 1.77 0.23 -0.54 0.00 0.00 174.62 176.11 1y3f n MET 59 N -0.60 2.63 -2.61 3.99 2.81 -1.26 -4.96 117.12 117.12 1y3f n MET 59 Ca 0.08 -3.38 -0.29 0.00 -1.81 0.00 0.00 57.70 52.30 1y3f n MET 59 Cb 0.45 -2.19 -0.02 0.00 -0.71 0.00 0.00 33.22 30.75 1y3f n MET 59 CO 0.00 0.00 0.00 -1.83 1.51 0.00 0.00 175.97 175.65 1y3f s GLU 60 N -3.59 3.68 -0.23 0.03 1.03 -1.26 -5.07 118.70 113.30 1y3f s GLU 60 Ca 0.58 0.45 -0.04 0.00 0.03 0.00 0.00 54.97 55.98 1y3f s GLU 60 Cb 0.47 -2.32 -0.01 0.00 -0.80 0.00 0.00 34.13 31.47 1y3f s GLU 60 CO 0.02 -0.19 -0.03 -0.47 -1.33 0.00 0.00 175.26 173.27 1y3f s TYR 61 N -2.63 2.98 -0.28 4.83 5.04 -1.26 -5.02 117.35 121.02 1y3f s TYR 61 Ca 0.51 -0.91 0.02 0.00 -2.44 0.00 0.00 57.07 54.25 1y3f s TYR 61 Cb -0.10 -2.12 0.07 0.00 0.35 0.00 0.00 41.96 40.16 1y3f s TYR 61 CO 0.39 -0.54 -0.04 1.03 -1.34 0.00 0.00 175.55 175.06 1y3f s ARG 62 N 1.49 1.74 0.59 4.97 0.52 0.02 -5.00 118.95 123.28 1y3f s ARG 62 Ca 0.06 -1.35 0.29 0.00 -0.52 0.00 0.00 55.73 54.20 1y3f s ARG 62 Cb -0.14 -2.81 1.66 0.00 0.52 0.00 0.00 34.95 34.18 1y3f s ARG 62 CO -0.02 -0.70 2.11 0.97 0.02 0.00 0.00 175.30 177.67 1y3f h ILE 63 N 6.68 0.48 -0.00 1.52 2.10 -1.95 -2.12 117.51 124.22 1y3f h ILE 63 Ca -0.14 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.80 1y3f h ILE 63 Cb 1.04 0.85 0.00 0.00 -1.09 0.00 0.00 36.82 37.62 1y3f h ILE 63 CO 0.46 0.00 -0.39 0.47 -1.08 0.00 0.00 178.15 177.61 1y3f n ASP 64 N -3.81 0.57 -4.89 2.19 8.00 -1.26 -4.69 116.55 112.66 1y3f n ASP 64 Ca 0.01 -0.34 -0.35 0.00 0.71 0.00 0.00 54.79 54.82 1y3f n ASP 64 Cb 0.31 0.15 -0.05 0.00 -0.02 0.00 0.00 41.12 41.51 1y3f n ASP 64 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 1y3f s ARG 65 N -2.87 3.50 -0.23 -1.24 3.52 -0.81 0.01 118.95 120.84 1y3f s ARG 65 Ca 0.15 -0.16 -0.02 0.00 -0.13 0.00 0.00 55.73 55.57 1y3f s ARG 65 Cb 0.18 -3.12 0.07 0.00 -1.56 0.00 0.00 34.95 30.52 1y3f s ARG 65 CO 0.64 0.70 0.03 0.08 -0.81 0.00 0.00 175.30 175.94 1y3f s VAL 66 N -1.22 0.76 0.29 7.11 1.01 -0.54 -1.19 120.40 126.62 1y3f s VAL 66 Ca 0.24 -0.84 -0.28 0.00 0.00 0.00 0.00 61.98 61.10 1y3f s VAL 66 Cb -0.13 -1.29 -0.10 0.00 0.00 0.00 0.00 36.38 34.87 1y3f s VAL 66 CO 0.13 -0.29 0.95 -0.13 0.00 0.00 0.00 175.10 175.76 1y3f s ARG 67 N 1.73 4.69 -0.16 2.72 0.52 -1.26 -2.46 118.95 124.73 1y3f s ARG 67 Ca 0.00 1.40 -0.01 0.00 -0.52 0.00 0.00 55.73 56.61 1y3f s ARG 67 Cb -0.17 -2.99 -0.01 0.00 0.52 0.00 0.00 34.95 32.30 1y3f s ARG 67 CO -0.11 0.37 -0.11 -0.51 0.02 0.00 0.00 175.30 174.95 1y3f s LEU 68 N -1.71 2.74 -0.37 2.53 1.43 0.90 -4.42 118.68 119.78 1y3f s LEU 68 Ca 0.47 -0.35 -0.13 0.00 -1.03 0.00 0.00 54.13 53.08 1y3f s LEU 68 Cb -0.22 -1.64 0.00 0.00 0.03 0.00 0.00 46.19 44.37 1y3f s LEU 68 CO 0.27 0.11 0.25 0.00 0.23 0.00 0.00 176.35 177.22 1y3f s ALA 69 N 0.68 3.45 0.04 4.21 0.00 -1.26 -0.60 121.76 128.28 1y3f s ALA 69 Ca -0.06 -1.56 0.02 0.00 0.00 0.00 0.00 51.96 50.36 1y3f s ALA 69 Cb -0.15 -2.73 -0.04 0.00 0.00 0.00 0.00 23.12 20.20 1y3f s ALA 69 CO 0.02 -1.21 0.06 0.14 0.00 0.00 0.00 175.76 174.78 1y3f s VAL 70 N 1.68 4.51 0.63 0.00 -7.23 -0.19 -0.80 120.40 119.01 1y3f s VAL 70 Ca 0.05 -0.62 -0.10 0.00 -1.81 0.00 0.00 61.98 59.50 1y3f s VAL 70 Cb -0.18 -3.11 0.15 0.00 0.56 0.00 0.00 36.38 33.80 1y3f s VAL 70 CO 0.10 0.25 0.86 -0.90 -0.31 0.00 0.00 175.10 175.10 1y3f n ASP 71 N 0.89 0.11 0.11 4.85 5.68 -0.25 -0.18 116.55 127.77 1y3f n ASP 71 Ca -0.11 -1.34 0.12 0.00 -0.50 0.00 0.00 54.79 52.95 1y3f n ASP 71 Cb 0.52 -0.66 0.46 0.00 -1.14 0.00 0.00 41.12 40.31 1y3f n ASP 71 CO 0.00 0.00 0.00 -2.11 -1.33 0.00 0.00 177.20 173.76 1y3f n ARG 72 N -2.82 0.18 0.00 0.11 1.85 -1.26 -2.04 116.66 112.68 1y3f n ARG 72 Ca 0.11 0.37 0.13 0.00 -1.00 0.00 0.00 57.85 57.46 1y3f n ARG 72 Cb 0.38 -1.81 0.43 0.00 -1.05 0.00 0.00 32.46 30.40 1y3f n ARG 72 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 1y3f n LEU 73 N -2.14 1.32 -0.72 2.89 4.77 -1.26 -4.95 117.00 116.90 1y3f n LEU 73 Ca 0.03 -0.40 -0.07 0.00 -0.03 0.00 0.00 56.01 55.54 1y3f n LEU 73 Cb 0.25 -0.06 -0.01 0.00 -2.33 0.00 0.00 43.42 41.28 1y3f n LEU 73 CO 0.21 0.23 -0.08 -0.67 -1.33 0.00 0.00 177.39 175.75 1y3f n ASP 74 N -0.20 -2.72 -4.90 -1.43 2.03 -0.87 -5.01 116.55 103.46 1y3f n ASP 74 Ca 0.15 0.02 -0.27 0.00 0.52 0.00 0.00 54.79 55.21 1y3f n ASP 74 Cb 0.36 -1.90 -0.04 0.00 -0.72 0.00 0.00 41.12 38.83 1y3f n ASP 74 CO 0.00 0.00 0.00 0.20 -1.92 0.00 0.00 