#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y3f s GLN 2 N 0.00 3.82 0.04 0.00 0.74 -1.14 -4.04 119.66 119.08 1y3f s GLN 2 Ca 0.00 0.45 0.09 0.00 0.05 0.00 0.00 55.36 55.95 1y3f s GLN 2 Cb 0.00 -2.45 -0.03 0.00 1.10 0.00 0.00 33.01 31.63 1y3f s GLN 2 CO 0.00 0.07 -0.26 -1.12 -0.55 0.00 0.00 175.29 173.43 1y3f s SER 3 N -2.88 3.07 -0.37 6.67 0.01 -0.21 -4.96 113.70 115.03 1y3f s SER 3 Ca 0.51 -0.57 -0.14 0.00 1.31 0.00 0.00 55.95 57.05 1y3f s SER 3 Cb -0.10 -0.28 -0.00 0.00 0.21 0.00 0.00 66.02 65.84 1y3f s SER 3 CO 0.27 0.25 0.29 -0.69 0.41 0.00 0.00 173.24 173.78 1y3f s VAL 4 N -0.79 5.25 0.57 3.43 1.01 -1.26 -2.48 120.40 126.13 1y3f s VAL 4 Ca 0.11 -0.34 -0.20 0.00 0.00 0.00 0.00 61.98 61.55 1y3f s VAL 4 Cb -0.10 -3.83 -0.06 0.00 0.00 0.00 0.00 36.38 32.40 1y3f s VAL 4 CO 0.02 -0.16 1.01 -2.65 0.00 0.00 0.00 175.10 173.33 1y3f n PRO 5 N 5.20 1.06 0.08 2.72 -0.02 -1.26 -4.85 135.00 137.93 1y3f n PRO 5 Ca -0.11 0.40 0.07 0.00 -2.02 0.00 0.00 63.50 61.84 1y3f n PRO 5 Cb 0.49 -2.19 0.52 0.00 -0.02 0.00 0.00 33.50 32.30 1y3f n PRO 5 CO 0.00 0.00 0.00 0.10 1.98 0.00 0.00 175.50 177.58 1y3f h TYR 6 N 0.76 0.30 -0.12 6.00 -0.00 -1.95 -2.00 116.97 119.96 1y3f h TYR 6 Ca -0.48 0.01 -0.10 0.00 0.00 0.00 0.00 58.73 58.15 1y3f h TYR 6 Cb 1.35 -0.10 -0.01 0.00 0.00 0.00 0.00 36.73 37.97 1y3f h TYR 6 CO 0.39 0.18 -0.39 0.78 -0.00 0.00 0.00 178.16 179.12 1y3f h GLY 7 N 0.31 0.27 0.96 0.10 0.00 -1.95 0.24 103.07 103.00 1y3f h GLY 7 Ca 0.12 -0.25 -0.04 0.00 0.00 0.00 0.00 47.33 47.16 1y3f h GLY 7 CO -0.03 0.23 0.13 -2.08 0.00 0.00 0.00 176.54 174.79 1y3f h VAL 8 N 0.22 1.23 -0.67 4.60 2.07 -1.71 -2.22 116.25 119.76 1y3f h VAL 8 Ca 0.02 -0.77 -0.05 0.00 0.82 0.00 0.00 66.70 66.72 1y3f h VAL 8 Cb 0.78 0.86 -0.03 0.00 -1.52 0.00 0.00 31.29 31.39 1y3f h VAL 8 CO 0.06 0.28 0.23 0.28 0.02 0.00 0.00 177.57 178.44 1y3f h SER 9 N 0.61 0.96 -0.12 0.57 0.02 -1.42 -2.54 113.55 111.63 1y3f h SER 9 Ca 0.15 -0.20 -0.05 0.00 -0.84 0.00 0.00 61.79 60.85 1y3f h SER 9 Cb 0.29 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.56 1y3f h SER 9 CO -0.00 0.90 -0.07 -0.61 -1.14 0.00 0.00 176.83 175.91 1y3f h GLN 10 N 0.97 0.40 -0.04 3.45 4.15 -0.14 -0.52 115.11 123.38 1y3f h GLN 10 Ca 0.22 -0.09 0.00 0.00 0.77 0.00 0.00 58.65 59.55 1y3f h GLN 10 Cb 0.27 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 27.90 1y3f h GLN 10 CO -0.01 0.49 0.00 0.44 -1.93 0.00 0.00 178.83 177.82 1y3f n ILE 11 N -4.27 0.05 -2.27 2.39 -5.35 -0.87 -4.92 119.36 104.11 1y3f n ILE 11 Ca 0.00 -0.15 -0.12 0.00 -0.27 0.00 0.00 62.75 62.21 1y3f n ILE 11 Cb 0.26 0.02 -0.00 0.00 -1.74 0.00 0.00 39.64 38.18 1y3f n ILE 11 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 1y3f n LYS 12 N -0.32 -1.12 -0.11 6.28 5.02 -0.20 -1.16 118.16 126.54 1y3f n LYS 12 Ca 0.19 0.58 -0.01 0.00 -2.02 0.00 0.00 58.31 57.05 1y3f n LYS 12 Cb 0.22 -4.75 0.26 0.00 -0.02 0.00 0.00 35.03 30.74 1y3f n LYS 12 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1y3f h ALA 13 N 0.58 1.38 -0.35 7.82 0.00 -1.66 -2.40 119.26 124.62 1y3f h ALA 13 Ca -0.29 -0.14 0.10 0.00 0.00 0.00 0.00 54.91 54.58 1y3f h ALA 13 Cb 1.21 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 1y3f h ALA 13 CO 0.34 0.47 0.27 -1.35 0.00 0.00 0.00 179.25 178.98 1y3f h PRO 14 N 0.77 0.00 -0.72 0.00 0.11 -1.88 -0.77 132.00 129.51 1y3f h PRO 14 Ca 0.18 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.23 1y3f h PRO 14 Cb 0.14 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.22 1y3f h PRO 14 CO -0.02 0.00 0.20 0.00 -0.21 0.00 0.00 178.00 177.98 1y3f h ALA 15 N 1.79 1.01 -0.37 -0.75 0.00 -1.82 -0.04 119.26 119.08 1y3f h ALA 15 Ca 0.17 -0.23 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 1y3f h ALA 15 Cb 0.70 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1y3f h ALA 15 CO -0.00 0.66 0.01 -0.07 0.00 0.00 0.00 179.25 179.84 1y3f h LEU 16 N 1.07 0.63 -0.83 0.00 -0.00 -1.27 -2.71 115.31 112.20 1y3f h LEU 16 Ca 0.23 -0.30 0.07 0.00 -0.00 0.00 0.00 57.88 57.88 1y3f h LEU 16 Cb 0.33 -0.17 -0.06 0.00 -0.00 0.00 0.00 40.66 40.75 1y3f h LEU 16 CO -0.00 0.78 0.50 0.45 -0.00 0.00 0.00 178.44 180.16 1y3f h HIS 17 N 0.47 0.91 0.00 1.13 3.86 -0.88 -0.52 115.15 120.12 1y3f h HIS 17 Ca 0.11 0.03 -0.08 0.00 -1.16 0.00 0.00 60.37 59.26 1y3f h HIS 17 Cb 0.45 -0.29 -0.01 0.00 1.06 0.00 0.00 27.41 28.62 1y3f h HIS 17 CO 0.04 0.43 -0.38 0.66 0.86 0.00 0.00 177.93 179.54 1y3f h SER 18 N 0.88 0.00 0.79 2.45 4.64 -0.99 0.28 113.55 121.61 1y3f h SER 18 Ca 0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.69 1y3f h SER 18 Cb 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 1y3f h SER 18 CO -0.20 0.38 0.00 0.00 -0.87 0.00 0.00 176.83 176.14 1y3f n GLN 19 N -3.68 0.12 0.00 4.77 6.02 -0.78 -4.91 117.38 118.92 1y3f n GLN 19 Ca -0.01 0.30 0.00 0.00 -0.01 0.00 0.00 57.00 57.28 1y3f n GLN 19 Cb 0.48 -1.71 0.00 0.00 1.02 0.00 0.00 30.24 30.03 1y3f n GLN 19 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1y3f n GLY 20 N 0.34 1.04 3.33 1.08 0.00 0.09 -5.09 105.19 105.99 1y3f n GLY 20 Ca 0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.71 1y3f n GLY 20 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1y3f s TYR 21 N -2.00 2.91 -0.01 1.61 2.02 -0.27 -4.97 117.35 116.64 1y3f s TYR 21 Ca 0.00 -0.84 0.02 0.00 -0.37 0.00 0.00 57.07 55.88 1y3f s TYR 21 Cb 0.00 -2.00 0.03 0.00 -0.40 0.00 0.00 41.96 39.58 1y3f s TYR 21 CO 0.00 -0.42 0.84 0.25 -1.57 0.00 0.00 175.55 174.65 1y3f n THR 22 N 4.30 0.25 -0.60 -0.71 -2.24 -1.26 -3.00 114.28 111.02 1y3f n THR 22 Ca -0.18 -0.29 0.00 0.00 -2.27 0.00 0.00 64.05 61.31 1y3f n THR 22 Cb 0.51 0.61 0.00 0.00 -2.10 0.00 0.00 70.33 69.35 1y3f n THR 22 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1y3f n GLY 23 N -0.17 0.68 3.68 3.38 0.00 -1.26 -1.03 105.19 110.46 1y3f n GLY 23 Ca 0.02 -0.25 -0.45 0.00 0.00 0.00 0.00 46.02 45.34 1y3f n GLY 23 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1y3f n SER 24 N 0.45 2.96 0.00 1.61 2.88 -1.26 -1.72 113.62 118.54 1y3f n SER 24 Ca 0.00 1.12 0.00 0.00 -1.33 0.00 0.00 58.87 58.66 1y3f n SER 24 Cb 0.00 -1.44 0.00 0.00 -0.75 0.00 0.00 64.21 62.02 1y3f n SER 24 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1y3f n ASN 25 N 2.55 -2.68 -4.75 -3.46 3.02 -1.26 -4.72 115.26 103.95 1y3f n ASN 25 Ca 0.13 0.00 -0.37 0.00 -0.03 0.00 0.00 54.58 54.31 1y3f n ASN 25 Cb 0.31 -1.43 -0.07 0.00 -0.61 0.00 0.00 39.78 37.99 1y3f n ASN 25 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1y3f s VAL 26 N -2.04 5.25 -0.28 2.41 1.01 -0.70 -4.90 120.40 121.14 1y3f s VAL 26 Ca 0.00 0.67 -0.13 0.00 0.00 0.00 0.00 61.98 62.52 1y3f s VAL 26 Cb 0.00 -3.68 -0.04 0.00 0.00 0.00 0.00 36.38 32.67 1y3f s VAL 26 CO 0.00 0.41 0.30 -0.54 0.00 0.00 0.00 175.10 175.27 1y3f s LYS 27 N 0.20 3.92 -0.20 2.72 1.02 -1.26 -0.49 119.74 125.64 1y3f s LYS 27 Ca 0.20 -0.18 0.01 0.00 0.02 0.00 0.00 55.97 56.02 1y3f s LYS 27 Cb -0.14 -3.68 0.03 0.00 -0.52 0.00 0.00 37.83 33.52 1y3f s LYS 27 CO 0.07 -0.28 -0.17 0.08 -0.92 0.00 0.00 175.35 174.13 1y3f s VAL 28 N 1.93 2.13 -0.20 3.17 1.01 0.05 -0.48 120.40 128.01 1y3f s VAL 28 Ca 0.11 -1.08 -0.19 0.00 0.00 0.00 0.00 61.98 60.81 1y3f s VAL 28 Cb -0.16 -1.98 -0.03 0.00 0.00 0.00 0.00 36.38 34.21 1y3f s VAL 28 CO 0.11 0.41 0.56 0.00 0.00 0.00 0.00 175.10 176.17 1y3f s ALA 29 N 1.25 3.54 -0.54 5.51 0.00 -0.17 -0.28 121.76 131.08 1y3f s ALA 29 Ca 0.02 -0.35 -0.18 0.00 0.00 0.00 0.00 51.96 51.45 1y3f s ALA 29 Cb -0.15 -2.87 0.08 0.00 0.00 0.00 0.00 23.12 20.18 1y3f s ALA 29 CO -0.11 -0.49 0.62 0.08 0.00 0.00 0.00 175.76 175.87 1y3f s VAL 30 N 1.74 4.92 -0.51 0.00 1.01 -0.12 -1.23 120.40 126.22 1y3f s VAL 30 Ca 0.26 -0.85 -0.20 0.00 0.00 0.00 0.00 61.98 61.19 1y3f s VAL 30 Cb -0.16 -4.36 0.05 0.00 0.00 0.00 0.00 36.38 31.92 1y3f s VAL 30 CO 0.10 -0.92 0.65 -0.63 0.00 0.00 0.00 175.10 174.30 1y3f s ILE 31 N 2.45 4.83 0.00 2.22 1.01 -0.67 -1.74 121.20 129.31 1y3f s ILE 31 Ca 0.11 -0.40 0.00 0.00 0.00 0.00 0.00 60.65 60.37 1y3f s ILE 31 Cb -0.23 -4.31 0.00 0.00 0.01 0.00 0.00 42.46 37.93 1y3f s ILE 31 CO 0.08 -0.82 0.00 -0.67 0.00 0.00 0.00 174.94 173.54 1y3f n ASP 32 N 6.28 0.00 -1.23 3.58 -0.08 -0.67 -4.20 116.55 120.22 1y3f n ASP 32 Ca -0.06 0.00 0.05 0.00 -1.51 0.00 0.00 54.79 53.27 1y3f n ASP 32 Cb 0.46 0.00 0.24 0.00 2.34 0.00 0.00 41.12 44.16 1y3f n ASP 32 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 1y3f n SER 33 N 0.00 3.56 0.00 1.67 3.41 -1.26 -0.24 113.62 120.76 1y3f n SER 33 Ca 0.00 -2.43 0.00 0.00 -0.26 0.00 0.00 58.87 56.18 1y3f n SER 33 Cb 0.00 -0.54 0.00 0.00 -0.26 0.00 0.00 64.21 63.41 1y3f n SER 33 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1y3f n GLY 34 N 0.59 0.87 2.77 5.00 0.00 -1.26 -4.32 105.19 108.84 1y3f n GLY 34 Ca 0.17 -2.11 -0.16 0.00 0.00 0.00 0.00 46.02 43.91 1y3f n GLY 34 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1y3f s ILE 35 N -1.35 -0.07 -0.67 -0.61 1.01 -0.66 -3.42 121.20 115.44 1y3f s ILE 35 Ca 0.00 0.26 -0.26 0.00 0.00 0.00 0.00 60.65 60.64 1y3f s ILE 35 Cb 0.00 -0.11 -0.03 0.00 0.01 0.00 0.00 42.46 42.33 1y3f s ILE 35 CO 0.00 0.11 1.90 -0.62 0.00 0.00 0.00 174.94 176.32 1y3f s ASP 36 N 1.30 5.21 0.21 3.58 2.15 -1.26 -3.95 116.67 123.91 1y3f s ASP 36 Ca -0.06 0.16 0.24 0.00 0.43 0.00 0.00 52.55 53.31 1y3f s ASP 36 Cb -0.13 -2.53 0.92 0.00 -0.30 0.00 0.00 42.92 40.88 1y3f s ASP 36 CO -0.03 -2.48 1.72 -1.54 -0.17 0.00 0.00 175.17 172.67 1y3f n SER 37 N 13.13 0.63 0.00 -0.34 3.41 -1.16 -2.06 113.62 127.24 1y3f n SER 37 Ca 0.25 0.62 0.13 0.00 -0.26 0.00 0.00 58.87 59.61 1y3f n SER 37 Cb 0.51 -0.77 0.64 0.00 -0.26 0.00 0.00 64.21 64.34 1y3f n SER 37 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1y3f n SER 38 N -2.16 0.00 -4.71 4.04 7.64 -1.26 -4.74 113.62 112.43 1y3f n SER 38 Ca 0.03 0.06 -0.42 0.00 1.01 0.00 0.00 58.87 59.56 1y3f n SER 38 Cb 0.29 -0.34 -0.03 0.00 -1.01 0.00 0.00 64.21 63.11 1y3f n SER 38 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 1y3f s HIS 39 N -2.69 3.16 -0.87 1.43 2.46 -0.88 -4.88 115.29 113.04 1y3f s HIS 39 Ca 0.22 0.89 0.16 0.00 0.47 0.00 0.00 55.06 56.80 1y3f s HIS 39 Cb 0.18 -3.71 0.69 0.00 -0.13 0.00 0.00 32.58 29.61 1y3f s HIS 39 CO 0.43 -2.53 1.51 -0.35 -2.47 0.00 0.00 174.74 171.32 1y3f n PRO 40 N 4.15 0.05 -0.65 2.88 -0.04 -1.26 -2.06 135.00 138.07 1y3f n PRO 40 Ca 0.12 0.30 0.08 0.00 -0.04 0.00 0.00 63.50 63.96 1y3f n PRO 40 Cb 0.42 -1.60 0.33 0.00 -0.04 0.00 0.00 33.50 32.62 1y3f n PRO 40 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1y3f n ASP 41 N -1.69 4.76 -4.11 3.54 2.03 -1.26 -4.92 116.55 114.90 1y3f n ASP 41 Ca 0.03 -2.80 -0.18 0.00 0.52 0.00 0.00 54.79 52.37 1y3f n ASP 41 Cb 0.18 -0.59 -0.13 0.00 -0.72 0.00 0.00 41.12 39.86 1y3f n ASP 41 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1y3f s LEU 42 N -2.48 2.18 -0.21 -2.67 1.43 -0.87 -0.74 118.68 115.32 1y3f s LEU 42 Ca 0.48 -0.45 0.01 0.00 -1.03 0.00 0.00 54.13 53.13 1y3f s LEU 42 Cb 0.35 -0.45 0.05 0.00 0.03 0.00 0.00 46.19 46.18 1y3f s LEU 42 CO 0.16 -0.03 -0.07 -0.75 0.23 0.00 0.00 176.35 175.88 1y3f s LYS 43 N -1.19 1.73 -0.22 1.70 2.20 -1.26 -4.73 119.74 117.97 1y3f s LYS 43 Ca -0.02 -0.88 -0.14 0.00 -0.36 0.00 0.00 55.97 54.57 1y3f s LYS 43 Cb -0.08 -2.46 -0.04 0.00 -1.51 0.00 0.00 37.83 33.74 1y3f s LYS 43 CO 0.01 -0.52 0.34 0.08 -0.36 0.00 0.00 175.35 174.89 1y3f s VAL 44 N 1.42 5.23 -0.18 4.02 1.01 -1.26 -4.23 120.40 126.42 1y3f s VAL 44 Ca -0.04 0.56 0.18 0.00 0.00 0.00 0.00 61.98 62.68 1y3f s VAL 44 Cb -0.18 -3.67 -0.00 0.00 0.00 0.00 0.00 36.38 32.53 1y3f s VAL 44 CO -0.07 0.26 1.15 0.00 0.00 0.00 0.00 175.10 176.44 1y3f h ALA 45 N 7.51 0.66 0.00 5.51 0.00 -0.78 -3.48 119.26 128.68 1y3f h ALA 45 Ca -0.36 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.06 1y3f h ALA 45 Cb 1.16 0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1y3f h ALA 45 CO 0.69 0.57 0.00 0.41 0.00 0.00 0.00 179.25 180.93 1y3f n GLY 46 N 1.27 -1.23 0.00 0.00 0.00 -1.23 -5.02 105.19 98.99 1y3f n GLY 46 Ca -0.03 -0.90 0.00 0.00 0.00 0.00 0.00 46.02 45.09 1y3f n GLY 46 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1y3f n GLY 47 N 0.00 -0.71 3.56 -0.02 0.00 -1.26 -0.98 105.19 105.77 1y3f n GLY 47 Ca 0.00 -1.48 -0.14 0.00 0.00 0.00 0.00 46.02 44.40 1y3f n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y3f s ALA 48 N -1.10 -1.85 -0.13 4.61 0.00 -0.42 -4.95 121.76 117.92 1y3f s ALA 48 Ca 0.00 1.52 -0.03 0.00 0.00 0.00 0.00 51.96 53.45 1y3f s ALA 48 Cb 0.00 -0.48 -0.03 0.00 0.00 0.00 0.00 23.12 22.60 1y3f s ALA 48 CO 0.00 -0.33 -0.02 0.45 0.00 0.00 0.00 175.76 175.86 1y3f s SER 49 N -0.94 5.01 -0.00 0.00 0.15 -1.26 -0.90 113.70 115.76 1y3f s SER 49 Ca -0.05 -0.01 0.17 0.00 0.70 0.00 0.00 55.95 56.75 1y3f s SER 49 Cb -0.01 -1.64 0.49 0.00 -1.71 0.00 0.00 66.02 63.14 1y3f s SER 49 CO 0.05 0.25 1.41 0.23 1.20 0.00 0.00 173.24 176.38 1y3f n MET 50 N 2.98 2.80 -3.12 5.44 2.81 0.73 -4.91 117.12 123.85 1y3f n MET 50 Ca -0.18 -2.38 -0.43 0.00 -1.81 0.00 0.00 57.70 52.90 1y3f n MET 50 Cb 0.53 -1.43 -0.07 0.00 -0.71 0.00 0.00 33.22 31.54 1y3f n MET 50 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 1y3f s VAL 51 N -1.01 4.84 0.24 2.03 1.01 -1.24 -4.76 120.40 121.52 1y3f s VAL 51 Ca 0.37 0.10 -0.04 0.00 0.00 0.00 0.00 61.98 62.40 1y3f s VAL 51 Cb 0.19 -4.20 0.22 0.00 0.00 0.00 0.00 36.38 32.59 1y3f s VAL 51 CO 0.25 -0.59 1.72 -0.65 0.00 0.00 0.00 175.10 175.83 1y3f h PRO 52 N 8.86 0.40 -0.02 2.72 0.11 -1.97 -1.48 132.00 140.63 1y3f h PRO 52 Ca -0.25 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1y3f h PRO 52 Cb 1.10 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.12 1y3f h PRO 52 CO 0.89 0.26 -0.06 -1.13 -0.21 0.00 0.00 178.00 177.74 1y3f n SER 53 N -5.03 1.58 -3.65 -2.05 3.41 -1.26 -4.56 113.62 102.06 1y3f n SER 53 Ca 0.14 -1.43 -0.29 0.00 -0.26 0.00 0.00 58.87 57.03 1y3f n SER 53 Cb 0.42 0.04 -0.12 0.00 -0.26 0.00 0.00 64.21 64.29 1y3f n SER 53 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1y3f s GLU 54 N -2.11 1.35 0.00 4.33 2.02 -0.56 -4.99 118.70 118.74 1y3f s GLU 54 Ca 0.34 -2.21 0.28 0.00 0.02 0.00 0.00 54.97 53.40 1y3f s GLU 54 Cb 0.20 -2.24 1.10 0.00 0.10 0.00 0.00 34.13 33.30 1y3f s GLU 54 CO 0.37 -1.24 1.79 0.25 0.02 0.00 0.00 175.26 176.46 1y3f n THR 55 N 3.16 0.00 -3.41 3.63 -2.24 -1.25 -4.42 114.28 109.74 1y3f n THR 55 Ca 0.15 -0.06 -0.43 0.00 -2.27 0.00 0.00 64.05 61.45 1y3f n THR 55 Cb 0.38 -0.03 -0.10 0.00 -2.10 0.00 0.00 70.33 68.48 1y3f n THR 55 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1y3f s ASN 56 N -2.56 6.14 0.23 3.42 3.84 -1.26 -4.45 114.94 120.29 1y3f s ASN 56 Ca 0.26 -0.76 0.24 0.00 0.21 0.00 0.00 52.86 52.81 1y3f s ASN 56 Cb 0.20 -2.18 0.92 0.00 -0.55 0.00 0.00 41.25 39.63 1y3f s ASN 56 CO 0.50 -0.48 1.73 -0.81 -2.79 0.00 0.00 177.10 175.26 1y3f n PRO 57 N 5.32 0.21 -0.18 0.43 -0.04 -1.26 -2.69 135.00 136.78 1y3f n PRO 57 Ca -0.10 0.34 0.08 0.00 -0.04 0.00 0.00 63.50 63.78 1y3f n PRO 57 Cb 0.47 -1.83 0.23 0.00 -0.04 0.00 0.00 33.50 32.33 1y3f n PRO 57 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1y3f n PHE 58 N -2.20 0.47 -4.12 0.54 3.72 -1.26 -1.65 117.46 112.96 1y3f n PHE 58 Ca 0.03 -0.23 -0.33 0.00 -0.05 0.00 0.00 57.45 56.86 1y3f n PHE 58 Cb 0.30 0.00 -0.15 0.00 -0.94 0.00 0.00 39.48 38.68 1y3f n PHE 58 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 176.76 175.57 1y3f s GLN 59 N -1.53 3.10 -0.39 -1.08 2.00 -1.10 -2.96 119.66 117.69 1y3f s GLN 59 Ca 0.29 -0.78 -0.05 0.00 -2.00 0.00 0.00 55.36 52.83 1y3f s GLN 59 Cb 0.15 -2.67 0.09 0.00 0.80 0.00 0.00 33.01 31.38 1y3f s GLN 59 CO 0.21 -0.18 0.19 0.34 -0.50 0.00 0.00 175.29 175.34 1y3f s ASP 60 N 1.28 5.32 0.00 6.67 2.15 -1.26 -4.61 116.67 126.22 1y3f s ASP 60 Ca 0.04 -1.74 0.25 0.00 0.43 0.00 0.00 52.55 51.54 1y3f s ASP 60 Cb -0.14 -1.86 1.03 0.00 -0.30 0.00 0.00 42.92 41.65 1y3f s ASP 60 CO -0.09 -0.50 1.72 0.59 -0.17 0.00 0.00 175.17 176.72 1y3f n ASN 61 N 4.70 1.35 -0.09 -0.34 3.02 -1.26 -4.10 115.26 118.54 1y3f n ASN 61 Ca -0.07 -1.52 -0.18 0.00 -0.03 0.00 0.00 54.58 52.79 1y3f n ASN 61 Cb 0.42 -0.04 -0.07 0.00 -0.61 0.00 0.00 39.78 39.48 1y3f n ASN 61 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1y3f n ASN 62 N 0.07 1.77 0.00 6.41 2.85 -1.26 -4.72 115.26 120.38 1y3f n ASN 62 Ca 0.18 0.12 0.00 0.00 -0.11 0.00 0.00 54.58 54.77 1y3f n ASN 62 Cb 0.31 -0.47 0.00 0.00 1.24 0.00 0.00 39.78 40.86 1y3f n ASN 62 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 1y3f n SER 63 N -3.57 0.00 0.03 1.20 3.41 -1.26 -4.99 113.62 108.44 1y3f n SER 63 Ca -0.35 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.13 1y3f n SER 63 Cb 0.79 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.66 1y3f n SER 63 CO 0.00 0.00 0.00 -0.74 -0.16 0.00 0.00 175.04 174.14 1y3f h HIS 64 N 0.00 -0.01 -0.34 7.33 6.17 -1.93 -2.23 115.15 124.14 1y3f h HIS 64 Ca 0.00 -0.00 -0.04 0.00 0.71 0.00 0.00 60.37 61.04 1y3f h HIS 64 Cb 0.00 0.00 -0.02 0.00 2.52 0.00 0.00 27.41 29.92 1y3f h HIS 64 CO 0.00 0.08 0.04 0.78 0.71 0.00 0.00 177.93 179.54 1y3f h GLY 65 N -0.10 0.55 0.98 5.26 0.00 -1.87 -1.09 103.07 106.80 1y3f h GLY 65 Ca -0.00 -0.30 -0.07 0.00 0.00 0.00 0.00 47.33 46.96 1y3f h GLY 65 CO 0.00 0.28 0.03 -0.84 0.00 0.00 0.00 176.54 176.01 1y3f h THR 66 N 0.50 1.26 -0.15 4.70 2.02 -1.54 -0.31 112.91 119.39 1y3f h THR 66 Ca 0.11 -1.01 -0.02 0.00 0.77 0.00 0.00 66.41 66.27 1y3f h THR 66 Cb 0.26 0.99 -0.01 0.00 -1.74 0.00 0.00 68.15 67.66 1y3f h THR 66 CO 0.00 0.35 0.03 -0.74 0.37 0.00 0.00 175.52 175.54 1y3f h HIS 67 N 0.66 0.26 -0.49 3.16 6.17 -0.78 -1.77 115.15 122.36 1y3f h HIS 67 Ca 0.14 -0.03 0.03 0.00 0.71 0.00 0.00 60.37 61.21 1y3f h HIS 67 Cb 0.47 -0.07 -0.04 0.00 2.52 0.00 0.00 27.41 30.29 1y3f h HIS 67 CO 0.03 0.41 0.27 0.28 0.71 0.00 0.00 177.93 179.63 1y3f h VAL 68 N 0.04 1.01 -1.01 5.26 2.07 -1.21 -2.29 116.25 120.12 1y3f h VAL 68 Ca 0.05 -0.18 0.01 0.00 0.82 0.00 0.00 66.70 67.40 1y3f h VAL 68 Cb 0.28 0.42 -0.05 0.00 -1.52 0.00 0.00 31.29 30.42 1y3f h VAL 68 CO 0.00 0.10 0.67 0.00 0.02 0.00 0.00 177.57 178.36 1y3f h ALA 69 N 1.24 1.29 0.00 1.67 0.00 -0.92 -2.07 119.26 120.47 1y3f h ALA 69 Ca 0.21 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 1y3f h ALA 69 Cb 0.07 -0.40 -0.01 0.00 0.00 0.00 0.00 17.79 17.45 1y3f h ALA 69 CO -0.12 0.65 -0.25 0.78 0.00 0.00 0.00 179.25 180.30 1y3f h GLY 70 N 1.35 0.00 1.28 0.00 0.00 -0.79 0.81 103.07 105.73 1y3f h GLY 70 Ca 0.37 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.51 1y3f h GLY 70 CO -0.09 0.00 -0.67 -0.84 0.00 0.00 0.00 176.54 174.94 1y3f h THR 71 N 0.00 1.30 -0.20 4.70 2.02 -0.91 -1.42 112.91 118.40 1y3f h THR 71 Ca -0.00 -1.90 -0.02 0.00 0.77 0.00 0.00 66.41 65.26 1y3f h THR 71 Cb 0.45 1.86 -0.01 0.00 -1.74 0.00 0.00 68.15 68.71 1y3f h THR 71 CO 0.03 0.60 0.06 0.58 0.37 0.00 0.00 175.52 177.17 1y3f h VAL 72 N 0.52 1.19 0.00 3.16 2.07 -0.79 -1.38 116.25 121.03 1y3f h VAL 72 Ca -0.02 -0.59 -0.06 0.00 0.82 0.00 0.00 