#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yaa n ALA 3 N 0.00 3.45 -2.27 -1.46 0.00 -1.26 -4.01 120.51 114.96 1yaa n ALA 3 Ca 0.00 -0.34 -0.03 0.00 0.00 0.00 0.00 53.44 53.07 1yaa n ALA 3 Cb 0.00 -1.14 0.07 0.00 0.00 0.00 0.00 19.45 18.38 1yaa n ALA 3 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1yaa n THR 4 N -1.44 1.42 -0.30 0.00 -2.24 -1.26 -4.89 114.28 105.57 1yaa n THR 4 Ca 0.06 -2.76 -0.05 0.00 -2.27 0.00 0.00 64.05 59.03 1yaa n THR 4 Cb 0.34 0.31 0.07 0.00 -2.10 0.00 0.00 70.33 68.95 1yaa n THR 4 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1yaa h LEU 5 N 1.69 1.11 -1.98 3.22 5.85 -2.08 -3.10 115.31 120.03 1yaa h LEU 5 Ca -0.02 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.55 1yaa h LEU 5 Cb 1.44 -0.29 0.00 0.00 0.37 0.00 0.00 40.66 42.18 1yaa h LEU 5 CO 0.25 0.96 0.00 0.49 -0.34 0.00 0.00 178.44 179.80 1yaa n PHE 6 N -4.29 0.41 0.27 1.25 3.72 -1.26 -4.51 117.46 113.05 1yaa n PHE 6 Ca 0.08 -0.21 0.18 0.00 -0.05 0.00 0.00 57.45 57.45 1yaa n PHE 6 Cb 0.17 0.00 0.97 0.00 -0.94 0.00 0.00 39.48 39.68 1yaa n PHE 6 CO 0.00 0.00 0.00 -0.91 -0.05 0.00 0.00 176.76 175.80 1yaa h ASN 7 N 3.88 0.00 0.00 4.37 4.21 -1.92 -2.72 115.58 123.39 1yaa h ASN 7 Ca 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1yaa h ASN 7 Cb 0.85 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.05 1yaa h ASN 7 CO 0.00 0.00 -1.32 0.59 -1.29 0.00 0.00 177.43 175.41 1yaa n ASN 8 N -2.76 0.94 -4.66 5.81 3.02 -1.26 -4.99 115.26 111.37 1yaa n ASN 8 Ca -0.02 -0.42 -0.48 0.00 -0.03 0.00 0.00 54.58 53.63 1yaa n ASN 8 Cb 0.06 1.42 -0.05 0.00 -0.61 0.00 0.00 39.78 40.61 1yaa n ASN 8 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 1yaa n ILE 9 N -1.77 0.09 -2.82 2.41 2.08 -1.03 -4.95 119.36 113.37 1yaa n ILE 9 Ca -0.00 -0.02 -0.31 0.00 0.56 0.00 0.00 62.75 62.98 1yaa n ILE 9 Cb 0.36 -1.43 -0.04 0.00 -0.75 0.00 0.00 39.64 37.78 1yaa n ILE 9 CO 0.00 0.00 0.00 -1.61 0.56 0.00 0.00 176.55 175.50 1yaa s GLU 10 N 1.36 3.86 0.02 0.38 8.01 -1.26 -5.06 118.70 126.01 1yaa s GLU 10 Ca 0.82 0.61 -0.25 0.00 0.01 0.00 0.00 54.97 56.16 1yaa s GLU 10 Cb -0.75 -2.35 -0.05 0.00 -4.31 0.00 0.00 34.13 26.68 1yaa s GLU 10 CO 0.42 -0.05 0.77 -1.17 0.01 0.00 0.00 175.26 175.25 1yaa s LEU 11 N -3.73 4.42 -0.02 1.80 2.96 -1.26 -5.07 118.68 117.78 1yaa s LEU 11 Ca 0.53 1.42 -0.01 0.00 -0.22 0.00 0.00 54.13 55.86 1yaa s LEU 11 Cb -0.10 -3.23 -0.04 0.00 0.50 0.00 0.00 46.19 43.32 1yaa s LEU 11 CO 0.29 -0.03 0.05 -0.76 -1.32 0.00 0.00 176.35 174.58 1yaa s LEU 12 N 0.19 3.78 0.71 -0.68 1.43 -1.26 -5.10 118.68 117.76 1yaa s LEU 12 Ca 0.39 0.13 -0.14 0.00 -1.03 0.00 0.00 54.13 53.48 1yaa s LEU 12 Cb -0.20 -2.13 0.03 0.00 0.03 0.00 0.00 46.19 43.91 1yaa s LEU 12 CO 0.23 0.30 1.12 -2.16 0.23 0.00 0.00 176.35 176.07 1yaa s PRO 13 N -1.53 2.47 0.86 1.29 0.04 -1.26 -4.99 135.00 131.88 1yaa s PRO 13 Ca 0.20 1.42 -0.11 0.00 0.04 0.00 0.00 61.00 62.55 1yaa s PRO 13 Cb -0.12 -1.91 0.12 0.00 0.04 0.00 0.00 34.50 32.63 1yaa s PRO 13 CO 0.11 -1.52 1.14 -1.25 0.04 0.00 0.00 177.00 175.52 1yaa s PRO 14 N -4.26 1.41 0.27 0.56 0.04 -1.26 -4.91 135.00 126.85 1yaa s PRO 14 Ca 0.67 1.48 -0.30 0.00 0.04 0.00 0.00 61.00 62.89 1yaa s PRO 14 Cb -0.21 -1.78 -0.11 0.00 0.04 0.00 0.00 34.50 32.43 1yaa s PRO 14 CO 0.46 -2.33 1.62 0.34 0.04 0.00 0.00 177.00 177.13 1yaa s ASP 15 N -2.78 6.37 0.48 6.66 2.15 -1.26 -4.84 116.67 123.45 1yaa s ASP 15 Ca 0.66 2.93 0.19 0.00 0.43 0.00 0.00 52.55 56.76 1yaa s ASP 15 Cb -0.22 -2.63 1.20 0.00 -0.30 0.00 0.00 42.92 40.97 1yaa s ASP 15 CO 0.56 -0.93 1.99 0.00 -0.17 0.00 0.00 175.17 176.63 1yaa h ALA 16 N 5.29 2.22 0.00 3.66 0.00 -1.98 0.29 119.26 128.74 1yaa h ALA 16 Ca -0.46 -0.01 -0.25 0.00 0.00 0.00 0.00 54.91 54.19 1yaa h ALA 16 Cb 1.22 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.94 1yaa h ALA 16 CO 0.83 -0.35 -1.58 1.28 0.00 0.00 0.00 179.25 179.43 1yaa n LEU 17 N -4.44 1.90 