177.20 175.48 1y3f s ASN 75 N -2.73 6.11 0.04 1.67 0.01 -1.26 -1.52 114.94 117.25 1y3f s ASN 75 Ca 0.00 0.10 -0.31 0.00 -0.71 0.00 0.00 52.86 51.95 1y3f s ASN 75 Cb 0.00 -1.78 -0.06 0.00 0.41 0.00 0.00 41.25 39.81 1y3f s ASN 75 CO 0.00 0.07 1.38 -0.63 -1.51 0.00 0.00 177.10 176.42 1y3f s ILE 76 N -1.71 3.61 -0.24 0.60 -1.09 0.12 -1.09 121.20 121.40 1y3f s ILE 76 Ca 0.33 1.07 0.12 0.00 -2.23 0.00 0.00 60.65 59.95 1y3f s ILE 76 Cb -0.11 -3.69 -0.16 0.00 -1.58 0.00 0.00 42.46 36.92 1y3f s ILE 76 CO 0.27 0.03 0.36 0.00 -1.23 0.00 0.00 174.94 174.37 1y3f n ALA 77 N 4.84 2.90 -2.47 9.38 0.00 0.02 0.03 120.51 135.21 1y3f n ALA 77 Ca 0.12 -0.30 -0.08 0.00 0.00 0.00 0.00 53.44 53.18 1y3f n ALA 77 Cb 0.43 -0.41 -0.10 0.00 0.00 0.00 0.00 19.45 19.37 1y3f n ALA 77 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1y3f s GLN 78 N -2.52 0.50 -0.04 0.00 -0.21 -1.24 -4.94 119.66 111.21 1y3f s GLN 78 Ca -0.01 -0.97 -0.30 0.00 0.02 0.00 0.00 55.36 54.11 1y3f s GLN 78 Cb 0.08 0.13 -0.07 0.00 1.00 0.00 0.00 33.01 34.15 1y3f s GLN 78 CO 0.49 -0.08 1.92 0.08 -2.12 0.00 0.00 175.29 175.59 1y3f s VAL 79 N -2.85 3.17 0.41 1.09 1.01 -1.26 -4.70 120.40 117.26 1y3f s VAL 79 Ca -0.02 0.20 -0.26 0.00 0.00 0.00 0.00 61.98 61.89 1y3f s VAL 79 Cb 0.00 -3.14 -0.09 0.00 0.00 0.00 0.00 36.38 33.15 1y3f s VAL 79 CO -0.06 -0.04 1.31 -2.84 0.00 0.00 0.00 175.10 173.48 1y3f s PRO 80 N 4.69 3.94 0.08 2.72 0.02 -1.26 -4.87 135.00 140.32 1y3f s PRO 80 Ca 0.86 2.17 -0.09 0.00 0.02 0.00 0.00 61.00 63.96 1y3f s PRO 80 Cb -0.38 -2.75 0.00 0.00 0.02 0.00 0.00 34.50 31.39 1y3f s PRO 80 CO 0.38 -0.52 0.20 -0.98 -0.33 0.00 0.00 177.00 175.75 1y3f s ARG 81 N -2.26 0.82 0.35 5.54 1.70 -1.26 -1.05 118.95 122.79 1y3f s ARG 81 Ca 0.57 -0.86 -0.27 0.00 -0.47 0.00 0.00 55.73 54.70 1y3f s ARG 81 Cb -0.38 0.34 -0.09 0.00 -0.57 0.00 0.00 34.95 34.24 1y3f s ARG 81 CO 0.49 -0.26 1.20 0.08 -1.08 0.00 0.00 175.30 175.73 1y3f s VAL 82 N -3.54 3.08 0.00 4.99 1.01 -0.29 -4.14 120.40 121.51 1y3f s VAL 82 Ca 0.02 1.01 0.00 0.00 0.00 0.00 0.00 61.98 63.01 1y3f s VAL 82 Cb 0.03 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.81 1y3f s VAL 82 CO -0.09 0.18 0.00 0.61 0.00 0.00 0.00 175.10 175.79