66.70 66.85 1y3f h VAL 72 Cb 1.27 1.20 -0.10 0.00 -1.52 0.00 0.00 31.29 32.15 1y3f h VAL 72 CO 0.14 0.19 -0.37 0.00 0.02 0.00 0.00 177.57 177.54 1y3f n ALA 73 N -2.26 2.46 -1.67 1.67 0.00 0.22 -0.27 120.51 120.66 1y3f n ALA 73 Ca -0.04 -0.81 -0.43 0.00 0.00 0.00 0.00 53.44 52.16 1y3f n ALA 73 Cb 0.15 -0.33 -0.00 0.00 0.00 0.00 0.00 19.45 19.26 1y3f n ALA 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1y3f n ALA 74 N 0.09 0.96 -1.77 0.00 0.00 -0.54 -4.59 120.51 114.66 1y3f n ALA 74 Ca -0.05 0.35 -0.36 0.00 0.00 0.00 0.00 53.44 53.37 1y3f n ALA 74 Cb 0.71 -2.20 -0.00 0.00 0.00 0.00 0.00 19.45 17.95 1y3f n ALA 74 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1y3f s LEU 75 N -0.80 3.88 -0.54 0.00 1.43 0.08 -0.44 118.68 122.30 1y3f s LEU 75 Ca 0.57 2.25 -0.24 0.00 -1.03 0.00 0.00 54.13 55.68 1y3f s LEU 75 Cb -0.58 -4.40 0.04 0.00 0.03 0.00 0.00 46.19 41.27 1y3f s LEU 75 CO 0.61 -1.07 0.90 0.21 0.23 0.00 0.00 176.35 177.23 1y3f s ASN 76 N -1.55 6.34 0.00 2.29 2.47 -1.26 -4.59 114.94 118.63 1y3f s ASN 76 Ca 0.68 -0.38 0.00 0.00 0.42 0.00 0.00 52.86 53.58 1y3f s ASN 76 Cb -0.27 -2.42 0.00 0.00 -1.45 0.00 0.00 41.25 37.11 1y3f s ASN 76 CO 0.31 -1.17 0.00 -0.46 -3.72 0.00 0.00 177.10 172.06 1y3f n ASN 77 N 7.29 0.00 -1.59 -4.21 0.23 -1.26 -5.05 115.26 110.66 1y3f n ASN 77 Ca 0.01 0.00 0.02 0.00 -0.53 0.00 0.00 54.58 54.08 1y3f n ASN 77 Cb 0.47 0.00 0.31 0.00 -2.08 0.00 0.00 39.78 38.49 1y3f n ASN 77 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1y3f n SER 78 N 0.00 4.63 -4.10 0.53 3.41 -1.26 -4.43 113.62 112.40 1y3f n SER 78 Ca 0.00 -3.14 -0.11 0.00 -0.26 0.00 0.00 58.87 55.36 1y3f n SER 78 Cb 0.00 -0.67 -0.11 0.00 -0.26 0.00 0.00 64.21 63.18 1y3f n SER 78 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 1y3f s ILE 79 N -2.92 0.55 0.00 -1.33 -4.36 -1.26 -1.90 121.20 109.98 1y3f s ILE 79 Ca 0.51 -1.45 0.00 0.00 -0.26 0.00 0.00 60.65 59.45 1y3f s ILE 79 Cb 0.41 -1.06 0.00 0.00 1.25 0.00 0.00 42.46 43.06 1y3f s ILE 79 CO 0.12 -0.62 0.00 0.61 0.24 0.00 0.00 174.94 175.29 1y3f n GLY 80 N 0.80 2.71 3.84 6.27 0.00 -1.26 -4.51 105.19 113.06 1y3f n GLY 80 Ca -0.18 -0.36 -0.26 0.00 0.00 0.00 0.00 46.02 45.22 1y3f n GLY 80 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1y3f s VAL 81 N 0.00 1.92 -0.08 1.61 -7.23 -1.26 -1.04 120.40 114.32 1y3f s VAL 81 Ca 0.00 -1.57 0.04 0.00 -1.81 0.00 0.00 61.98 58.64 1y3f s VAL 81 Cb 0.00 -2.49 -0.02 0.00 0.56 0.00 0.00 36.38 34.43 1y3f s VAL 81 CO 0.00 0.00 -0.19 -0.22 -0.31 0.00 0.00 175.10 174.38 1y3f s LEU 82 N -4.12 2.41 0.73 1.32 2.96 -1.03 -4.46 118.68 116.48 1y3f s LEU 82 Ca 0.35 -0.39 -0.07 0.00 -0.22 0.00 0.00 54.13 53.81 1y3f s LEU 82 Cb -0.00 -1.48 0.08 0.00 0.50 0.00 0.00 46.19 45.29 1y3f s LEU 82 CO 0.21 0.25 1.03 -0.83 -1.32 0.00 0.00 176.35 175.69 1y3f s GLY 83 N -0.15 1.71 0.15 7.98 0.00 0.42 -4.58 107.32 112.85 1y3f s GLY 83 Ca -0.02 -1.07 -0.12 0.00 0.00 0.00 0.00 44.72 43.50 1y3f s GLY 83 CO 0.04 -0.61 1.62 -2.08 0.00 0.00 0.00 173.10 172.07 1y3f h VAL 84 N -0.67 1.26 -2.35 1.40 2.07 -1.13 -3.34 116.25 113.48 1y3f h VAL 84 Ca -0.43 -0.99 -0.59 0.00 0.82 0.00 0.00 66.70 65.50 1y3f h VAL 84 Cb 1.30 0.92 -0.41 0.00 -1.52 0.00 0.00 31.29 31.58 1y3f h VAL 84 CO 0.55 0.35 -0.76 0.00 0.02 0.00 0.00 177.57 177.73 1y3f n ALA 85 N -2.42 3.39 0.40 1.67 0.00 0.63 -4.89 120.51 119.29 1y3f n ALA 85 Ca 0.01 -4.18 0.08 0.00 0.00 0.00 0.00 53.44 49.35 1y3f n ALA 85 Cb 0.28 -0.89 0.35 0.00 0.00 0.00 0.00 19.45 19.19 1y3f n ALA 85 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1y3f n PRO 86 N 1.46 0.07 -0.18 0.00 -0.04 -1.03 -1.37 135.00 133.90 1y3f n PRO 86 Ca 0.26 0.35 0.12 0.00 -0.04 0.00 0.00 63.50 64.18 1y3f n PRO 86 Cb 0.44 -1.64 0.21 0.00 -0.04 0.00 0.00 33.50 32.46 1y3f n PRO 86 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1y3f n SER 87 N -1.77 3.46 -4.71 3.54 7.64 -0.19 -4.45 113.62 117.14 1y3f n SER 87 Ca 0.02 -2.00 -0.36 0.00 1.01 0.00 0.00 58.87 57.55 1y3f n SER 87 Cb 0.16 -0.23 0.08 0.00 -1.01 0.00 0.00 64.21 63.22 1y3f n SER 87 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1y3f n ALA 88 N 1.50 0.77 -2.59 -0.43 0.00 -0.47 -3.99 120.51 115.30 1y3f n ALA 88 Ca 0.19 -0.09 -0.42 0.00 0.00 0.00 0.00 53.44 53.11 1y3f n ALA 88 Cb 0.61 -2.29 -0.04 0.00 0.00 0.00 0.00 19.45 17.73 1y3f n ALA 88 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1y3f s SER 89 N -1.57 6.61 -0.23 0.00 0.01 0.35 -4.97 113.70 113.90 1y3f s SER 89 Ca 0.80 0.44 -0.10 0.00 1.31 0.00 0.00 55.95 58.40 1y3f s SER 89 Cb -0.36 -2.44 -0.05 0.00 0.21 0.00 0.00 66.02 63.39 1y3f s SER 89 CO 0.43 -0.84 0.14 -0.22 0.41 0.00 0.00 173.24 173.17 1y3f s LEU 90 N 3.37 4.01 -0.15 2.44 2.96 -1.26 -0.77 118.68 129.27 1y3f s LEU 90 Ca 0.35 0.07 -0.02 0.00 -0.22 0.00 0.00 54.13 54.32 1y3f s LEU 90 Cb -0.12 -2.07 -0.01 0.00 0.50 0.00 0.00 46.19 44.48 1y3f s LEU 90 CO 0.19 0.07 -0.10 -0.31 -1.32 0.00 0.00 176.35 174.88 1y3f s TYR 91 N 1.04 2.88 -0.54 5.38 1.51 0.62 -0.01 117.35 128.23 1y3f s TYR 91 Ca 0.07 -0.66 -0.23 0.00 -1.01 0.00 0.00 57.07 55.23 1y3f s TYR 91 Cb -0.14 -1.92 0.05 0.00 -0.11 0.00 0.00 41.96 39.84 1y3f s TYR 91 CO 0.04 -0.26 0.88 0.00 -1.11 0.00 0.00 175.55 175.09 1y3f s ALA 92 N 0.61 3.21 -0.54 3.71 0.00 -0.15 -0.95 121.76 127.65 1y3f s ALA 92 Ca -0.06 -1.35 -0.06 0.00 0.00 0.00 0.00 51.96 50.49 1y3f s ALA 92 Cb -0.15 -3.66 0.14 0.00 0.00 0.00 0.00 23.12 19.45 1y3f s ALA 92 CO 0.03 -2.31 0.38 0.08 0.00 0.00 0.00 175.76 173.93 1y3f s VAL 93 N 3.68 3.90 -0.36 0.00 1.01 -0.71 -1.31 120.40 126.61 1y3f s VAL 93 Ca 0.27 -2.33 -0.25 0.00 0.00 0.00 0.00 61.98 59.68 1y3f s VAL 93 Cb -0.14 -3.57 0.01 0.00 0.00 0.00 0.00 36.38 32.68 1y3f s VAL 93 CO 0.18 -0.81 0.86 -0.75 0.00 0.00 0.00 175.10 174.57 1y3f s LYS 94 N 0.70 3.80 0.00 2.72 2.20 -0.08 -1.66 119.74 127.42 1y3f s LYS 94 Ca 0.11 0.46 0.00 0.00 -0.36 0.00 0.00 55.97 56.18 1y3f s LYS 94 Cb -0.22 -3.80 0.00 0.00 -1.51 0.00 0.00 37.83 32.30 1y3f s LYS 94 CO -0.03 -0.89 0.30 1.33 -0.36 0.00 0.00 175.35 175.70 1y3f n VAL 95 N 5.87 0.00 -4.96 4.02 0.24 0.66 -0.19 118.33 123.97 1y3f n VAL 95 Ca 0.05 -0.37 -0.28 0.00 -2.04 0.00 0.00 64.34 61.70 1y3f n VAL 95 Cb 0.48 1.21 -0.15 0.00 -1.47 0.00 0.00 33.84 33.91 1y3f n VAL 95 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1y3f s LEU 96 N -0.27 2.11 0.00 1.34 1.43 -0.85 -4.33 118.68 118.11 1y3f s LEU 96 Ca 0.00 -0.49 -0.04 0.00 -1.03 0.00 0.00 54.13 52.57 1y3f s LEU 96 Cb 0.00 -1.16 0.10 0.00 0.03 0.00 0.00 46.19 45.16 1y3f s LEU 96 CO 0.00 0.25 0.65 0.61 0.23 0.00 0.00 176.35 178.08 1y3f n GLY 97 N 2.16 -0.27 0.42 -3.19 0.00 -0.57 -4.36 105.19 99.38 1y3f n GLY 97 Ca -0.16 -1.85 0.23 0.00 0.00 0.00 0.00 46.02 44.23 1y3f n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y3f h ALA 98 N -1.18 2.32 -0.04 4.61 0.00 -1.89 0.23 119.26 123.31 1y3f h ALA 98 Ca -0.21 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1y3f h ALA 98 Cb 0.67 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1y3f h ALA 98 CO 0.18 -0.68 0.00 -0.40 0.00 0.00 0.00 179.25 178.35 1y3f n ASP 99 N -4.54 0.39 0.00 0.00 5.75 -1.26 -4.20 116.55 112.69 1y3f n ASP 99 Ca 0.23 -1.48 0.00 0.00 -0.01 0.00 0.00 54.79 53.53 1y3f n ASP 99 Cb 0.86 -0.02 0.00 0.00 -1.03 0.00 0.00 41.12 40.93 1y3f n ASP 99 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1y3f n GLY 100 N 0.87 0.60 3.38 6.12 0.00 0.80 -5.04 105.19 111.92 1y3f n GLY 100 Ca 0.14 -0.09 -0.24 0.00 0.00 0.00 0.00 46.02 45.83 1y3f n GLY 100 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1y3f s SER 101 N -2.08 3.02 0.00 1.61 0.15 -1.26 -4.87 113.70 110.27 1y3f s SER 101 Ca 0.00 -0.87 -0.12 0.00 0.70 0.00 0.00 55.95 55.65 1y3f s SER 101 Cb 0.00 -0.20 0.02 0.00 -1.71 0.00 0.00 66.02 64.12 1y3f s SER 101 CO 0.00 0.03 0.26 -0.83 1.20 0.00 0.00 173.24 173.90 1y3f s GLY 102 N -2.71 -0.09 0.47 9.45 0.00 -1.26 -1.51 107.32 111.67 1y3f s GLY 102 Ca 0.18 0.13 -0.20 0.00 0.00 0.00 0.00 44.72 44.83 1y3f s GLY 102 CO 0.08 -0.06 1.02 1.20 0.00 0.00 0.00 173.10 175.34 1y3f s GLN 103 N -1.58 3.90 0.28 2.90 -1.52 -1.26 -4.94 119.66 117.44 1y3f s GLN 103 Ca -0.12 1.30 0.03 0.00 -1.95 0.00 0.00 55.36 54.62 1y3f s GLN 103 Cb -0.05 -2.11 0.66 0.00 -0.22 0.00 0.00 33.01 31.29 1y3f s GLN 103 CO 0.02 -0.34 1.74 1.88 -0.25 0.00 0.00 175.29 178.34 1y3f h TYR 104 N 1.62 0.81 -0.11 0.91 -1.99 -2.00 0.53 116.97 116.75 1y3f h TYR 104 Ca -0.49 0.04 -0.05 0.00 2.00 0.00 0.00 58.73 60.22 1y3f h TYR 104 Cb 1.21 -0.22 -0.01 0.00 2.00 0.00 0.00 36.73 39.71 1y3f h TYR 104 CO 0.58 0.11 -0.17 0.66 -0.00 0.00 0.00 178.16 179.35 1y3f h SER 105 N 0.58 0.17 -0.46 3.88 4.64 -1.99 -0.98 113.55 119.39 1y3f h SER 105 Ca 0.53 -0.04 -0.06 0.00 -0.47 0.00 0.00 61.79 61.76 1y3f h SER 105 Cb 0.88 -0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 62.90 1y3f h SER 105 CO -0.43 0.35 0.07 -0.50 -0.87 0.00 0.00 176.83 175.46 1y3f h TRP 106 N 0.17 0.82 -0.32 4.77 6.55 -1.20 0.40 115.95 127.14 1y3f h TRP 106 Ca 0.03 -0.12 -0.02 0.00 0.95 0.00 0.00 58.89 59.74 1y3f h TRP 106 Cb 0.40 -0.22 -0.01 0.00 -0.86 0.00 0.00 29.16 28.46 1y3f h TRP 106 CO 0.00 0.77 0.14 0.82 -1.05 0.00 0.00 178.44 179.12 1y3f h ILE 107 N 0.64 1.18 -0.73 1.49 5.03 -1.13 -1.29 117.51 122.69 1y3f h ILE 107 Ca 0.14 -0.53 -0.02 0.00 -0.12 0.00 0.00 64.86 64.33 1y3f h ILE 107 Cb 0.39 0.93 -0.03 0.00 -3.03 0.00 0.00 36.82 35.08 1y3f h ILE 107 CO 0.01 0.19 0.38 0.40 -0.68 0.00 0.00 178.15 178.45 1y3f h ILE 108 N 0.37 1.23 -0.87 -0.67 2.04 -1.06 -0.04 117.51 118.50 1y3f h ILE 108 Ca 0.11 -0.60 -0.01 0.00 1.00 0.00 0.00 64.86 65.36 1y3f h ILE 108 Cb 0.17 0.29 -0.04 0.00 -0.74 0.00 0.00 36.82 36.49 1y3f h ILE 108 CO -0.01 0.26 0.49 0.78 0.00 0.00 0.00 178.15 179.67 1y3f h ASN 109 N 1.01 1.08 -0.62 1.72 2.35 -0.61 -0.35 115.58 120.15 1y3f h ASN 109 Ca 0.25 -0.08 -0.05 0.00 -0.55 0.00 0.00 56.30 55.87 1y3f h ASN 109 Cb 0.07 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.14 1y3f h ASN 109 CO -0.04 0.85 0.20 1.23 -1.65 0.00 0.00 177.43 178.02 1y3f h GLY 110 N 1.23 1.03 0.96 2.83 0.00 -0.46 -0.07 103.07 108.59 1y3f h GLY 110 Ca 0.31 -0.61 -0.01 0.00 0.00 0.00 0.00 47.33 47.02 1y3f h GLY 110 CO -0.05 0.57 0.20 -2.22 0.00 0.00 0.00 176.54 175.04 1y3f h ILE 111 N 0.88 1.17 -0.58 2.60 2.04 -0.56 -0.94 117.51 122.12 1y3f h ILE 111 Ca 0.20 -0.46 0.05 0.00 1.00 0.00 0.00 64.86 65.66 1y3f h ILE 111 Cb 0.28 0.73 -0.05 0.00 -0.74 0.00 0.00 36.82 37.04 1y3f h ILE 111 CO -0.01 0.18 0.30 -0.33 0.00 0.00 0.00 178.15 178.29 1y3f h GLU 112 N 0.51 0.56 -0.79 2.37 4.39 -0.91 -1.17 114.58 119.55 1y3f h GLU 112 Ca 0.14 -0.03 0.09 0.00 0.34 0.00 0.00 59.36 59.89 1y3f h GLU 112 Cb 0.10 -0.13 -0.07 0.00 -0.10 0.00 0.00 28.75 28.55 1y3f h GLU 112 CO -0.02 0.37 0.44 2.35 -1.16 0.00 0.00 179.01 180.99 1y3f h TRP 113 N 0.58 0.80 -0.57 4.33 7.01 -0.77 -0.12 115.95 127.21 1y3f h TRP 113 Ca 0.26 0.03 -0.09 0.00 2.11 0.00 0.00 58.89 61.20 1y3f h TRP 113 Cb 0.17 -0.24 -0.02 0.00 -2.10 0.00 0.00 29.16 26.96 1y3f h TRP 113 CO -0.10 0.34 -0.00 0.00 -2.79 0.00 0.00 178.44 175.89 1y3f h ALA 114 N 1.43 0.76 -0.09 2.65 0.00 -0.41 0.46 119.26 124.07 1y3f h ALA 114 Ca 0.37 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1y3f h ALA 114 Cb 0.33 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 1y3f h ALA 114 CO -0.24 0.60 0.01 0.82 0.00 0.00 0.00 179.25 180.44 1y3f h ILE 115 N 0.89 1.21 0.00 0.00 2.04 -0.79 -2.08 117.51 118.78 1y3f h ILE 115 Ca 0.16 -0.66 -0.02 0.00 1.00 0.00 0.00 64.86 65.34 1y3f h ILE 115 Cb 0.55 1.50 -0.00 0.00 -0.74 0.00 0.00 36.82 38.12 1y3f h ILE 115 CO 0.03 0.19 -0.09 0.00 0.00 0.00 0.00 178.15 178.27 1y3f h ALA 116 N 0.78 1.66 -0.57 1.87 0.00 -0.65 -1.97 119.26 120.38 1y3f h ALA 116 Ca 0.03 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1y3f h ALA 116 Cb 0.28 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1y3f h ALA 116 CO 0.00 0.12 0.00 0.09 0.00 0.00 0.00 179.25 179.46 1y3f n ASN 117 N -4.15 4.55 -3.41 0.00 3.02 0.12 -4.97 115.26 110.42 1y3f n ASN 117 Ca -0.03 -2.51 -0.24 0.00 -0.03 0.00 0.00 54.58 51.77 1y3f n ASN 117 Cb 0.18 -0.58 0.05 0.00 -0.61 0.00 0.00 39.78 38.81 1y3f n ASN 117 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1y3f n ASN 118 N 0.89 -5.82 -4.77 6.41 3.02 -0.74 -4.95 115.26 109.29 1y3f n ASN 118 Ca 0.24 -0.47 -0.40 0.00 -0.03 0.00 0.00 54.58 53.91 1y3f n ASN 118 Cb 0.88 -4.65 -0.00 0.00 -0.61 0.00 0.00 39.78 35.40 1y3f n ASN 118 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1y3f s MET 119 N -6.11 4.06 0.05 3.52 -1.94 -0.81 -4.86 119.30 113.22 1y3f s MET 119 Ca 0.48 2.38 0.11 0.00 -1.71 0.00 0.00 55.69 56.95 1y3f s MET 119 Cb -0.22 -2.89 -0.19 0.00 2.01 0.00 0.00 34.83 33.54 1y3f s MET 119 CO 0.59 -0.50 0.96 -0.44 -0.01 0.00 0.00 175.02 175.62 1y3f h ASP 120 N 2.90 0.00 -3.80 3.03 3.32 -1.13 -3.43 116.42 117.30 1y3f h ASP 120 Ca -0.50 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 56.34 1y3f h ASP 120 Cb 1.24 0.00 -0.27 0.00 0.22 0.00 0.00 39.33 40.52 1y3f h ASP 120 CO 0.64 0.91 -0.65 -0.69 -1.72 0.00 0.00 179.24 177.72 1y3f s VAL 121 N -2.70 0.00 -0.05 -1.35 1.01 -0.69 -1.36 120.40 115.26 1y3f s VAL 121 Ca -0.02 -0.04 0.05 0.00 0.00 0.00 0.00 61.98 61.98 1y3f s VAL 121 Cb 0.09 -0.10 -0.02 0.00 0.00 0.00 0.00 36.38 36.35 1y3f s VAL 121 CO 0.82 -0.02 -0.21 -0.63 0.00 0.00 0.00 175.10 175.05 1y3f s ILE 122 N -0.03 2.40 -0.14 2.22 1.01 0.20 -1.00 121.20 125.86 1y3f s ILE 122 Ca -0.01 -0.95 0.01 0.00 0.00 0.00 0.00 60.65 59.71 1y3f s ILE 122 Cb -0.01 -1.90 -0.00 0.00 0.01 0.00 0.00 42.46 40.56 1y3f s ILE 122 CO 0.00 0.57 -0.18 0.21 0.00 0.00 0.00 174.94 175.55 1y3f s ASN 123 N -0.35 3.53 -0.43 3.58 2.47 -0.36 -0.86 114.94 122.53 1y3f s ASN 123 Ca 0.02 -0.48 0.04 0.00 0.42 0.00 0.00 52.86 52.86 1y3f s ASN 123 Cb -0.12 -1.52 0.12 0.00 -1.45 0.00 0.00 41.25 38.27 1y3f s ASN 123 CO 0.02 0.12 0.16 -0.04 -3.72 0.00 0.00 177.10 173.64 1y3f s MET 124 N 0.61 1.66 -1.37 0.43 -1.94 0.34 -1.67 119.30 117.37 1y3f s MET 124 Ca -0.10 -2.19 -0.08 0.00 -1.71 0.00 0.00 55.69 51.61 1y3f s MET 124 Cb -0.16 -3.15 0.10 0.00 2.01 0.00 0.00 34.83 33.63 1y3f s MET 124 CO 0.03 -1.03 2.28 0.43 -0.01 0.00 0.00 175.02 176.72 1y3f n SER 125 N 3.71 6.76 -3.81 3.03 7.64 -1.26 -1.70 113.62 127.99 1y3f n SER 125 Ca 0.04 -3.02 -0.08 0.00 1.01 0.00 0.00 58.87 56.83 1y3f n SER 125 Cb 0.37 -1.46 -0.02 0.00 -1.01 0.00 0.00 64.21 62.09 1y3f n SER 125 CO 0.00 0.00 0.00 -1.48 -3.01 0.00 0.00 175.04 170.55 1y3f s LEU 126 N -0.73 -0.30 0.00 -3.43 0.05 -1.26 -4.84 118.68 108.18 1y3f s LEU 126 Ca 0.51 -0.54 0.00 0.00 0.05 0.00 0.00 54.13 54.15 1y3f s LEU 126 Cb 0.15 2.71 0.00 0.00 -2.05 0.00 0.00 46.19 47.00 1y3f s LEU 126 CO -0.05 -1.30 0.00 0.61 -0.55 0.00 0.00 176.35 175.05 1y3f n GLY 127 N -0.45 0.61 3.24 -3.48 0.00 -1.26 -4.52 105.19 99.33 1y3f n GLY 127 Ca -0.06 -0.97 -0.10 0.00 0.00 0.00 0.00 46.02 44.90 1y3f n GLY 127 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1y3f s GLY 128 N 0.00 -0.07 0.46 -0.02 0.00 0.09 -4.95 107.32 102.84 1y3f s GLY 128 Ca 0.00 -0.22 0.26 0.00 0.00 0.00 0.00 44.72 44.76 1y3f s GLY 128 CO 0.00 -0.43 1.86 -0.56 0.00 0.00 0.00 173.10 173.97 1y3f h PRO 129 N 2.97 0.00 -6.41 2.90 0.13 -1.96 0.40 132.00 130.03 1y3f h PRO 129 Ca -0.33 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.18 1y3f h PRO 129 Cb 1.21 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.20 1y3f h PRO 129 CO 0.49 0.18 -0.72 -1.12 -0.23 0.00 0.00 178.00 176.60 1y3f s SER 130 N -6.10 4.20 0.52 1.44 0.01 -1.26 -4.75 113.70 107.77 1y3f s SER 130 Ca 0.01 -0.63 0.01 0.00 1.31 0.00 0.00 55.95 56.64 1y3f s SER 130 Cb 0.10 -0.68 0.07 0.00 0.21 0.00 0.00 66.02 65.72 1y3f s SER 130 CO 0.62 0.09 0.49 0.61 0.41 0.00 0.00 173.24 175.45 1y3f n GLY 131 N -0.10 0.87 3.12 3.44 0.00 -1.26 -4.69 105.19 106.56 1y3f n GLY 131 Ca -0.10 -2.02 -0.10 0.00 0.00 0.00 0.00 46.02 43.81 1y3f n GLY 131 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1y3f s SER 132 N -3.00 0.16 0.29 1.61 1.04 -1.26 -5.02 113.70 107.52 1y3f s SER 132 Ca 0.33 -0.50 0.01 0.00 0.48 0.00 0.00 55.95 56.27 1y3f s SER 132 Cb -0.02 0.23 0.53 0.00 0.10 0.00 0.00 66.02 66.86 1y3f s SER 132 CO 0.22 -0.50 1.87 0.00 0.98 0.00 0.00 173.24 175.80 1y3f h ALA 133 N 3.69 1.51 -0.09 5.32 0.00 -2.00 -0.25 119.26 127.44 1y3f h ALA 133 Ca -0.32 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.44 1y3f h ALA 133 Cb 1.19 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 1y3f h ALA 133 CO 0.49 0.29 -0.58 0.00 0.00 0.00 0.00 179.25 179.45 1y3f h ALA 134 N 1.52 0.85 -0.22 0.00 0.00 -1.99 -0.71 119.26 118.71 1y3f h ALA 134 Ca 0.46 -0.53 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 1y3f h ALA 134 Cb 0.36 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1y3f h ALA 134 CO -0.21 0.71 -0.11 1.25 0.00 0.00 0.00 179.25 180.88 1y3f h LEU 135 N 0.21 0.49 -0.84 0.00 5.85 -1.77 -1.78 115.31 117.47 1y3f h LEU 135 Ca -0.00 -0.41 -0.02 0.00 0.84 0.00 0.00 57.88 58.28 1y3f h LEU 135 Cb 1.08 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 41.94 1y3f h LEU 135 CO 0.09 0.80 0.44 0.50 -0.34 0.00 0.00 178.44 179.93 1y3f h LYS 136 N 0.18 1.19 -0.69 1.25 3.64 -0.89 -1.95 116.57 119.31 1y3f h LYS 136 Ca 0.05 -0.15 -0.04 0.00 -1.27 0.00 0.00 60.65 59.23 1y3f h LYS 136 Cb 0.61 -0.23 -0.03 0.00 -0.41 0.00 0.00 32.23 32.18 1y3f h LYS 136 CO 0.03 0.89 0.26 0.00 -2.27 0.00 0.00 179.45 178.36 1y3f h ALA 137 N 1.24 1.16 -0.06 5.00 0.00 -1.04 -0.41 119.26 125.14 1y3f h ALA 137 Ca 0.29 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1y3f h ALA 137 Cb 0.06 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 1y3f h ALA 137 CO -0.04 0.60 0.01 0.00 0.00 0.00 0.00 179.25 179.82 1y3f h ALA 138 N 1.28 0.08 -0.45 0.00 0.00 -0.65 0.10 119.26 119.62 1y3f h ALA 138 Ca 0.23 -0.13 -0.11 0.00 0.00 0.00 0.00 54.91 54.90 1y3f h ALA 138 Cb 0.22 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1y3f h ALA 138 CO -0.02 -0.29 -0.16 -0.39 0.00 0.00 0.00 179.25 178.40 1y3f h VAL 139 N -0.13 1.27 -0.45 0.00 -1.51 -1.29 -1.09 116.25 113.05 1y3f h VAL 139 Ca 0.02 -1.27 -0.09 0.00 -1.23 0.00 0.00 66.70 64.13 1y3f h VAL 139 Cb 0.26 1.08 -0.02 0.00 -2.13 0.00 0.00 31.29 30.48 1y3f h VAL 139 CO 0.00 0.43 -0.07 0.44 -1.23 0.00 0.00 177.57 177.15 1y3f h ASP 140 N 0.76 0.78 -0.46 4.19 3.32 -0.98 -1.75 116.42 122.29 1y3f h ASP 140 Ca 0.12 -0.22 -0.01 0.00 0.02 0.00 0.00 57.03 56.94 1y3f h ASP 140 Cb 0.68 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 40.00 1y3f h ASP 140 CO 0.05 0.88 0.24 0.50 -1.72 0.00 0.00 179.24 179.20 1y3f h LYS 141 N 0.73 0.64 -0.34 3.56 3.64 -0.52 0.57 116.57 124.85 1y3f h LYS 141 Ca 0.13 -0.08 0.01 0.00 -1.27 0.00 0.00 60.65 59.44 1y3f h LYS 141 Cb 0.54 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.22 1y3f h LYS 141 CO 0.03 0.51 0.21 0.00 -2.27 0.00 0.00 179.45 177.94 1y3f h ALA 142 N 1.09 0.43 -0.29 5.00 0.00 -0.83 -0.19 119.26 124.46 1y3f h ALA 142 Ca 0.16 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 1y3f h ALA 142 Cb 0.06 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1y3f h ALA 142 CO -0.02 -0.13 0.11 0.28 0.00 0.00 0.00 179.25 179.49 1y3f h VAL 143 N 0.43 1.18 -0.69 0.00 2.07 -1.16 -1.46 116.25 116.63 1y3f h VAL 143 Ca 0.13 -0.55 0.15 0.00 0.82 0.00 0.00 66.70 67.24 1y3f h VAL 143 Cb -0.03 1.