0.21 0.00 4.32 -1.26 -4.25 117.00 113.48 1yaa n LEU 17 Ca 0.09 0.41 0.05 0.00 -0.02 0.00 0.00 56.01 56.55 1yaa n LEU 17 Cb 0.46 -0.86 0.46 0.00 -1.62 0.00 0.00 43.42 41.86 1yaa n LEU 17 CO 0.35 0.18 0.81 -0.26 -1.22 0.00 0.00 177.39 177.25 1yaa h PHE 18 N -1.00 0.00 0.00 -1.77 -1.00 -1.95 -2.14 116.94 109.07 1yaa h PHE 18 Ca -0.37 0.00 -0.04 0.00 2.81 0.00 0.00 57.97 60.37 1yaa h PHE 18 Cb 1.25 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.80 1yaa h PHE 18 CO -0.10 0.28 -0.20 0.78 -1.61 0.00 0.00 178.31 177.46 1yaa h GLY 19 N 1.01 0.00 2.00 -1.45 0.00 -0.64 -2.68 103.07 101.31 1yaa h GLY 19 Ca -0.00 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.22 1yaa h GLY 19 CO 0.04 0.00 -0.51 0.16 0.00 0.00 0.00 176.54 176.23 1yaa h ILE 20 N 0.00 0.91 0.00 2.60 3.07 -1.56 -2.93 117.51 119.59 1yaa h ILE 20 Ca -0.00 -2.19 0.00 0.00 1.55 0.00 0.00 64.86 64.22 1yaa h ILE 20 Cb 0.41 2.38 0.00 0.00 -0.27 0.00 0.00 36.82 39.34 1yaa h ILE 20 CO 0.03 0.50 0.00 0.07 -1.05 0.00 0.00 178.15 177.70 1yaa h LYS 21 N 0.00 0.00 0.04 0.16 2.10 -1.50 -2.11 116.57 115.26 1yaa h LYS 21 Ca -0.01 0.00 -0.08 0.00 -2.00 0.00 0.00 60.65 58.57 1yaa h LYS 21 Cb 1.34 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 32.68 1yaa h LYS 21 CO 0.07 0.00 -0.33 0.37 -2.00 0.00 0.00 179.45 177.56 1yaa h GLN 22 N 0.00 0.15 -0.66 0.07 4.15 -1.48 -2.33 115.11 115.01 1yaa h GLN 22 Ca 0.00 -0.22 -0.02 0.00 0.77 0.00 0.00 58.65 59.18 1yaa h GLN 22 Cb 0.71 0.07 -0.03 0.00 0.21 0.00 0.00 27.48 28.45 1yaa h GLN 22 CO 0.00 1.05 0.31 0.00 -1.93 0.00 0.00 178.83 178.26 1yaa h ARG 23 N -0.65 0.93 -0.01 1.69 3.08 -1.47 -1.66 114.38 116.29 1yaa h ARG 23 Ca -0.05 -0.12 -0.00 0.00 0.07 0.00 0.00 59.98 59.87 1yaa h ARG 23 Cb 1.20 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 31.07 1yaa h ARG 23 CO 0.06 0.72 0.00 -0.92 -1.07 0.00 0.00 179.97 178.76 1yaa h TYR 24 N 0.93 0.02 -0.56 3.04 3.20 -1.45 -0.90 116.97 121.24 1yaa h TYR 24 Ca 0.23 -0.00 0.03 0.00 3.14 0.00 0.00 58.73 62.12 1yaa h TYR 24 Cb 0.10 -0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.33 1yaa h TYR 24 CO 0.01 0.23 0.37 0.78 -1.64 0.00 0.00 178.16 177.91 1yaa h GLY 25 N -0.20 0.74 2.00 1.82 0.00 -1.15 -1.59 103.07 104.69 1yaa h GLY 25 Ca 0.00 -0.26 -0.00 0.00 0.00 0.00 0.00 47.33 47.07 1yaa h GLY 25 CO -0.00 0.24 -0.01 -1.61 0.00 0.00 0.00 176.54 175.16 1yaa h GLN 26 N 0.67 0.00 -6.28 4.80 5.75 -1.09 -3.45 115.11 115.52 1yaa h GLN 26 Ca 0.22 0.00 -0.55 0.00 -0.15 0.00 0.00 58.65 58.17 1yaa h GLN 26 Cb 0.05 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.61 1yaa h GLN 26 CO -0.06 0.01 1.20 0.34 -2.65 0.00 0.00 178.83 177.67 1yaa s ASP 27 N -6.10 6.41 0.00 -0.69 -1.08 -0.36 -4.88 116.67 109.96 1yaa s ASP 27 Ca 0.06 2.33 0.26 0.00 -0.52 0.00 0.00 52.55 54.67 1yaa s ASP 27 Cb 0.06 -2.53 0.80 0.00 -1.46 0.00 0.00 42.92 39.78 1yaa s ASP 27 CO 0.64 -1.13 1.60 0.00 0.52 0.00 0.00 175.17 176.80 1yaa n GLN 28 N 7.55 1.86 -2.44 4.34 1.13 -1.26 -4.92 117.38 123.63 1yaa n GLN 28 Ca 0.20 -1.25 -0.39 0.00 -1.94 0.00 0.00 57.00 53.62 1yaa n GLN 28 Cb 0.42 -1.47 -0.04 0.00 0.11 0.00 0.00 30.24 29.27 1yaa n GLN 28 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 1yaa s ARG 29 N -1.95 4.40 0.00 -1.09 0.52 -1.26 -4.93 118.95 114.64 1yaa s ARG 29 Ca 0.35 1.75 0.24 0.00 -0.52 0.00 0.00 55.73 57.55 1yaa s ARG 29 Cb 0.20 -2.93 1.11 0.00 0.52 0.00 0.00 34.95 33.85 1yaa s ARG 29 CO 0.32 0.01 1.77 0.00 0.02 0.00 0.00 175.30 177.42 1yaa n ALA 30 N 0.65 2.15 -1.11 2.13 0.00 -1.26 -3.66 120.51 119.41 1yaa n ALA 30 Ca 0.01 -0.10 0.04 0.00 0.00 0.00 0.00 53.44 53.40 1yaa n ALA 30 Cb 0.46 -1.38 0.25 0.00 0.00 0.00 0.00 19.45 18.77 1yaa n ALA 30 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1yaa n THR 31 N -1.39 2.40 -2.61 0.00 -2.24 -1.26 -5.04 114.28 104.14 1yaa n THR 31 Ca 0.09 -2.08 -0.37 0.00 -2.27 0.00 0.00 64.05 59.42 1yaa n THR 31 Cb 0.23 -0.28 -0.05 0.00 -2.10 0.00 0.00 70.33 68.13 1yaa n THR 31 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 1yaa s LYS 32 N -2.95 4.41 -0.08 -0.78 0.00 -1.24 -4.74 119.74 114.36 1yaa s LYS 32 Ca 0.44 1.50 0.02 0.00 0.00 0.00 0.00 55.97 57.93 1yaa s LYS 32 Cb 0.36 -2.77 0.01 0.00 0.00 0.00 0.00 37.83 35.44 1yaa s LYS 32 CO 0.07 0.08 -0.12 0.08 0.00 0.00 0.00 175.35 175.46 1yaa s VAL 33 N -1.54 1.20 -0.48 1.79 1.01 0.19 -4.99 120.40 117.59 1yaa s VAL 33 Ca 0.52 -0.49 -0.17 0.00 0.00 0.00 0.00 61.98 61.84 1yaa s VAL 33 Cb -0.23 -1.11 0.06 0.00 0.00 0.00 0.00 36.38 35.10 1yaa s VAL 33 CO 0.29 0.38 0.48 -0.62 0.00 0.00 0.00 175.10 175.63 1yaa s ASP 34 N 0.86 6.18 -0.20 3.32 2.15 -1.26 -0.56 116.67 127.16 1yaa s ASP 34 Ca -0.10 -1.10 0.12 0.00 0.43 0.00 0.00 52.55 51.89 1yaa s ASP 34 Cb -0.15 -2.23 0.41 0.00 -0.30 0.00 0.00 42.92 40.65 1yaa s ASP 34 CO 0.01 -0.73 1.21 0.18 -0.17 0.00 0.00 175.17 175.68 1yaa n LEU 35 N 5.60 2.64 0.00 -1.34 4.32 -0.28 -4.39 117.00 123.56 1yaa n LEU 35 Ca -0.10 -3.79 0.00 0.00 -0.02 0.00 0.00 56.01 52.10 1yaa n LEU 35 Cb 0.45 -0.51 0.00 0.00 -1.62 0.00 0.00 43.42 41.74 1yaa n LEU 35 CO 0.49 1.32 0.00 0.61 -1.22 0.00 0.00 177.39 178.60 1yaa n GLY 36 N -1.12 0.17 3.74 -0.72 0.00 -1.16 -0.84 105.19 105.26 1yaa n GLY 36 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 1yaa n GLY 36 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1yaa s ILE 37 N 0.00 2.45 -1.47 -0.61 -1.09 -1.26 -4.43 121.20 114.78 1yaa s ILE 37 Ca 0.00 0.37 -0.11 0.00 -2.23 0.00 0.00 60.65 58.68 1yaa s ILE 37 Cb 0.00 -3.23 -0.06 0.00 -1.58 0.00 0.00 42.46 37.59 1yaa s ILE 37 CO 0.00 0.05 2.66 0.61 -1.23 0.00 0.00 174.94 177.03 1yaa n GLY 38 N 2.44 4.09 3.39 6.18 0.00 -1.26 -4.86 105.19 115.18 1yaa n GLY 38 Ca 0.08 -1.44 -0.34 0.00 0.00 0.00 0.00 46.02 44.33 1yaa n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yaa s ALA 39 N 2.66 2.80 0.38 4.61 0.00 -1.26 -4.99 121.76 125.96 1yaa s ALA 39 Ca 0.61 -0.96 -0.28 0.00 0.00 0.00 0.00 51.96 51.33 1yaa s ALA 39 Cb 0.16 -1.48 -0.11 0.00 0.00 0.00 0.00 23.12 21.70 1yaa s ALA 39 CO -0.06 0.02 1.49 0.98 0.00 0.00 0.00 175.76 178.19 1yaa n TYR 40 N 3.93 2.99 -4.20 0.00 9.36 -1.26 -4.79 117.16 123.19 1yaa n TYR 40 Ca -0.18 0.45 -0.16 0.00 3.32 0.00 0.00 57.90 61.32 1yaa n TYR 40 Cb 0.52 -2.53 -0.13 0.00 -0.63 0.00 0.00 39.34 36.57 1yaa n TYR 40 CO 0.00 0.00 0.00 1.03 0.22 0.00 0.00 176.86 178.11 1yaa s ARG 41 N -2.12 0.61 0.00 2.98 1.81 -1.26 -4.27 118.95 116.71 1yaa s ARG 41 Ca 0.53 -0.52 0.00 0.00 -1.72 0.00 0.00 55.73 54.03 1yaa s ARG 41 Cb -0.47 -0.53 0.00 0.00 -0.45 0.00 0.00 34.95 33.50 1yaa s ARG 41 CO 0.64 0.13 0.00 -0.40 -0.68 0.00 0.00 175.30 174.99 1yaa n ASP 42 N 2.22 -0.18 0.00 0.23 5.68 -0.92 -4.77 116.55 118.81 1yaa n ASP 42 Ca -0.17 -0.23 0.08 0.00 -0.50 0.00 0.00 54.79 53.97 1yaa n ASP 42 Cb 0.56 0.00 0.41 0.00 -1.14 0.00 0.00 41.12 40.95 1yaa n ASP 42 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1yaa n ASP 43 N -0.97 0.00 -0.44 -1.12 8.00 -1.26 -2.19 116.55 118.57 1yaa n ASP 43 Ca 0.00 0.07 0.05 0.00 0.71 0.00 0.00 54.79 55.62 1yaa n ASP 43 Cb 0.00 -0.29 0.08 0.00 -0.02 0.00 0.00 41.12 40.89 1yaa n ASP 43 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1yaa n ASN 44 N -1.29 2.24 -1.40 -2.24 4.13 -1.26 -4.45 115.26 110.99 1yaa n ASN 44 Ca 0.08 -1.68 -0.10 0.00 1.68 0.00 0.00 54.58 54.55 1yaa n ASN 44 Cb 0.13 -0.09 0.01 0.00 -1.54 0.00 0.00 39.78 38.29 1yaa n ASN 44 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1yaa n GLY 45 N 0.42 0.04 3.23 7.41 0.00 -0.93 -5.04 105.19 110.32 1yaa n GLY 45 Ca 0.07 -0.39 -0.21 0.00 0.00 0.00 0.00 46.02 45.49 1yaa n GLY 45 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1yaa s LYS 46 N -4.84 0.98 0.13 1.61 -2.85 -1.26 -4.86 119.74 108.65 1yaa s LYS 46 Ca 0.09 -1.07 -0.35 0.00 -1.00 0.00 0.00 55.97 53.64 1yaa s LYS 46 Cb -0.04 -1.13 -0.16 0.00 -2.06 0.00 0.00 37.83 34.44 1yaa s LYS 46 CO 0.11 0.26 1.29 -0.35 0.10 0.00 0.00 175.35 176.75 1yaa n PRO 47 N 1.17 1.24 -3.80 1.78 -0.04 -1.26 -2.17 135.00 131.93 1yaa n PRO 47 Ca -0.20 0.44 -0.35 0.00 -0.04 0.00 0.00 63.50 63.35 1yaa n PRO 47 Cb 0.54 -2.04 -0.12 0.00 -0.04 0.00 0.00 33.50 31.84 1yaa n PRO 47 CO 0.00 0.00 0.00 -0.46 -0.04 0.00 0.00 175.50 175.00 1yaa s TRP 48 N 0.23 3.55 -0.12 0.54 -0.00 -1.26 -4.86 118.94 117.02 1yaa s TRP 48 Ca 0.79 -2.59 -0.29 0.00 -0.00 0.00 0.00 56.10 54.01 1yaa s TRP 48 Cb -0.89 -3.17 -0.03 0.00 -0.00 0.00 0.00 33.47 29.38 1yaa s TRP 48 CO 0.48 -0.93 1.40 0.08 -0.00 0.00 0.00 176.95 177.99 1yaa s VAL 49 N 0.79 4.02 0.27 5.86 1.01 -1.26 -4.96 120.40 126.13 1yaa s VAL 49 Ca 0.11 1.24 -0.31 0.00 0.00 0.00 0.00 61.98 63.02 1yaa s VAL 49 Cb -0.22 -3.80 -0.12 0.00 0.00 0.00 0.00 36.38 32.24 1yaa s VAL 49 CO -0.04 -0.11 1.53 0.18 0.00 0.00 0.00 175.10 176.66 1yaa n LEU 50 N 6.74 3.90 -0.33 3.92 4.32 -1.26 -4.84 117.00 129.45 1yaa n LEU 50 Ca 0.15 1.14 0.11 0.00 -0.02 0.00 0.00 56.01 57.39 1yaa n LEU 50 Cb 0.44 -1.53 0.28 0.00 -1.62 0.00 0.00 43.42 40.99 1yaa n LEU 50 CO 0.58 -0.08 1.15 -0.65 -1.22 0.00 0.00 177.39 177.17 1yaa h PRO 51 N 4.63 0.67 -0.43 3.23 0.11 -1.94 -0.00 132.00 138.26 1yaa h PRO 51 Ca -0.46 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 65.54 1yaa h PRO 51 Cb 1.24 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 1yaa h PRO 51 CO 0.78 0.44 0.00 0.66 -0.21 0.00 0.00 178.00 179.68 1yaa h SER 52 N 0.69 0.67 1.19 -2.05 4.64 -1.90 -1.68 113.55 115.10 1yaa h SER 52 Ca 0.53 -0.15 -0.14 0.00 -0.47 0.00 0.00 61.79 61.56 1yaa h SER 52 Cb 0.81 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 62.70 1yaa h SER 52 CO -0.39 0.74 -0.66 -0.37 -0.87 0.00 0.00 176.83 175.28 1yaa h VAL 53 N 0.66 1.19 -0.49 0.95 -1.51 -1.48 -1.08 116.25 114.50 1yaa h VAL 53 Ca 0.13 -2.54 -0.11 0.00 -1.23 0.00 0.00 66.70 62.96 1yaa h VAL 53 Cb 0.41 2.49 -0.02 0.00 -2.13 0.00 0.00 31.29 32.04 1yaa h VAL 53 CO 0.02 0.65 -0.12 0.11 -1.23 0.00 0.00 177.57 176.99 1yaa h LYS 54 N 0.00 0.91 -0.30 5.19 1.57 -0.71 -0.23 116.57 123.00 1yaa h LYS 54 Ca -0.01 -0.33 -0.16 0.00 -1.87 0.00 0.00 60.65 58.28 1yaa h LYS 54 Cb 1.44 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 33.68 1yaa h LYS 54 CO 0.09 0.98 -0.45 0.00 -0.57 0.00 0.00 179.45 179.50 1yaa h ALA 55 N 1.04 0.46 -0.37 3.86 0.00 -1.22 -2.88 119.26 120.15 1yaa h ALA 55 Ca 0.13 -0.48 -0.08 0.00 0.00 0.00 0.00 54.91 54.49 1yaa h ALA 55 Cb 0.66 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 1yaa h ALA 55 CO 0.05 0.60 -0.09 0.00 0.00 0.00 0.00 179.25 179.81 1yaa h ALA 56 N 0.69 1.16 -0.42 0.00 0.00 -0.95 -2.96 119.26 116.79 1yaa h ALA 56 Ca 0.03 -0.28 -0.12 0.00 0.00 0.00 0.00 54.91 54.54 1yaa h ALA 56 Cb 1.05 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 1yaa h ALA 56 CO 0.10 0.53 -0.22 0.93 0.00 0.00 0.00 179.25 180.60 1yaa h GLU 57 N 0.58 0.85 -0.09 0.00 5.08 -0.99 -2.74 114.58 117.26 1yaa h GLU 57 Ca 0.11 -0.35 0.00 0.00 -1.00 0.00 0.00 59.36 58.12 1yaa h GLU 57 Cb 0.50 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 1yaa h GLU 57 CO 0.03 0.99 0.05 0.87 -1.00 0.00 0.00 179.01 179.95 1yaa h LYS 58 N 0.74 0.10 -0.53 2.33 1.57 -1.35 -2.25 116.57 117.18 1yaa h LYS 58 Ca 0.10 -0.01 0.09 0.00 -1.87 0.00 0.00 60.65 58.96 1yaa h LYS 58 Cb 0.76 -0.02 -0.07 0.00 0.08 0.00 0.00 32.23 32.98 1yaa h LYS 58 CO 0.06 0.07 0.12 -0.07 -0.57 0.00 0.00 179.45 179.06 1yaa h LEU 59 N 0.10 0.03 -0.67 2.94 4.07 -1.43 0.16 115.31 120.52 1yaa h LEU 59 Ca 0.04 0.09 -0.04 0.00 0.08 0.00 0.00 57.88 58.05 1yaa h LEU 59 Cb 0.00 0.12 -0.03 0.00 1.08 0.00 0.00 40.66 41.83 1yaa h LEU 59 CO -0.02 0.04 0.26 0.40 -1.08 0.00 0.00 178.44 178.03 1yaa h ILE 60 N 0.26 1.24 -0.01 1.22 2.04 -1.37 -2.97 117.51 117.92 1yaa h ILE 60 Ca 0.27 -0.77 -0.16 0.00 1.00 0.00 0.00 64.86 65.20 1yaa h ILE 60 Cb 0.36 0.49 -0.02 0.00 -0.74 0.00 0.00 36.82 36.92 1yaa h ILE 