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.70 1y3f h VAL 143 CO -0.04 0.19 0.47 0.00 0.02 0.00 0.00 177.57 178.20 1y3f h ALA 144 N 0.96 2.24 -0.00 1.67 0.00 -0.65 -1.01 119.26 122.46 1y3f h ALA 144 Ca 0.10 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1y3f h ALA 144 Cb 0.19 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1y3f h ALA 144 CO -0.01 -0.42 -0.01 0.43 0.00 0.00 0.00 179.25 179.24 1y3f n SER 145 N -4.44 0.21 0.00 0.00 7.64 -0.10 -4.92 113.62 112.00 1y3f n SER 145 Ca 0.13 -0.89 0.00 0.00 1.01 0.00 0.00 58.87 59.12 1y3f n SER 145 Cb 0.55 -0.05 0.00 0.00 -1.01 0.00 0.00 64.21 63.71 1y3f n SER 145 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1y3f n GLY 146 N 1.09 0.77 3.76 0.23 0.00 -0.38 -5.07 105.19 105.58 1y3f n GLY 146 Ca 0.21 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.84 1y3f n GLY 146 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1y3f s VAL 147 N -2.00 4.82 -0.18 1.61 1.01 -0.59 -4.07 120.40 120.99 1y3f s VAL 147 Ca 0.00 1.38 -0.29 0.00 0.00 0.00 0.00 61.98 63.06 1y3f s VAL 147 Cb 0.00 -3.99 -0.00 0.00 0.00 0.00 0.00 36.38 32.39 1y3f s VAL 147 CO 0.00 0.41 1.07 -0.69 0.00 0.00 0.00 175.10 175.89 1y3f s VAL 148 N -0.24 4.64 -0.20 2.92 1.01 -0.46 -4.19 120.40 123.87 1y3f s VAL 148 Ca 0.33 1.96 -0.02 0.00 0.00 0.00 0.00 61.98 64.25 1y3f s VAL 148 Cb -0.19 -4.26 -0.00 0.00 0.00 0.00 0.00 36.38 31.93 1y3f s VAL 148 CO 0.19 -0.12 -0.10 -0.69 0.00 0.00 0.00 175.10 174.38 1y3f s VAL 149 N 2.90 2.92 -0.00 2.92 1.01 -1.26 -0.63 120.40 128.26 1y3f s VAL 149 Ca 0.47 -0.65 0.08 0.00 0.00 0.00 0.00 61.98 61.87 1y3f s VAL 149 Cb -0.17 -2.29 -0.02 0.00 0.00 0.00 0.00 36.38 33.90 1y3f s VAL 149 CO 0.11 0.47 -0.24 -0.69 0.00 0.00 0.00 175.10 174.75 1y3f s VAL 150 N 1.29 1.89 0.03 2.92 1.01 -0.04 -1.30 120.40 126.21 1y3f s VAL 150 Ca 0.03 -1.09 -0.09 0.00 0.00 0.00 0.00 61.98 60.84 1y3f s VAL 150 Cb -0.14 -1.59 0.00 0.00 0.00 0.00 0.00 36.38 34.66 1y3f s VAL 150 CO -0.05 0.47 0.17 0.00 0.00 0.00 0.00 175.10 175.69 1y3f s ALA 151 N -0.62 -0.32 0.38 5.51 0.00 -0.35 -0.51 121.76 125.85 1y3f s ALA 151 Ca 0.09 -0.28 -0.28 0.00 0.00 0.00 0.00 51.96 51.49 1y3f s ALA 151 Cb -0.09 0.24 -0.11 0.00 0.00 0.00 0.00 23.12 23.16 1y3f s ALA 151 CO -0.00 -0.33 1.50 0.00 0.00 0.00 0.00 175.76 176.93 1y3f s ALA 152 N -2.33 3.59 0.28 0.00 0.00 -0.69 -1.19 121.76 121.41 1y3f s ALA 152 Ca -0.07 1.60 0.20 0.00 0.00 0.00 0.00 51.96 53.69 1y3f s ALA 152 Cb -0.02 -3.62 0.93 0.00 0.00 0.00 0.00 23.12 20.41 1y3f s ALA 152 CO -0.03 -1.08 1.86 0.00 0.00 0.00 0.00 175.76 176.51 1y3f h ALA 153 N 3.04 1.16 0.00 0.00 0.00 -1.08 -3.40 119.26 118.99 1y3f h ALA 153 Ca -0.51 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.14 1y3f h ALA 153 Cb 1.24 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1y3f h ALA 153 CO 0.65 0.36 0.00 0.41 0.00 0.00 0.00 179.25 180.66 1y3f n GLY 154 N -0.19 2.94 2.20 0.00 0.00 -1.26 -1.10 105.19 107.78 1y3f n GLY 154 Ca -0.01 -1.99 -0.26 0.00 0.00 0.00 0.00 46.02 43.76 1y3f n GLY 154 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1y3f n ASN 155 N 0.00 5.26 -0.27 1.61 3.02 -1.26 -0.92 115.26 122.70 1y3f n ASN 155 Ca 0.00 -3.75 0.12 0.00 -0.03 0.00 0.00 54.58 50.92 1y3f n ASN 155 Cb 0.00 -0.46 0.26 0.00 -0.61 0.00 0.00 39.78 38.97 1y3f n ASN 155 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1y3f n GLU 156 N -0.67 0.80 0.00 3.52 -0.58 -0.91 -4.77 120.64 118.04 1y3f n GLU 156 Ca 0.45 -0.53 0.00 0.00 -0.42 0.00 0.00 57.16 56.66 1y3f n GLU 156 Cb 0.83 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 30.21 1y3f n GLU 156 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1y3f n GLY 157 N 1.38 0.79 3.94 0.62 0.00 0.18 -4.79 105.19 107.32 1y3f n GLY 157 Ca 0.11 -0.72 -0.24 0.00 0.00 0.00 0.00 46.02 45.17 1y3f n GLY 157 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1y3f s THR 158 N 0.00 5.14 -0.46 2.61 -4.23 -1.26 -3.89 115.64 113.55 1y3f s THR 158 Ca 0.00 -0.53 0.07 0.00 -1.18 0.00 0.00 61.69 60.05 1y3f s THR 158 Cb 0.00 -3.85 0.24 0.00 1.34 0.00 0.00 72.50 70.23 1y3f s THR 158 CO 0.00 -0.48 0.75 -0.24 -0.54 0.00 0.00 174.62 174.11 1y3f n SER 159 N -1.60 -1.87 0.00 3.99 2.88 -1.26 -5.08 113.62 110.68 1y3f n SER 159 Ca -0.05 -3.07 0.00 0.00 -1.33 0.00 0.00 58.87 54.41 1y3f n SER 159 Cb 0.56 0.97 0.00 0.00 -0.75 0.00 0.00 64.21 64.99 1y3f n SER 159 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1y3f n GLY 160 N 1.64 3.55 1.09 0.46 0.00 -1.26 -1.67 105.19 109.00 1y3f n GLY 160 Ca 0.14 -0.07 0.11 0.00 0.00 0.00 0.00 46.02 46.19 1y3f n GLY 160 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1y3f n SER 161 N 7.84 3.42 -4.81 1.61 7.64 -1.26 -4.98 113.62 123.08 1y3f n SER 161 Ca 0.00 -1.96 -0.34 0.00 1.01 0.00 0.00 58.87 57.57 1y3f n SER 161 Cb 0.00 -0.28 -0.07 0.00 -1.01 0.00 0.00 64.21 62.85 1y3f n SER 161 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1y3f s SER 162 N -1.30 7.09 0.27 6.43 0.01 -0.67 -5.04 113.70 120.49 1y3f s SER 162 Ca 0.37 1.74 -0.29 0.00 1.31 0.00 0.00 55.95 59.08 1y3f s SER 162 Cb 0.21 -2.55 -0.09 0.00 0.21 0.00 0.00 66.02 63.80 1y3f s SER 162 CO 0.29 -0.25 1.21 -0.55 0.41 0.00 0.00 173.24 174.36 1y3f s SER 163 N -1.97 7.03 -0.03 2.44 0.15 -1.26 -4.45 113.70 115.61 1y3f s SER 163 Ca 0.57 2.42 0.06 0.00 0.70 0.00 0.00 55.95 59.71 1y3f s SER 163 Cb -0.13 -2.63 0.13 0.00 -1.71 0.00 0.00 66.02 61.69 1y3f s SER 163 CO 0.17 -0.36 1.10 0.35 1.20 0.00 0.00 173.24 175.70 1y3f n THR 164 N 1.44 1.21 -2.05 6.45 -2.24 0.83 -4.98 114.28 114.95 1y3f n THR 164 Ca 0.01 -1.25 -0.42 0.00 -2.27 0.00 0.00 64.05 60.12 1y3f n THR 164 Cb 0.43 0.34 -0.03 0.00 -2.10 0.00 0.00 70.33 68.97 1y3f n THR 164 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1y3f s VAL 165 N -1.40 2.94 0.49 2.28 1.01 -1.18 -4.61 120.40 119.92 1y3f s VAL 165 Ca 0.12 0.68 -0.01 0.00 0.00 0.00 0.00 61.98 62.76 1y3f s VAL 165 Cb 0.09 -3.43 0.10 0.00 0.00 0.00 0.00 36.38 33.13 1y3f s VAL 165 CO 0.04 0.05 0.67 0.61 0.00 0.00 0.00 175.10 176.47 1y3f n GLY 166 N 3.60 0.47 3.80 4.51 0.00 -0.26 -4.69 105.19 112.61 1y3f n GLY 166 Ca 0.13 -1.97 -0.32 0.00 0.00 0.00 0.00 46.02 43.85 1y3f n GLY 166 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1y3f s TYR 167 N -2.01 3.29 -1.83 1.61 2.02 0.13 -0.03 117.35 120.52 1y3f s TYR 167 Ca 0.43 0.18 0.31 0.00 -0.37 0.00 0.00 57.07 57.62 1y3f s TYR 167 Cb -0.02 -1.71 1.60 0.00 -0.40 0.00 0.00 41.96 41.43 1y3f s TYR 167 CO 0.29 0.55 2.07 -0.35 -1.57 0.00 0.00 175.55 176.54 1y3f n PRO 168 N 0.89 0.86 -0.24 -1.71 -0.04 -1.26 -0.73 135.00 132.76 1y3f n PRO 168 Ca -0.11 -0.13 0.18 0.00 -0.04 0.00 0.00 63.50 63.39 1y3f n PRO 168 Cb 0.52 -1.50 0.49 0.00 -0.04 0.00 0.00 33.50 32.98 1y3f n PRO 168 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1y3f h GLY 169 N 4.98 0.90 2.00 0.55 0.00 -1.70 -1.87 103.07 107.93 1y3f h GLY 169 Ca 0.00 -0.20 -0.01 0.00 0.00 0.00 0.00 47.33 47.12 1y3f h GLY 169 CO 0.00 0.01 -0.04 1.70 0.00 0.00 0.00 176.54 178.21 1y3f h LYS 170 N 0.45 0.00 -6.68 4.80 3.64 -0.73 -3.37 116.57 114.68 1y3f h LYS 170 Ca 0.46 0.00 -0.53 0.00 -1.27 0.00 0.00 60.65 59.31 1y3f h LYS 170 Cb 1.07 0.00 0.04 0.00 -0.41 0.00 0.00 32.23 32.93 1y3f h LYS 170 CO -0.18 0.04 0.72 0.71 -2.27 0.00 0.00 179.45 178.47 1y3f s TYR 171 N -3.84 3.16 0.43 1.91 2.02 -0.71 -4.92 117.35 115.40 1y3f s TYR 171 Ca -0.01 1.06 0.21 0.00 -0.37 0.00 0.00 57.07 57.96 1y3f s TYR 171 Cb 0.10 -3.72 1.17 0.00 -0.40 0.00 0.00 41.96 39.11 1y3f s TYR 171 CO 0.53 -2.36 1.80 -1.35 -1.57 0.00 0.00 175.55 172.60 1y3f h PRO 172 N 5.60 0.32 0.00 -1.71 0.11 -1.89 -1.30 132.00 133.13 1y3f h PRO 172 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1y3f h PRO 172 Cb 1.21 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1y3f h PRO 172 CO 0.80 0.21 0.00 -1.13 -0.21 0.00 0.00 178.00 177.67 1y3f n SER 173 N -4.53 0.52 -4.69 -2.05 3.41 -1.26 -4.75 113.62 100.27 1y3f n SER 173 Ca 0.24 0.59 -0.35 0.00 -0.26 0.00 0.00 58.87 59.08 1y3f n SER 173 Cb 0.88 -0.71 -0.09 0.00 -0.26 0.00 0.00 64.21 64.03 1y3f n SER 173 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1y3f s VAL 174 N -3.15 4.46 -0.32 -3.33 1.01 -0.49 -4.71 120.40 113.86 1y3f s VAL 174 Ca 0.08 -0.19 -0.26 0.00 0.00 0.00 0.00 61.98 61.62 1y3f s VAL 174 Cb 0.12 -2.90 0.01 0.00 0.00 0.00 0.00 36.38 33.61 1y3f s VAL 174 CO 0.46 0.59 0.90 -0.63 0.00 0.00 0.00 175.10 176.43 1y3f s ILE 175 N -0.74 4.66 -0.22 2.22 1.01 -0.42 -4.80 121.20 122.91 1y3f s ILE 175 Ca 0.12 1.34 -0.18 0.00 0.00 0.00 0.00 60.65 61.93 1y3f s ILE 175 Cb -0.12 -4.27 -0.03 0.00 0.01 0.00 0.00 42.46 38.06 1y3f s ILE 175 CO 0.02 -0.38 0.53 0.00 0.00 0.00 0.00 174.94 175.11 1y3f s ALA 176 N 3.27 3.56 -0.20 9.38 0.00 -1.26 -1.21 121.76 135.31 1y3f s ALA 176 Ca 0.37 -0.46 -0.03 0.00 0.00 0.00 0.00 51.96 51.84 1y3f s ALA 176 Cb -0.13 -2.86 -0.01 0.00 0.00 0.00 0.00 23.12 20.12 1y3f s ALA 176 CO 0.15 -0.57 -0.07 0.08 0.00 0.00 0.00 175.76 175.35 1y3f s VAL 177 N 1.92 3.25 0.54 0.00 1.01 -0.33 -1.38 120.40 125.42 1y3f s VAL 177 Ca 0.23 -0.55 0.07 0.00 0.00 0.00 0.00 61.98 61.73 1y3f s VAL 177 Cb -0.15 -2.45 0.06 0.00 0.00 0.00 0.00 36.38 33.83 1y3f s VAL 177 