60 CO -0.34 0.30 -0.73 0.45 0.00 0.00 0.00 178.15 177.84 1yaa h HIS 61 N 0.95 0.12 0.00 1.37 3.86 -0.77 -3.05 115.15 117.63 1yaa h HIS 61 Ca 0.22 -0.06 0.00 0.00 -1.16 0.00 0.00 60.37 59.37 1yaa h HIS 61 Cb 0.22 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 28.67 1yaa h HIS 61 CO 0.01 0.78 0.00 0.09 0.86 0.00 0.00 177.93 179.68 1yaa n ASN 62 N -3.72 0.00 -4.68 2.45 4.13 0.51 -4.72 115.26 109.24 1yaa n ASN 62 Ca -0.02 -1.09 -0.40 0.00 1.68 0.00 0.00 54.58 54.75 1yaa n ASN 62 Cb 0.71 0.00 -0.05 0.00 -1.54 0.00 0.00 39.78 38.90 1yaa n ASN 62 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1yaa s ASP 63 N -1.79 6.83 0.45 6.41 -1.08 -1.15 -4.92 116.67 121.42 1yaa s ASP 63 Ca 0.32 1.01 0.30 0.00 -0.52 0.00 0.00 52.55 53.66 1yaa s ASP 63 Cb 0.15 -2.39 1.12 0.00 -1.46 0.00 0.00 42.92 40.33 1yaa s ASP 63 CO 0.25 -0.28 1.86 0.77 0.52 0.00 0.00 175.17 178.29 1yaa h SER 64 N 7.28 0.00 -0.34 -0.34 4.64 -1.89 -2.37 113.55 120.53 1yaa h SER 64 Ca -0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.99 1yaa h SER 64 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 1yaa h SER 64 CO 0.79 0.00 0.00 -0.24 -0.87 0.00 0.00 176.83 176.51 1yaa n SER 65 N -2.85 1.82 -4.76 4.97 2.88 -1.26 -4.93 113.62 109.48 1yaa n SER 65 Ca 0.02 -1.99 -0.41 0.00 -1.33 0.00 0.00 58.87 55.16 1yaa n SER 65 Cb 0.32 -0.22 -0.02 0.00 -0.75 0.00 0.00 64.21 63.54 1yaa n SER 65 CO 0.00 0.00 0.00 -0.47 -1.23 0.00 0.00 175.04 173.34 1yaa s TYR 66 N -1.55 3.01 0.36 0.66 5.04 -0.89 -5.01 117.35 118.96 1yaa s TYR 66 Ca 0.23 1.26 -0.17 0.00 -2.44 0.00 0.00 57.07 55.95 1yaa s TYR 66 Cb 0.12 -3.75 0.05 0.00 0.35 0.00 0.00 41.96 38.73 1yaa s TYR 66 CO 0.16 -2.22 0.80 0.54 -1.34 0.00 0.00 175.55 173.49 1yaa s ASN 67 N -0.14 -0.03 -0.27 4.32 2.20 -1.26 -5.05 114.94 114.71 1yaa s ASN 67 Ca 0.53 -1.05 0.08 0.00 -0.94 0.00 0.00 52.86 51.48 1yaa s ASN 67 Cb -0.41 0.81 0.45 0.00 -2.00 0.00 0.00 41.25 40.10 1yaa s ASN 67 CO 0.50 -1.61 1.20 1.41 -2.94 0.00 0.00 177.10 175.67 1yaa n HIS 68 N -0.53 1.87 -1.52 1.54 8.25 -1.26 -4.96 115.22 118.61 1yaa n HIS 68 Ca -0.08 -1.99 -0.31 0.00 -0.26 0.00 0.00 57.72 55.08 1yaa n HIS 68 Cb 0.60 -0.31 0.06 0.00 1.12 0.00 0.00 29.99 31.45 1yaa n HIS 68 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1yaa s GLU 69 N -3.48 2.82 0.51 -0.41 0.41 -1.26 -5.01 118.70 112.28 1yaa s GLU 69 Ca 0.47 0.99 -0.22 0.00 -0.41 0.00 0.00 54.97 55.80 1yaa s GLU 69 Cb 0.40 -1.97 -0.06 0.00 -1.78 0.00 0.00 34.13 30.71 1yaa s GLU 69 CO 0.00 -1.19 1.25 0.71 -0.49 0.00 0.00 175.26 175.54 1yaa s TYR 70 N -3.02 2.57 0.61 1.61 2.02 -1.26 -4.91 117.35 114.97 1yaa s TYR 70 Ca 0.59 1.46 0.06 0.00 -0.37 0.00 0.00 57.07 58.81 1yaa s TYR 70 Cb -0.15 -3.57 0.10 0.00 -0.40 0.00 0.00 41.96 37.94 1yaa s TYR 70 CO 0.55 -2.18 0.84 -0.51 -1.57 0.00 0.00 175.55 172.68 1yaa s LEU 71 N -3.34 3.10 0.88 -1.29 1.43 -1.26 -5.08 118.68 113.12 1yaa s LEU 71 Ca 0.68 -0.67 -0.12 0.00 -1.03 0.00 0.00 54.13 52.99 1yaa s LEU 71 Cb -0.34 -1.80 0.12 0.00 0.03 0.00 0.00 46.19 44.20 1yaa s LEU 71 CO 0.40 -1.47 1.09 -0.83 0.23 0.00 0.00 176.35 175.78 1yaa s GLY 72 N -4.67 1.62 0.22 -3.19 0.00 -1.25 -4.89 107.32 95.16 1yaa s GLY 72 Ca 0.63 -0.12 -0.08 0.00 0.00 0.00 0.00 44.72 45.16 1yaa s GLY 72 CO 0.40 0.37 1.76 -2.22 0.00 0.00 0.00 173.10 173.40 1yaa h ILE 73 N -1.46 0.78 0.00 0.90 1.08 -1.97 -1.50 117.51 115.34 1yaa h ILE 73 Ca -0.49 -0.17 0.00 0.00 -0.39 0.00 0.00 64.86 63.81 1yaa h ILE 73 Cb 1.28 0.25 0.00 0.00 -3.07 0.00 0.00 36.82 35.28 1yaa h ILE 73 CO 0.56 0.09 0.00 0.35 -0.69 0.00 0.00 178.15 178.46 1yaa n THR 74 N -4.94 0.00 0.00 -0.27 -2.24 -1.26 -4.49 114.28 101.08 1yaa n THR 74 Ca 0.10 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.88 1yaa n THR 74 Cb 0.30 -0.52 0.00 0.00 -2.10 0.00 0.00 70.33 68.01 1yaa n THR 74 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yaa n GLY 75 N 0.94 -1.64 3.62 3.38 0.00 -0.57 -1.04 105.19 