CO 0.09 0.46 0.74 -0.83 0.00 0.00 0.00 175.10 175.56 1y3f s GLY 178 N 1.18 1.82 -0.12 4.51 0.00 -0.21 -0.53 107.32 113.97 1y3f s GLY 178 Ca 0.02 -1.82 -0.01 0.00 0.00 0.00 0.00 44.72 42.91 1y3f s GLY 178 CO -0.02 -1.46 -0.07 0.00 0.00 0.00 0.00 173.10 171.55 1y3f s ALA 179 N -2.64 2.90 0.36 3.20 0.00 -1.26 -1.29 121.76 123.03 1y3f s ALA 179 Ca 0.60 -0.86 0.09 0.00 0.00 0.00 0.00 51.96 51.78 1y3f s ALA 179 Cb -0.08 -1.36 -0.07 0.00 0.00 0.00 0.00 23.12 21.62 1y3f s ALA 179 CO 0.38 0.35 -0.05 0.14 0.00 0.00 0.00 175.76 176.57 1y3f s VAL 180 N -0.04 2.24 0.00 0.00 -7.23 -0.61 -0.98 120.40 113.78 1y3f s VAL 180 Ca -0.00 -2.11 0.00 0.00 -1.81 0.00 0.00 61.98 58.06 1y3f s VAL 180 Cb -0.13 -2.76 0.00 0.00 0.56 0.00 0.00 36.38 34.05 1y3f s VAL 180 CO 0.03 -0.15 0.00 -0.90 -0.31 0.00 0.00 175.10 173.77 1y3f n ASP 181 N -0.87 0.00 0.09 4.85 5.68 -0.28 -0.81 116.55 125.21 1y3f n ASP 181 Ca -0.05 -0.98 0.09 0.00 -0.50 0.00 0.00 54.79 53.36 1y3f n ASP 181 Cb 0.64 0.00 0.41 0.00 -1.14 0.00 0.00 41.12 41.03 1y3f n ASP 181 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 1y3f n SER 182 N -2.94 0.41 -1.37 -1.12 3.41 -1.26 -1.02 113.62 109.73 1y3f n SER 182 Ca 0.00 0.62 0.12 0.00 -0.26 0.00 0.00 58.87 59.35 1y3f n SER 182 Cb 0.00 -0.70 0.32 0.00 -0.26 0.00 0.00 64.21 63.57 1y3f n SER 182 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1y3f n SER 183 N -1.97 3.97 -1.09 4.04 3.41 -1.26 -4.95 113.62 115.78 1y3f n SER 183 Ca 0.02 -2.00 -0.14 0.00 -0.26 0.00 0.00 58.87 56.49 1y3f n SER 183 Cb 0.16 -0.49 -0.06 0.00 -0.26 0.00 0.00 64.21 63.56 1y3f n SER 183 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1y3f n ASN 184 N 1.67 -4.70 -4.78 4.04 3.02 -0.19 -5.01 115.26 109.33 1y3f n ASN 184 Ca 0.25 0.35 -0.39 0.00 -0.03 0.00 0.00 54.58 54.75 1y3f n ASN 184 Cb 0.63 -3.45 -0.06 0.00 -0.61 0.00 0.00 39.78 36.29 1y3f n ASN 184 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1y3f s GLN 185 N -3.21 4.37 0.32 3.52 -1.52 -1.26 -4.79 119.66 117.08 1y3f s GLN 185 Ca 0.00 0.89 -0.29 0.00 -1.95 0.00 0.00 55.36 54.01 1y3f s GLN 185 Cb 0.00 -3.29 -0.11 0.00 -0.22 0.00 0.00 33.01 29.39 1y3f s GLN 185 CO 0.00 0.50 1.47 0.50 -0.25 0.00 0.00 175.29 177.51 1y3f s ARG 186 N -0.71 4.19 0.44 2.91 3.52 -1.26 -1.12 118.95 126.91 1y3f s ARG 186 Ca 0.33 2.45 -0.24 0.00 -0.13 0.00 0.00 55.73 58.14 1y3f s ARG 186 Cb -0.20 -3.03 -0.08 0.00 -1.56 0.00 0.00 34.95 30.08 1y3f s ARG 186 CO 0.21 -0.47 1.18 0.00 -0.81 0.00 0.00 175.30 175.41 1y3f s ALA 187 N -0.58 3.04 0.42 6.12 0.00 -0.15 -4.83 121.76 125.77 1y3f s ALA 187 Ca 0.56 0.98 0.16 0.00 0.00 0.00 0.00 51.96 53.66 1y3f s ALA 187 Cb -0.45 -3.40 0.99 0.00 0.00 0.00 0.00 23.12 20.27 1y3f s ALA 187 CO 0.53 -0.66 1.95 0.66 0.00 0.00 0.00 175.76 178.24 1y3f h SER 188 N 2.25 0.00 1.10 0.00 4.64 -1.92 -1.34 113.55 118.28 1y3f h SER 188 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 1y3f h SER 188 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1y3f h SER 188 CO 0.61 0.23 0.00 2.22 -0.87 0.00 0.00 176.83 179.02 1y3f n PHE 189 N -4.14 0.82 -1.99 4.77 1.16 -1.26 -4.33 117.46 112.49 1y3f n PHE 189 Ca -0.02 0.28 -0.42 0.00 -1.87 0.00 0.00 57.45 55.41 1y3f n PHE 189 Cb 0.29 -0.95 -0.03 0.00 -1.61 0.00 0.00 39.48 37.19 1y3f n PHE 189 CO 0.00 0.00 0.00 0.45 -1.87 0.00 0.00 176.76 175.34 1y3f s SER 190 N -4.31 6.65 0.93 5.98 0.15 -0.51 -0.65 113.70 121.95 1y3f s SER 190 Ca 0.08 2.44 -0.10 0.00 0.70 0.00 0.00 55.95 59.07 1y3f s SER 190 Cb 0.11 -2.57 0.15 0.00 -1.71 0.00 0.00 66.02 62.01 1y3f s SER 190 CO 0.50 -0.84 1.13 -1.20 1.20 0.00 0.00 173.24 174.03 1y3f n SER 191 N 5.20 0.21 -4.12 5.45 7.64 -0.10 -3.78 113.62 124.13 1y3f n SER 191 Ca 0.15 0.40 -0.08 0.00 1.01 0.00 0.00 58.87 60.34 1y3f n SER 191 Cb 0.41 -1.47 -0.10 0.00 -1.01 0.00 0.00 64.21 62.04 1y3f n SER 191 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 1y3f s VAL 192 N -2.63 0.22 0.00 0.44 -7.23 -1.25 -4.88 120.40 105.07 1y3f s VAL 192 Ca 0.67 -1.86 0.00 0.00 -1.81 0.00 0.00 61.98 58.98 1y3f s VAL 192 Cb -0.23 -1.73 0.00 0.00 0.56 0.00 0.00 36.38 34.98 1y3f s VAL 192 CO 0.58 -0.79 0.00 0.61 -0.31 0.00 0.00 175.10 175.19 1y3f n GLY 193 N 0.02 3.24 0.18 2.32 0.00 -0.44 -0.12 105.19 110.40 1y3f n GLY 193 Ca -0.11 -1.59 0.14 0.00 0.00 0.00 0.00 46.02 44.46 1y3f n GLY 193 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1y3f h PRO 194 N 0.00 0.00 -0.00 1.61 0.13 -1.88 -1.92 132.00 129.94 1y3f h PRO 194 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1y3f h PRO 194 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1y3f h PRO 194 CO 0.00 0.00 -0.06 0.39 -0.23 0.00 0.00 178.00 178.10 1y3f n GLU 195 N -2.48 0.14 -1.96 0.86 4.71 -1.26 -4.79 120.64 115.87 1y3f n GLU 195 Ca 0.01 -0.02 -0.42 0.00 -0.01 0.00 0.00 57.16 56.72 1y3f n GLU 195 Cb 0.21 -1.50 -0.03 0.00 -1.01 0.00 0.00 31.44 29.11 1y3f n GLU 195 CO 0.00 0.00 0.00 -1.17 0.09 0.00 0.00 177.13 176.05 1y3f s LEU 196 N -2.87 4.35 -0.16 -4.62 2.96 -0.72 -4.46 118.68 113.15 1y3f s LEU 196 Ca 0.18 2.35 -0.14 0.00 -0.22 0.00 0.00 54.13 56.30 1y3f s LEU 196 Cb 0.19 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 43.29 1y3f s LEU 196 CO 0.53 -0.92 -0.27 -0.67 -1.32 0.00 0.00 176.35 173.70 1y3f n ASP 197 N 6.67 1.88 -4.19 3.68 2.03 -0.48 -4.23 116.55 121.91 1y3f n ASP 197 Ca 0.17 0.47 -0.12 0.00 0.52 0.00 0.00 54.79 55.83 1y3f n ASP 197 Cb 0.42 -0.80 -0.10 0.00 -0.72 0.00 0.00 41.12 39.92 1y3f n ASP 197 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 1y3f s VAL 198 N -2.60 0.01 0.19 5.18 -7.23 -1.12 -0.09 120.40 114.74 1y3f s VAL 198 Ca -0.23 -1.97 0.11 0.00 -1.81 0.00 0.00 61.98 58.08 1y3f s VAL 198 Cb 0.03 -2.45 -0.04 0.00 0.56 0.00 0.00 36.38 34.48 1y3f s VAL 198 CO 0.34 -0.04 -0.23 -0.04 -0.31 0.00 0.00 175.10 174.82 1y3f s MET 199 N -4.15 1.49 0.21 4.82 -1.94 -0.03 -1.05 119.30 118.67 1y3f s MET 199 Ca 0.37 -1.52 -0.12 0.00 -1.71 0.00 0.00 55.69 52.71 1y3f s MET 199 Cb 0.07 -1.78 -0.00 0.00 2.01 0.00 0.00 34.83 35.13 1y3f s MET 199 CO 0.11 0.38 0.43 0.00 -0.01 0.00 0.00 175.02 175.93 1y3f s ALA 200 N -1.74 -0.27 0.19 3.03 0.00 -0.41 -1.96 121.76 120.60 1y3f s ALA 200 Ca 0.20 -0.78 -0.32 0.00 0.00 0.00 0.00 51.96 51.07 1y3f s ALA 200 Cb -0.08 0.98 -0.12 0.00 0.00 0.00 0.00 23.12 23.91 1y3f s ALA 200 CO 0.10 -0.78 1.74 -2.14 0.00 0.00 0.00 175.76 174.67 1y3f s PRO 201 N -3.98 4.13 0.00 0.00 0.02 -1.26 -1.57 135.00 132.34 1y3f s PRO 201 Ca 0.19 2.60 0.12 0.00 0.02 0.00 0.00 61.00 63.93 1y3f s PRO 201 Cb 0.01 -3.18 0.19 0.00 0.02 0.00 0.00 34.50 31.54 1y3f s PRO 201 CO 0.04 -0.77 1.04 0.41 -0.33 0.00 0.00 177.00 177.39 1y3f n GLY 202 N 4.03 0.76 3.05 0.52 0.00 0.01 -3.30 105.19 110.27 1y3f n GLY 202 Ca 0.16 -0.38 -0.29 0.00 0.00 0.00 0.00 46.02 45.51 1y3f n GLY 202 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1y3f s VAL 203 N 0.00 1.50 -1.20 1.61 1.01 -1.23 -1.01 120.40 121.07 1y3f s VAL 203 Ca 0.15 -0.64 -0.01 0.00 0.00 0.00 0.00 61.98 61.48 1y3f s VAL 203 Cb 0.18 -1.37 -0.01 0.00 0.00 0.00 0.00 36.38 35.18 1y3f s VAL 203 CO -0.08 0.44 0.94 -0.24 0.00 0.00 0.00 175.10 176.16 1y3f n SER 204 N 4.22 -2.41 -4.51 3.32 2.88 -1.11 -4.81 113.62 111.19 1y3f n SER 204 Ca -0.19 -0.67 -0.43 0.00 -1.33 0.00 0.00 58.87 56.26 1y3f n SER 204 Cb 0.51 -4.94 -0.08 0.00 -0.75 0.00 0.00 64.21 58.96 1y3f n SER 204 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 1y3f s ILE 205 N -3.42 4.97 0.12 2.46 -1.09 -0.13 -4.80 121.20 119.32 1y3f s ILE 205 Ca 0.05 -0.01 -0.30 0.00 -2.23 0.00 0.00 60.65 58.16 1y3f s ILE 205 Cb -0.01 -4.09 -0.07 0.00 -1.58 0.00 0.00 42.46 36.71 1y3f s ILE 205 CO 0.75 -0.45 1.21 -1.10 -1.23 0.00 0.00 174.94 174.12 1y3f s GLN 206 N 2.47 4.45 0.36 2.79 -1.52 -1.26 -1.29 119.66 125.66 1y3f s GLN 206 Ca 0.18 1.84 -0.13 0.00 -1.95 0.00 0.00 55.36 55.30 1y3f s GLN 206 Cb -0.15 -3.29 0.05 0.00 -0.22 0.00 0.00 33.01 29.40 1y3f s GLN 206 CO 0.16 -0.19 0.72 0.45 -0.25 0.00 0.00 175.29 176.17 1y3f n SER 207 N 3.29 -2.08 -4.77 5.90 2.88 -0.59 -4.85 113.62 113.41 1y3f n SER 207 Ca 0.07 -2.47 -0.40 0.00 -1.33 0.00 0.00 58.87 54.74 1y3f n SER 207 Cb 0.45 3.47 -0.02 0.00 -0.75 0.00 0.00 64.21 67.36 1y3f n SER 207 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1y3f s THR 208 N -2.20 2.95 0.10 2.46 -4.23 -1.26 -1.38 115.64 112.08 1y3f s THR 208 Ca 0.15 0.92 0.06 0.00 -1.18 0.00 0.00 61.69 61.64 1y3f s THR 208 Cb -0.04 -3.57 -0.03 0.00 1.34 0.00 0.00 72.50 70.19 1y3f s THR 208 CO 0.11 0.19 -0.14 -0.76 -0.54 0.00 0.00 174.62 173.49 1y3f s LEU 209 N -1.88 2.35 0.60 4.79 1.43 0.42 -2.39 118.68 124.00 1y3f s LEU 209 Ca 0.50 -0.74 -0.19 0.00 -1.03 0.00 0.00 54.13 52.67 1y3f s LEU 209 Cb -0.36 -0.53 -0.04 0.00 0.03 0.00 0.00 46.19 45.28 1y3f s LEU 209 CO 0.48 -0.12 1.09 -2.65 0.23 0.00 0.00 176.35 175.37 1y3f n PRO 210 N 0.83 1.07 -2.74 1.29 -0.02 -1.26 -1.55 135.00 132.61 1y3f n PRO 210 Ca -0.18 0.41 -0.06 0.00 -2.02 0.00 0.00 63.50 61.65 1y3f n PRO 210 Cb 0.56 -2.29 0.02 0.00 -0.02 0.00 0.00 33.50 31.77 1y3f n PRO 210 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1y3f n GLY 211 N 1.14 0.55 3.67 -1.23 0.00 -1.26 -3.86 105.19 104.20 1y3f n GLY 211 Ca 0.13 -0.45 -0.21 0.00 0.00 0.00 0.00 46.02 45.49 1y3f n GLY 211 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1y3f n ASN 212 N 0.38 -1.48 -4.68 1.61 5.15 -1.22 -5.00 115.26 110.02 1y3f n ASN 212 Ca -0.00 -0.81 -0.31 0.00 -0.60 0.00 0.00 54.58 52.85 1y3f n ASN 212 Cb 0.52 -4.12 -0.09 0.00 -0.53 0.00 0.00 39.78 35.57 1y3f n ASN 212 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 1y3f s LYS 213 N -5.90 2.11 0.03 1.20 -0.14 -0.59 -5.00 119.74 111.44 1y3f s LYS 213 Ca 0.03 -2.31 -0.02 0.00 -1.36 0.00 0.00 55.97 52.31 1y3f s LYS 213 Cb -0.01 -1.48 -0.02 0.00 -1.68 0.00 0.00 37.83 34.65 1y3f s LYS 213 CO 0.81 -0.29 0.02 0.71 -0.76 0.00 0.00 175.35 175.84 1y3f s TYR 214 N -2.87 0.30 -0.04 3.18 2.02 -1.26 -0.43 117.35 118.24 1y3f s TYR 214 Ca 0.15 -0.65 -0.30 0.00 -0.37 0.00 0.00 57.07 55.90 1y3f s TYR 214 Cb 0.04 -0.22 0.11 0.00 -0.40 0.00 0.00 41.96 41.49 1y3f s TYR 214 CO 0.08 -0.30 1.07 0.20 -1.57 0.00 0.00 175.55 175.03 1y3f s GLY 215 N -2.06 -0.36 -0.28 0.71 0.00 -0.48 -4.84 107.32 100.00 1y3f s GLY 215 Ca -0.06 1.00 -0.15 0.00 0.00 0.00 0.00 44.72 45.51 1y3f s GLY 215 CO -0.04 0.31 0.39 0.00 0.00 0.00 0.00 173.10 173.75 1y3f s ALA 216 N -2.80 3.55 0.36 3.20 0.00 -1.26 -1.54 121.76 123.28 1y3f s ALA 216 Ca 0.09 -0.85 0.08 0.00 0.00 0.00 0.00 51.96 51.28 1y3f s ALA 216 Cb -0.00 -2.75 -0.05 0.00 0.00 0.00 0.00 23.12 20.32 1y3f s ALA 216 CO -0.05 -0.74 0.12 0.71 0.00 0.00 0.00 175.76 175.80 1y3f s TYR 217 N 2.10 2.64 0.02 0.00 1.51 -0.41 -4.76 117.35 118.45 1y3f s TYR 217 Ca 0.15 -0.45 0.04 0.00 -1.01 0.00 0.00 57.07 55.81 1y3f s TYR 217 Cb -0.16 -1.69 -0.02 0.00 -0.11 0.00 0.00 41.96 39.99 1y3f s TYR 217 CO 0.10 0.33 -0.13 -0.80 -1.11 0.00 0.00 175.55 173.94 1y3f s ASN 218 N -3.83 1.57 0.00 2.29 0.01 -1.26 -0.95 114.94 112.78 1y3f s ASN 218 Ca 0.38 -0.38 0.00 0.00 -0.71 0.00 0.00 52.86 52.14 1y3f s ASN 218 Cb -0.00 -0.12 0.00 0.00 0.41 0.00 0.00 41.25 41.54 1y3f s ASN 218 CO 0.22 0.07 0.00 0.61 -1.51 0.00 0.00 177.10 176.48 1y3f n GLY 219 N 2.17 3.59 0.30 0.66 0.00 -0.18 -4.80 105.19 106.93 1y3f n GLY 219 Ca -0.17 -1.14 0.18 0.00 0.00 0.00 0.00 46.02 44.89 1y3f n GLY 219 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1y3f h THR 220 N 1.00 0.20 -0.76 2.61 1.35 -1.83 -1.29 112.91 114.19 1y3f h THR 220 Ca 0.00 -0.33 0.19 0.00 -0.55 0.00 0.00 66.41 65.72 1y3f h THR 220 Cb 0.00 1.26 -0.04 0.00 -1.73 0.00 0.00 68.15 67.64 1y3f h THR 220 CO 0.00 0.04 0.52 0.28 -0.25 0.00 0.00 175.52 176.11 1y3f h SER 221 N 0.00 0.20 0.89 5.36 0.02 -1.88 -1.52 113.55 116.61 1y3f h SER 221 Ca -0.00 0.02 -0.18 0.00 -0.84 0.00 0.00 61.79 60.78 1y3f h SER 221 Cb 0.26 -0.02 -0.03 0.00 0.14 0.00 0.00 62.40 62.75 1y3f h SER 221 CO 0.01 0.09 -1.20 0.24 -1.14 0.00 0.00 176.83 174.83 1y3f h MET 222 N 0.20 0.00 -0.01 3.45 2.07 -1.55 -3.37 114.93 115.73 1y3f h MET 222 Ca 0.37 0.00 -0.05 0.00 -2.07 0.00 0.00 59.70 57.95 1y3f h MET 222 Cb 1.16 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.89 1y3f h MET 222 CO -0.07 0.47 -0.20 0.00 1.07 0.00 0.00 176.91 178.18 1y3f h ALA 223 N 1.31 0.03 -0.58 6.32 0.00 -1.27 -3.35 119.26 121.71 1y3f h ALA 223 Ca -0.13 -0.44 0.11 0.00 0.00 0.00 0.00 54.91 54.45 1y3f h ALA 223 Cb 1.64 0.01 -0.11 0.00 0.00 0.00 0.00 17.79 19.33 1y3f h ALA 223 CO 0.07 0.05 -0.30 1.03 0.00 0.00 0.00 179.25 180.09 1y3f h SER 224 N -0.52 -1.05 0.42 0.00 0.87 -1.45 -1.26 113.55 110.56 1y3f h SER 224 Ca -0.02 0.22 0.00 0.00 -1.23 0.00 0.00 61.79 60.75 1y3f h SER 224 Cb 0.94 0.54 0.00 0.00 -0.44 0.00 0.00 62.40 63.44 1y3f h SER 224 CO 0.04 -0.29 0.00 1.55 -0.53 0.00 0.00 176.83 177.60 1y3f h PRO 225 N -0.14 0.00 -0.63 2.24 0.13 -1.72 -0.18 132.00 131.69 1y3f h PRO 225 Ca 0.24 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.35 1y3f h PRO 225 Cb 0.54 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.64 1y3f h PRO 225 CO -0.66 0.00 0.30 0.45 -0.23 0.00 0.00 178.00 177.85 1y3f h HIS 226 N 0.00 0.92 -0.15 1.56 3.86 -1.36 0.12 115.15 120.10 1y3f h HIS 226 Ca 0.00 -0.05 -0.15 0.00 -1.16 0.00 0.00 60.37 59.01 1y3f h HIS 226 Cb 0.21 -0.28 0.00 0.00 1.06 0.00 0.00 27.41 28.40 1y3f h HIS 226 CO 0.00 0.70 -0.50 0.28 0.86 0.00 0.00 177.93 179.27 1y3f h VAL 227 N 0.87 1.34 -0.30 2.45 2.07 -1.15 0.12 116.25 121.65 1y3f h VAL 227 Ca 0.22 -1.77 0.00 0.00 0.82 0.00 0.00 66.70 65.97 1y3f h VAL 227 Cb 0.13 2.03 -0.01 0.00 -1.52 0.00 0.00 31.29 31.92 1y3f h VAL 227 CO -0.03 0.54 0.19 0.00 0.02 0.00 0.00 177.57 178.29 1y3f h ALA 228 N 0.53 0.38 -0.76 1.67 0.00 -1.03 0.86 119.26 120.92 1y3f h ALA 228 Ca -0.02 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 54.90 1y3f h ALA 228 Cb 1.13 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.74 1y3f h ALA 228 CO 0.11 -0.14 0.47 0.78 0.00 0.00 0.00 179.25 180.47 1y3f h GLY 229 N 0.39 1.11 1.01 0.00 0.00 -0.78 -1.71 103.07 103.09 1y3f h GLY 229 Ca 0.11 -0.35 -0.00 0.00 0.00 0.00 0.00 47.33 47.09 1y3f h GLY 229 CO -0.02 0.27 0.45 0.00 0.00 0.00 0.00 176.54 177.24 1y3f h ALA 230 N 1.34 0.96 -0.97 3.60 0.00 -0.26 -1.44 119.26 122.49 1y3f h ALA 230 Ca 0.32 -0.09 0.07 0.00 0.00 0.00 0.00 54.91 55.20 1y3f h ALA 230 Cb 0.08 -0.30 -0.06 0.00 0.00 0.00 0.00 17.79 17.50 1y3f h ALA 230 CO -0.14 0.43 0.63 0.00 0.00 0.00 0.00 179.25 180.17 1y3f h ALA 231 N 1.24 1.45 -0.57 0.00 0.00 -0.39 -0.79 119.26 120.19 1y3f h ALA 231 Ca 0.27 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 55.06 1y3f h ALA 231 Cb -0.03 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.45 1y3f h ALA 231 CO -0.05 0.41 -0.04 0.00 0.00 0.00 0.00 179.25 179.57 1y3f h ALA 232 N 1.48 0.86 -0.33 0.00 0.00 -0.68 -0.99 119.26 119.59 1y3f h ALA 232 Ca 0.42 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1y3f h ALA 232 Cb 0.19 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1y3f h ALA 232 CO -0.17 0.66 0.22 -0.07 0.00 0.00 0.00 179.25 179.89 1y3f h LEU 233 N 0.92 0.37 -0.42 0.00 3.38 -0.85 0.08 115.31 118.79 1y3f h LEU 233 Ca 0.16 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.09 1y3f h LEU 233 Cb 0.59 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 1y3f h LEU 233 CO 0.04 0.27 0.16 0.40 0.09 0.00 0.00 178.44 179.40 1y3f h ILE 234 N 0.44 1.20 -0.25 1.22 2.04 -0.97 -2.18 117.51 119.02 1y3f h ILE 234 Ca 0.12 -0.64 -0.05 0.00 1.00 0.00 0.00 64.86 65.29 1y3f h ILE 234 Cb -0.05 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 36.86 1y3f h ILE 234 CO -0.03 0.23 -0.07 -0.07 0.00 0.00 0.00 178.15 178.22 1y3f h LEU 235 N 0.53 0.36 -1.25 1.44 3.38 -1.06 0.16 115.31 118.88 1y3f h LEU 235 Ca 0.14 -0.07 -0.08 0.00 0.09 0.00 0.00 57.88 57.96 1y3f h LEU 235 Cb 0.21 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1y3f h LEU 235 CO -0.01 0.48 -0.37 0.77 0.09 0.00 0.00 178.44 179.40 1y3f h SER 236 N 0.37 0.01 0.69 -0.43 4.64 -0.48 -1.48 113.55 116.88 1y3f h SER 236 Ca 0.08 -0.01 -0.26 0.00 -0.47 0.00 0.00 61.79 61.13 1y3f h SER 236 Cb 0.35 -0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.42 1y3f h SER 236 CO 0.02 0.38 -1.31 0.50 -0.87 0.00 0.00 176.83 175.55 1y3f h LYS 237 N 0.01 0.13 -2.30 4.77 3.64 -0.95 -3.40 116.57 118.46 1y3f h LYS 237 Ca -0.00 -0.22 -0.59 0.00 -1.27 0.00 0.00 60.65 58.58 1y3f h LYS 237 Cb 0.66 0.08 -0.40 0.00 -0.41 0.00 0.00 32.23 32.16 1y3f h LYS 237 CO 0.05 1.00 -0.86 0.72 -2.27 0.00 0.00 179.45 178.09 1y3f n HIS 238 N -3.37 1.13 0.28 1.91 8.25 0.52 -4.98 115.22 118.96 1y3f n HIS 238 Ca -0.09 -3.78 0.17 0.00 -0.26 0.00 0.00 57.72 53.76 1y3f n HIS 238 Cb 1.00 -0.31 0.89 0.00 1.12 0.00 0.00 29.99 32.69 1y3f n HIS 238 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1y3f h PRO 239 N 4.62 0.00 -0.33 -0.41 0.11 -1.50 -1.55 132.00 132.94 1y3f h PRO 239 Ca 0.16 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.23 1y3f h PRO 239 Cb 0.81 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.89 1y3f h PRO 239 CO 0.58 0.00 0.01 0.27 -0.21 0.00 0.00 178.00 178.65 1y3f n ASN 240 N -2.72 3.88 -4.73 -2.05 6.94 -1.26 -4.93 115.26 110.38 1y3f n ASN 240 Ca -0.02 -3.13 -0.41 0.00 -0.02 0.00 0.00 54.58 51.00 1y3f n ASN 240 Cb 0.09 -0.58 -0.04 0.00 -2.36 0.00 0.00 39.78 36.89 1y3f n ASN 240 CO 0.00 0.00 0.00 0.26 -1.03 0.00 0.00 177.26 176.49 1y3f s TRP 241 N -2.90 3.70 0.88 -2.53 0.52 -0.58 -5.05 118.94 112.97 1y3f s TRP 241 Ca 0.44 1.69 -0.12 0.00 0.02 0.00 0.00 56.10 58.13 1y3f s TRP 241 Cb 0.36 -3.17 0.12 0.00 -1.15 0.00 0.00 33.47 29.63 1y3f s TRP 241 CO 0.08 -0.24 1.13 0.95 0.02 0.00 0.00 176.95 178.90 1y3f s THR 242 N -0.15 2.25 0.23 2.01 -4.23 -1.26 -4.84 115.64 109.66 1y3f s THR 242 Ca 0.48 0.08 -0.06 0.00 -1.18 0.00 0.00 61.69 61.01 1y3f s THR 242 Cb -0.27 -2.84 0.19 0.00 1.34 0.00 0.00 72.50 70.92 1y3f s THR 242 CO 0.32 -0.11 1.82 -0.55 -0.54 0.00 0.00 174.62 175.56 1y3f h ASN 243 N -1.39 0.65 -0.60 3.99 -1.07 -1.91 -0.15 115.58 115.10 1y3f h ASN 243 Ca -0.50 0.04 0.12 0.00 0.07 0.00 0.00 56.30 56.03 1y3f h ASN 243 Cb 1.32 -0.09 -0.10 0.00 -2.07 0.00 0.00 38.32 37.38 1y3f h ASN 243 CO 0.61 0.40 0.04 0.74 0.07 0.00 0.00 177.43 179.29 1y3f h THR 244 N 0.78 0.54 -0.17 6.14 2.02 -1.93 0.76 112.91 121.06 1y3f h THR 244 Ca 0.36 -0.05 -0.20 0.00 0.77 0.00 0.00 66.41 67.29 1y3f h THR 244 Cb 0.27 0.37 0.00 0.00 -1.74 0.00 0.00 68.15 67.05 1y3f h THR 244 CO -0.21 0.03 -0.69 -0.61 0.37 0.00 0.00 175.52 174.41 1y3f h GLN 245 N 0.16 0.69 -0.62 6.66 5.75 -1.72 -0.84 115.11 125.18 1y3f h GLN 245 Ca 0.32 -0.51 -0.01 0.00 -0.15 0.00 0.00 58.65 58.29 1y3f h GLN 245 Cb 0.50 0.09 -0.03 0.00 1.07 0.00 0.00 27.48 29.11 1y3f h GLN 245 CO -0.48 1.13 0.33 0.28 -2.65 0.00 0.00 178.83 177.44 1y3f h VAL 246 N 0.49 1.20 -0.15 2.39 2.07 -0.55 0.20 116.25 121.90 1y3f h VAL 246 Ca -0.02 -0.52 -0.03 0.00 0.82 0.00 0.00 66.70 66.95 1y3f h VAL 246 Cb 1.29 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 31.46 1y3f h VAL 246 CO 0.14 0.22 -0.02 -0.09 0.02 0.00 0.00 177.57 177.84 1y3f h ARG 247 N 0.84 0.29 -0.55 1.57 2.43 -0.77 -2.05 114.38 116.15 1y3f h ARG 247 Ca 0.22 -0.10 -0.05 0.00 -0.81 0.00 0.00 59.98 59.24 1y3f h ARG 247 Cb 0.05 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.56 1y3f h ARG 247 CO -0.03 0.54 0.15 0.66 -1.51 0.00 0.00 179.97 179.78 1y3f h SER 248 N 0.01 0.77 -0.97 -3.80 4.64 -1.02 -1.26 113.55 111.91 1y3f h SER 248 Ca 0.04 -0.13 0.03 0.00 -0.47 0.00 0.00 61.79 61.26 1y3f h SER 248 Cb 0.42 -0.20 -0.05 0.00 -0.31 0.00 0.00 62.40 62.26 1y3f h SER 248 CO 0.01 0.74 0.63 0.77 -0.87 0.00 0.00 176.83 178.11 1y3f h SER 249 N 0.80 1.06 -0.13 4.97 4.64 -0.15 0.32 113.55 125.06 1y3f h SER 249 Ca 0.18 -0.01 -0.08 0.00 -0.47 0.00 0.00 61.79 61.41 1y3f h SER 249 Cb 0.26 -0.25 -0.00 0.00 -0.31 0.00 0.00 62.40 62.11 1y3f h SER 249 CO -0.01 0.74 -0.23 -0.07 -0.87 0.00 0.00 176.83 176.39 1y3f h LEU 250 N 1.24 0.44 -0.86 5.97 3.38 -0.93 -3.14 115.31 121.41 1y3f h LEU 250 Ca 0.38 -0.54 -0.02 0.00 0.09 0.00 0.00 57.88 57.78 1y3f h LEU 250 Cb -0.03 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.56 1y3f h LEU 250 CO -0.11 0.90 0.44 -0.33 0.09 0.00 0.00 178.44 179.43 1y3f h GLU 251 N -0.00 1.22 -0.00 1.13 5.08 -1.05 -3.15 114.58 117.81 1y3f h GLU 251 Ca 0.01 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 1y3f h GLU 251 Cb 0.81 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.83 1y3f h GLU 251 CO 0.05 0.92 -0.03 0.09 -1.00 0.00 0.00 179.01 179.04 1y3f n ASN 252 N -4.33 0.07 -0.05 1.42 5.03 0.08 -3.70 115.26 113.78 1y3f n ASN 252 Ca 0.09 -0.06 0.01 0.00 0.87 0.00 0.00 54.58 55.49 1y3f n ASN 252 Cb 0.12 -0.29 0.02 0.00 -1.02 0.00 0.00 39.78 38.61 1y3f n ASN 252 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 1y3f n THR 253 N -1.30 0.76 -0.84 3.41 -2.24 -1.19 -2.97 114.28 109.91 1y3f n THR 253 Ca 0.12 -0.81 -0.32 0.00 -2.27 0.00 0.00 64.05 60.77 1y3f n THR 253 Cb 0.27 0.54 0.15 0.00 -2.10 0.00 0.00 70.33 69.19 1y3f n THR 253 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1y3f n THR 254 N -0.45 0.75 -2.96 4.28 -2.24 -1.19 -4.20 114.28 108.28 1y3f n THR 254 Ca 0.02 -0.09 -0.42 0.00 -2.27 0.00 0.00 64.05 61.29 1y3f n THR 254 Cb 0.41 -1.05 -0.05 0.00 -2.10 0.00 0.00 70.33 67.54 1y3f n THR 254 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1y3f s THR 255 N -2.44 4.72 0.35 4.28 2.01 0.20 -3.14 115.64 121.62 1y3f s THR 255 Ca 0.69 0.82 -0.28 0.00 0.31 0.00 0.00 61.69 63.24 1y3f s THR 255 Cb -0.25 -4.23 -0.10 0.00 0.01 0.00 0.00 72.50 67.93 1y3f s THR 255 CO 0.56 -0.48 1.27 -0.54 -0.69 0.00 0.00 174.62 174.75 1y3f s LYS 256 N 3.13 4.25 0.00 4.92 -0.14 -1.26 -1.25 119.74 129.40 1y3f s LYS 256 Ca 0.31 2.12 0.00 0.00 -1.36 0.00 0.00 55.97 57.05 1y3f s LYS 256 Cb -0.13 -2.95 0.00 0.00 -1.68 0.00 0.00 37.83 33.07 1y3f s LYS 256 CO 0.18 -0.25 0.00 1.28 -0.76 0.00 0.00 175.35 175.80 1y3f n LEU 257 N 0.57 0.00 0.00 3.17 4.77 -1.26 -4.89 117.00 119.37 1y3f n LEU 257 Ca 0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 1y3f n LEU 257 Cb 0.43 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.52 1y3f n LEU 257 CO 0.57 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.24 1y3f n GLY 258 N 5.00 0.74 3.60 -0.72 0.00 -1.26 -5.00 105.19 107.54 1y3f n GLY 258 Ca 0.00 -1.70 -0.46 0.00 0.00 0.00 0.00 46.02 43.86 1y3f n GLY 258 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1y3f n ASP 259 N 0.00 1.48 0.27 1.61 2.03 -1.26 -4.70 116.55 115.98 1y3f n ASP 259 Ca 0.00 1.16 0.18 0.00 0.52 0.00 0.00 54.79 56.65 1y3f n ASP 259 Cb 0.00 -1.28 0.78 0.00 -0.72 0.00 0.00 41.12 39.90 1y3f n ASP 259 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 1y3f h SER 260 N 2.68 0.00 -0.11 1.67 4.64 -1.92 -0.84 113.55 119.67 1y3f h SER 260 Ca -0.41 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.87 1y3f h SER 260 Cb 1.33 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.41 1y3f h SER 260 CO 0.65 0.00 -0.02 0.15 -0.87 0.00 0.00 176.83 176.75 1y3f h PHE 261 N 0.00 0.33 0.00 4.77 3.57 -1.86 0.14 116.94 123.89 1y3f h PHE 261 Ca 0.00 -0.02 -0.23 0.00 3.53 0.00 0.00 57.97 61.24 1y3f h PHE 261 Cb 0.35 -0.10 -0.04 0.00 2.79 0.00 0.00 35.95 38.95 1y3f h PHE 261 CO 0.00 0.36 -2.15 0.66 -2.23 0.00 0.00 178.31 174.94 1y3f n TYR 262 N -4.34 0.00 -0.05 0.41 4.01 -0.47 -1.32 117.16 115.40 1y3f n TYR 262 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 1y3f n TYR 262 Cb 0.21 -0.77 0.00 0.00 -0.31 0.00 0.00 39.34 38.47 1y3f n TYR 262 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1y3f n TYR 263 N -2.53 0.00 -1.59 -0.72 4.01 -0.45 -4.94 117.16 110.95 1y3f n TYR 263 Ca -0.22 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.52 1y3f n TYR 263 Cb 0.92 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.95 1y3f n TYR 263 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1y3f n GLY 264 N 0.12 2.38 0.08 2.72 0.00 0.47 -1.30 105.19 109.65 1y3f n GLY 264 Ca 0.00 -0.23 0.15 0.00 0.00 0.00 0.00 46.02 45.94 1y3f n GLY 264 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1y3f n LYS 265 N 14.00 0.94 0.00 1.61 5.02 0.88 -4.15 118.16 136.45 1y3f n LYS 265 Ca 0.00 -0.15 0.00 0.00 -2.02 0.00 0.00 58.31 56.14 1y3f n LYS 265 Cb 0.00 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.51 1y3f n LYS 265 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1y3f n GLY 266 N 1.11 -1.02 3.71 0.72 0.00 -0.42 -4.02 105.19 105.27 1y3f n GLY 266 Ca 0.20 -2.13 -0.42 0.00 0.00 0.00 0.00 46.02 43.68 1y3f n GLY 266 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1y3f s LEU 267 N 0.00 4.40 0.62 0.99 2.96 -0.38 -0.85 118.68 126.43 1y3f s LEU 267 Ca 0.00 1.70 -0.19 0.00 -0.22 0.00 0.00 54.13 55.43 1y3f s LEU 267 Cb 0.00 -3.57 -0.02 0.00 0.50 0.00 0.00 46.19 43.09 1y3f s LEU 267 CO 0.00 -0.22 1.29 0.27 -1.32 0.00 0.00 176.35 176.37 1y3f s ILE 268 N 0.75 2.15 -0.32 6.68 -4.36 -0.83 -0.63 121.20 124.65 1y3f s ILE 268 Ca 0.51 0.10 -0.01 0.00 -0.26 0.00 0.00 60.65 60.98 1y3f s ILE 268 Cb -0.22 -3.04 0.11 0.00 1.25 0.00 0.00 42.46 40.56 1y3f s ILE 268 CO 0.29 -0.02 0.13 0.21 0.24 0.00 0.00 174.94 175.79 1y3f s ASN 269 N -1.38 3.73 0.38 4.36 3.84 -1.26 -4.56 114.94 120.05 1y3f s ASN 269 Ca 0.80 -1.69 0.18 0.00 0.21 0.00 0.00 52.86 52.36 1y3f s ASN 269 Cb -0.37 -0.68 0.74 0.00 -0.55 0.00 0.00 41.25 40.40 1y3f s ASN 269 CO 0.39 -0.40 1.77 1.62 -2.79 0.00 0.00 177.10 177.70 1y3f h VAL 270 N 6.18 0.94 0.19 -5.21 3.04 -1.42 -1.15 116.25 118.83 1y3f h VAL 270 Ca -0.12 -1.43 0.01 0.00 -1.01 0.00 0.00 66.70 64.14 1y3f h VAL 270 Cb 1.00 1.85 -0.02 0.00 -2.01 0.00 0.00 31.29 32.11 1y3f h VAL 270 CO 0.44 0.36 -0.21 -0.61 -1.01 0.00 0.00 177.57 176.54 1y3f h GLN 271 N 0.00 -0.42 -0.43 4.17 4.15 -1.74 -1.33 115.11 119.51 1y3f h GLN 271 Ca -0.00 0.03 -0.09 0.00 0.77 0.00 0.00 58.65 59.35 1y3f h GLN 271 Cb 0.82 0.10 -0.02 0.00 0.21 0.00 0.00 27.48 28.59 1y3f h GLN 271 CO 0.05 -0.28 -0.11 0.00 -1.93 0.00 0.00 178.83 176.56 1y3f h ALA 272 N 0.30 1.01 -0.15 3.38 0.00 -1.86 -2.96 119.26 118.99 1y3f h ALA 272 Ca 0.01 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.58 1y3f h ALA 272 Cb 0.42 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1y3f h ALA 272 CO -0.07 0.59 -0.00 0.00 0.00 0.00 0.00 179.25 179.78 1y3f h ALA 273 N 1.19 1.73 -0.24 0.00 0.00 -0.96 -2.50 119.26 118.47 1y3f h ALA 273 Ca 0.12 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1y3f h ALA 273 Cb 0.58 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1y3f h ALA 273 CO 0.04 0.21 0.00 0.00 0.00 0.00 0.00 179.25 179.50 1y3f n ALA 274 N -2.50 2.49 -1.91 0.00 0.00 -0.52 -4.79 120.51 113.26 1y3f n ALA 274 Ca -0.01 -0.68 -0.29 0.00 0.00 0.00 0.00 53.44 52.47 1y3f n ALA 274 Cb 0.16 -1.01 0.05 0.00 0.00 0.00 0.00 19.45 18.65 1y3f n ALA 274 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1y3f s GLN 275 N -1.70 2.65 0.12 0.00 -1.52 -0.95 -5.00 119.66 113.27 1y3f s GLN 275 Ca 0.34 0.30 -0.18 0.00 -1.95 0.00 0.00 55.36 53.87 1y3f s GLN 275 Cb 0.19 -2.05 -0.04 0.00 -0.22 0.00 0.00 33.01 30.90 1y3f s GLN 275 CO 0.28 -1.12 1.67 0.45 -0.25 0.00 0.00 175.29 176.32 1y3f h HIS 276 N -0.67 0.47 -3.32 0.91 3.86 -1.89 -3.44 115.15 111.08 1y3f h HIS 276 Ca -0.45 -0.03 -0.63 0.00 -1.16 0.00 0.00 60.37 58.10 1y3f h HIS 276 Cb 1.27 -0.14 -0.20 0.00 1.06 0.00 0.00 27.41 29.40 1y3f h HIS 276 CO 0.45 0.44 -0.64 -1.01 0.86 0.00 0.00 177.93 178.03 1y3f s HIS 277 N -5.61 3.09 -0.13 2.45 3.76 -1.26 -5.11 115.29 112.49 1y3f s HIS 277 Ca -0.13 -0.21 -0.01 0.00 -0.15 0.00 0.00 55.06 54.56 1y3f s HIS 277 Cb 0.09 -2.01 -0.02 0.00 1.11 0.00 0.00 32.58 31.75 1y3f s HIS 277 CO 0.73 -0.00 -0.09 -1.01 -0.85 0.00 0.00 174.74 173.52 1y3f s HIS 278 N 0.44 2.90 0.14 1.40 0.09 -1.26 -4.98 115.29 114.01 1y3f s HIS 278 Ca -0.01 -0.39 -0.12 0.00 -0.00 0.00 0.00 55.06 54.53 1y3f s HIS 278 Cb -0.14 -1.86 0.01 0.00 -0.00 0.00 0.00 32.58 30.60 1y3f s HIS 278 CO 0.02 -0.05 0.33 -3.38 -0.00 0.00 0.00 174.74 171.67 1y3f s HIS 279 N 0.13 0.06 0.40 1.40 -3.43 -1.24 -4.94 115.29 107.68 1y3f s HIS 279 Ca -0.04 -0.43 -0.23 0.00 -0.80 0.00 0.00 55.06 53.56 1y3f s HIS 279 Cb -0.14 0.11 -0.09 0.00 -1.43 0.00 0.00 32.58 31.03 1y3f s HIS 279 CO 0.04 -0.70 1.02 -1.01 -2.00 0.00 0.00 174.74 172.09 1y3f s HIS 280 N -3.87 3.30 -1.09 0.38 3.76 -1.16 -4.35 115.29 112.25 1y3f s HIS 280 Ca 0.08 1.65 0.09 0.00 -0.15 0.00 0.00 55.06 56.73 1y3f s HIS 280 Cb 0.03 -3.05 0.07 0.00 1.11 0.00 0.00 32.58 30.73 1y3f s HIS 280 CO -0.07 -0.47 0.78 0.72 -0.85 0.00 0.00 174.74 174.85