109.88 1yaa n GLY 75 Ca 0.23 -2.06 -0.42 0.00 0.00 0.00 0.00 46.02 43.78 1yaa n GLY 75 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1yaa s LEU 76 N 0.00 4.08 0.24 0.99 0.20 -1.26 -3.83 118.68 119.10 1yaa s LEU 76 Ca 0.00 0.70 -0.05 0.00 0.69 0.00 0.00 54.13 55.47 1yaa s LEU 76 Cb 0.00 -3.09 0.42 0.00 -0.43 0.00 0.00 46.19 43.09 1yaa s LEU 76 CO 0.00 -0.61 1.75 -0.65 -0.29 0.00 0.00 176.35 176.55 1yaa h PRO 77 N 8.09 0.50 0.00 0.98 0.11 -2.00 -1.68 132.00 137.99 1yaa h PRO 77 Ca -0.24 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.82 1yaa h PRO 77 Cb 1.10 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 32.09 1yaa h PRO 77 CO 0.88 0.33 -0.07 0.66 -0.21 0.00 0.00 178.00 179.59 1yaa h SER 78 N 0.51 0.00 0.14 -2.05 4.64 -1.98 -1.48 113.55 113.33 1yaa h SER 78 Ca 0.39 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.71 1yaa h SER 78 Cb 0.54 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 1yaa h SER 78 CO -0.35 0.07 -0.07 0.25 -0.87 0.00 0.00 176.83 175.86 1yaa h LEU 79 N 0.00 -0.16 -0.72 5.97 6.46 -1.63 -3.03 115.31 122.20 1yaa h LEU 79 Ca -0.00 -0.20 0.00 0.00 -0.12 0.00 0.00 57.88 57.56 1yaa h LEU 79 Cb 0.54 0.04 -0.04 0.00 -0.73 0.00 0.00 40.66 40.48 1yaa h LEU 79 CO 0.01 0.39 0.46 0.71 -0.62 0.00 0.00 178.44 179.39 1yaa h THR 80 N -1.00 1.20 0.27 1.05 1.35 -1.46 -0.12 112.91 114.19 1yaa h THR 80 Ca -0.02 -0.39 -0.01 0.00 -0.55 0.00 0.00 66.41 65.44 1yaa h THR 80 Cb 0.35 0.16 0.00 0.00 -1.73 0.00 0.00 68.15 66.93 1yaa h THR 80 CO 0.03 0.19 -0.13 -1.28 -0.25 0.00 0.00 175.52 174.09 1yaa h SER 81 N 0.98 -0.31 1.07 5.36 0.87 -1.42 -2.02 113.55 118.09 1yaa h SER 81 Ca 0.26 -0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.77 1yaa h SER 81 Cb -0.08 0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 61.95 1yaa h SER 81 CO -0.05 -0.20 -0.22 0.78 -0.53 0.00 0.00 176.83 176.60 1yaa h ASN 82 N -0.38 0.00 0.21 6.23 2.35 -1.42 -3.15 115.58 119.42 1yaa h ASN 82 Ca -0.04 0.00 -0.22 0.00 -0.55 0.00 0.00 56.30 55.49 1yaa h ASN 82 Cb 0.29 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.66 1yaa h ASN 82 CO 0.06 0.22 -0.88 0.00 -1.65 0.00 0.00 177.43 175.19 1yaa h ALA 83 N 1.78 0.39 -0.14 -0.83 0.00 -0.89 -3.09 119.26 116.48 1yaa h ALA 83 Ca -0.00 -0.67 -0.06 0.00 0.00 0.00 0.00 54.91 54.18 1yaa h ALA 83 Cb 0.82 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 1yaa h ALA 83 CO 0.03 0.77 -0.18 0.00 0.00 0.00 0.00 179.25 179.87 1yaa h ALA 84 N 0.73 1.44 -0.10 0.00 0.00 -1.33 -3.02 119.26 116.98 1yaa h ALA 84 Ca -0.07 -0.24 -0.18 0.00 0.00 0.00 0.00 54.91 54.42 1yaa h ALA 84 Cb 1.50 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 19.20 1yaa h ALA 84 CO 0.16 0.39 -0.70 0.87 0.00 0.00 0.00 179.25 179.97 1yaa h LYS 85 N 0.21 0.45 0.00 0.00 1.57 -1.51 -1.81 116.57 115.48 1yaa h LYS 85 Ca 0.04 -0.35 -0.11 0.00 -1.87 0.00 0.00 60.65 58.36 1yaa h LYS 85 Cb 0.45 0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.81 1yaa h LYS 85 CO 0.03 0.98 -0.54 -0.84 -0.57 0.00 0.00 179.45 178.51 1yaa h ILE 86 N 0.32 1.32 0.04 1.86 3.07 -1.46 -1.23 117.51 121.43 1yaa h ILE 86 Ca -0.02 -1.90 -0.37 0.00 1.55 0.00 0.00 64.86 64.12 1yaa h ILE 86 Cb 1.27 2.04 -0.04 0.00 -0.27 0.00 0.00 36.82 39.81 1yaa h ILE 86 CO 0.12 0.53 -2.11 0.00 -1.05 0.00 0.00 178.15 175.64 1yaa n ILE 87 N -3.79 1.61 0.14 0.16 3.06 -1.22 -4.42 119.36 114.89 1yaa n ILE 87 Ca -0.01 -0.48 0.03 0.00 -2.50 0.00 0.00 62.75 59.79 1yaa n ILE 87 Cb 0.57 -1.71 0.02 0.00 0.54 0.00 0.00 39.64 39.06 1yaa n ILE 87 CO 0.00 0.00 0.00 -0.26 -2.50 0.00 0.00 176.55 173.79 1yaa h PHE 88 N -0.31 0.00 0.00 9.51 0.04 -1.45 -3.42 116.94 121.31 1yaa h PHE 88 Ca -0.51 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.26 1yaa h PHE 88 Cb 1.80 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.95 1yaa h PHE 88 CO 0.04 0.48 0.00 0.41 -0.60 0.00 0.00 178.31 178.64 1yaa n GLY 89 N 1.23 1.39 0.33 -1.45 0.00 -0.47 -4.44 105.19 101.78 1yaa n GLY 89 Ca 0.01 -1.55 -0.02 0.00 0.00 0.00 0.00 46.02 44.46 1yaa n GLY 89 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1yaa h THR 90 N 0.00 1.22 -0.84 2.61 1.35 -1.91 -2.86 112.91 112.48 1yaa h THR 90 Ca 0.00 -0.63 -0.45 0.00 -0.55 0.00 0.00 66.41 64.77 1yaa h THR 90 Cb 0.00 0.38 -0.26 0.00 -1.73 0.00 0.00 68.15 66.54 1yaa h THR 90 CO 0.00 0.26 0.58 0.00 -0.25 0.00 0.00 175.52 176.11 1yaa n GLN 91 N -4.33 2.10 -2.45 4.72 6.02 -1.26 -4.86 117.38 117.32 1yaa n GLN 91 Ca 0.06 -2.56 -0.41 0.00 -0.01 0.00 0.00 57.00 54.08 1yaa n GLN 91 Cb 0.14 -2.00 -0.04 0.00 1.02 0.00 0.00 30.24 29.36 1yaa n GLN 91 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1yaa s SER 92 N -0.97 7.21 0.39 1.08 0.15 -1.08 -4.94 113.70 115.53 1yaa s SER 92 Ca 0.49 2.25 0.15 0.00 0.70 0.00 0.00 55.95 59.53 1yaa s SER 92 Cb 0.41 -2.62 0.78 0.00 -1.71 0.00 0.00 66.02 62.88 1yaa s SER 92 CO 0.08 -0.22 1.84 0.44 1.20 0.00 0.00 173.24 176.58 1yaa h ASP 93 N 4.34 0.00 0.06 5.45 3.32 -1.92 -1.43 116.42 126.24 1yaa h ASP 93 Ca -0.46 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.48 1yaa h ASP 93 Cb 1.21 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.75 1yaa h ASP 93 CO 0.69 0.35 -0.37 0.00 -1.72 0.00 0.00 179.24 178.19 1yaa h ALA 94 N 1.65 1.00 0.11 3.45 0.00 -1.93 -0.70 119.26 122.84 1yaa h ALA 94 Ca -0.00 -0.41 -0.25 0.00 0.00 0.00 0.00 54.91 54.25 1yaa h ALA 94 Cb 0.65 -0.10 0.03 0.00 0.00 0.00 0.00 17.79 18.36 1yaa h ALA 94 CO 0.05 0.61 -1.05 -0.07 0.00 0.00 0.00 179.25 178.78 1yaa h LEU 95 N 0.36 0.73 -1.03 0.00 3.38 -1.80 -1.30 115.31 115.64 1yaa h LEU 95 Ca 0.04 -0.84 -0.08 0.00 0.09 0.00 0.00 57.88 57.08 1yaa h LEU 95 Cb 0.82 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 1yaa h LEU 95 CO 0.07 1.50 -0.38 1.56 0.09 0.00 0.00 178.44 181.28 1yaa h GLN 96 N 0.06 0.00 -0.03 1.13 1.08 -1.24 -2.86 115.11 113.24 1yaa h GLN 96 Ca -0.16 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.04 1yaa h GLN 96 Cb 1.76 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 29.19 1yaa h GLN 96 CO 0.20 0.38 0.00 0.39 -0.95 0.00 0.00 178.83 178.85 1yaa n GLU 97 N -3.64 1.73 -2.04 1.46 1.02 -0.27 -4.95 120.64 113.95 1yaa n GLU 97 Ca -0.01 -1.06 -0.17 0.00 -0.02 0.00 0.00 57.16 55.90 1yaa n GLU 97 Cb 0.49 -1.47 -0.03 0.00 -0.02 0.00 0.00 31.44 30.41 1yaa n GLU 97 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1yaa n ASP 98 N 0.29 -5.05 -0.29 1.62 9.92 -1.08 -4.90 116.55 117.06 1yaa n ASP 98 Ca 0.18 0.13 0.14 0.00 -0.53 0.00 0.00 54.79 54.72 1yaa n ASP 98 Cb 0.37 -4.11 0.61 0.00 -0.64 0.00 0.00 41.12 37.35 1yaa n ASP 98 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1yaa n ARG 99 N -2.60 1.27 -3.59 -1.24 1.74 -0.50 -4.87 116.66 106.88 1yaa n ARG 99 Ca -0.19 -0.59 -0.36 0.00 -0.77 0.00 0.00 57.85 55.94 1yaa n ARG 99 Cb 0.62 -1.49 -0.07 0.00 -1.02 0.00 0.00 32.46 30.50 1yaa n ARG 99 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1yaa s VAL 100 N -2.13 5.33 -0.20 1.55 1.01 -1.22 -0.87 120.40 123.87 1yaa s VAL 100 Ca 0.37 0.45 -0.04 0.00 0.00 0.00 0.00 61.98 62.76 1yaa s VAL 100 Cb 0.21 -3.59 -0.02 0.00 0.00 0.00 0.00 36.38 32.98 1yaa s VAL 100 CO 0.39 0.40 -0.03 -0.63 0.00 0.00 0.00 175.10 175.23 1yaa s ILE 101 N 0.46 3.65 -0.06 2.22 1.01 -0.31 -4.95 121.20 123.23 1yaa s ILE 101 Ca 0.14 -0.41 0.02 0.00 0.00 0.00 0.00 60.65 60.39 1yaa s ILE 101 Cb -0.12 -2.64 0.02 0.00 0.01 0.00 0.00 42.46 39.72 1yaa s ILE 101 CO 0.02 0.44 -0.10 -0.44 0.00 0.00 0.00 174.94 174.86 1yaa s SER 102 N 1.09 1.65 0.10 3.58 0.01 -1.26 -0.21 113.70 118.66 1yaa s SER 102 Ca 0.02 -0.27 0.04 0.00 1.31 0.00 0.00 55.95 57.05 1yaa s SER 102 Cb -0.15 -0.75 -0.04 0.00 0.21 0.00 0.00 66.02 65.29 1yaa s SER 102 CO 0.00 0.00 -0.10 0.68 0.41 0.00 0.00 173.24 174.24 1yaa s VAL 103 N 0.79 0.95 0.13 3.43 -7.23 -0.30 -4.96 120.40 113.22 1yaa s VAL 103 Ca -0.12 -1.69 -0.29 0.00 -1.81 0.00 0.00 61.98 58.06 1yaa s VAL 103 Cb -0.15 -1.42 -0.06 0.00 0.56 0.00 0.00 36.38 35.30 1yaa s VAL 103 CO 0.02 -0.59 0.94 -1.58 -0.31 0.00 0.00 175.10 173.58 1yaa s GLN 104 N -2.92 4.71 0.23 4.82 0.74 -0.21 -0.53 119.66 126.50 1yaa s GLN 104 Ca 0.07 1.42 0.04 0.00 0.05 0.00 0.00 55.36 56.94 1yaa s GLN 104 Cb -0.02 -3.35 -0.05 0.00 1.10 0.00 0.00 33.01 30.68 1yaa s GLN 104 CO -0.00 0.29 -0.02 -1.54 -0.55 0.00 0.00 175.29 173.47 1yaa s SER 105 N -0.27 1.96 -0.97 6.67 1.04 -0.60 -4.77 113.70 116.76 1yaa s SER 105 Ca 0.45 -1.20 -0.20 0.00 0.48 0.00 0.00 55.95 55.48 1yaa s SER 105 Cb -0.24 -0.02 -0.10 0.00 0.10 0.00 0.00 66.02 65.76 1yaa s SER 105 CO 0.30 -0.48 2.00 0.18 0.98 0.00 0.00 173.24 176.22 1yaa n LEU 106 N -0.43 4.73 0.00 2.42 7.99 -1.26 -2.74 117.00 127.71 1yaa n LEU 106 Ca -0.05 -3.23 0.00 0.00 -0.01 0.00 0.00 56.01 52.72 1yaa n LEU 106 Cb 0.64 -1.29 0.00 0.00 -0.11 0.00 0.00 43.42 42.66 1yaa n LEU 106 CO 0.37 -0.07 0.00 -0.24 -1.51 0.00 0.00 177.39 175.94 1yaa n SER 107 N 7.51 -1.23 0.05 -1.43 2.88 -1.11 -1.31 113.62 118.98 1yaa n SER 107 Ca 0.50 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.95 1yaa n SER 107 Cb 0.41 0.00 0.05 0.00 -0.75 0.00 0.00 64.21 63.91 1yaa n SER 107 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 1yaa h GLY 108 N 0.00 0.42 1.41 0.46 0.00 -1.83 -2.58 103.07 100.96 1yaa h GLY 108 Ca 0.00 -0.58 -0.07 0.00 0.00 0.00 0.00 47.33 46.68 1yaa h GLY 108 CO 0.00 0.51 -0.04 -0.84 0.00 0.00 0.00 176.54 176.18 1yaa h THR 109 N 0.27 1.24 -0.01 4.70 2.02 -1.93 0.44 112.91 119.64 1yaa h THR 109 Ca -0.02 -1.01 -0.00 0.00 0.77 0.00 0.00 66.41 66.15 1yaa h THR 109 Cb 1.25 0.95 -0.00 0.00 -1.74 0.00 0.00 68.15 68.61 1yaa h THR 109 CO 0.12 0.35 0.00 1.23 0.37 0.00 0.00 175.52 177.59 1yaa h GLY 110 N 0.96 0.01 0.80 2.16 0.00 -1.13 0.11 103.07 105.98 1yaa h GLY 110 Ca 0.13 -0.01 0.04 0.00 0.00 0.00 0.00 47.33 47.49 1yaa h GLY 110 CO 0.02 0.01 0.39 0.00 0.00 0.00 0.00 176.54 176.96 1yaa h ALA 111 N 0.77 0.86 -0.57 3.60 0.00 -1.27 0.28 119.26 122.92 1yaa h ALA 111 Ca 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1yaa h ALA 111 Cb 0.24 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1yaa h ALA 111 CO 0.00 0.11 0.31 -0.07 0.00 0.00 0.00 179.25 179.60 1yaa h LEU 112 N 0.75 0.70 -0.17 0.00 4.07 -0.70 -2.10 115.31 117.86 1yaa h LEU 112 Ca 0.27 -0.05 -0.23 0.00 0.08 0.00 0.00 57.88 57.95 1yaa h LEU 112 Cb 0.08 -0.18 0.00 0.00 1.08 0.00 0.00 40.66 41.65 1yaa h LEU 112 CO -0.13 0.57 -0.94 -0.74 -1.08 0.00 0.00 178.44 176.12 1yaa h HIS 113 N 0.80 0.63 -0.12 1.13 2.76 0.28 -2.60 115.15 118.03 1yaa h HIS 113 Ca 0.20 -0.34 -0.06 0.00 -2.20 0.00 0.00 60.37 57.97 1yaa h HIS 113 Cb 0.03 -0.07 -0.01 0.00 1.55 0.00 0.00 27.41 28.91 1yaa h HIS 113 CO 0.00 1.16 -0.20 0.82 -1.30 0.00 0.00 177.93 178.42 1yaa h ILE 114 N 0.24 1.20 -0.11 6.26 2.04 -0.66 -1.15 117.51 125.34 1yaa h ILE 114 Ca -0.08 -0.94 -0.03 0.00 1.00 0.00 0.00 64.86 64.81 1yaa h ILE 114 Cb 1.58 1.33 -0.00 0.00 -0.74 0.00 0.00 36.82 38.99 1yaa h ILE 114 CO 0.16 0.28 -0.05 0.28 0.00 0.00 0.00 178.15 178.83 1yaa h SER 115 N 0.19 0.23 -0.53 1.72 0.02 -1.30 -2.19 113.55 111.69 1yaa h SER 115 Ca 0.03 -0.42 -0.03 0.00 -0.84 0.00 0.00 61.79 60.53 1yaa h SER 115 Cb 0.47 -0.06 -0.02 0.00 0.14 0.00 0.00 62.40 62.92 1yaa h SER 115 CO 0.03 0.60 0.20 0.00 -1.14 0.00 0.00 176.83 176.52 1yaa h ALA 116 N 0.64 0.69 -0.62 3.77 0.00 -1.21 -1.47 119.26 121.06 1yaa h ALA 116 Ca 0.02 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 1yaa h ALA 116 Cb 0.51 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 1yaa h ALA 116 CO 0.02 0.31 0.26 -0.22 0.00 0.00 0.00 179.25 179.61 1yaa h LYS 117 N 0.72 0.91 -0.45 0.00 1.63 -1.26 -0.31 116.57 117.82 1yaa h LYS 117 Ca 0.18 -0.16 0.00 0.00 -0.85 0.00 0.00 60.65 59.82 1yaa h LYS 117 Cb 0.21 -0.15 -0.02 0.00 -0.60 0.00 0.00 32.23 31.67 1yaa h LYS 117 CO -0.01 0.77 0.29 0.35 -3.45 0.00 0.00 179.45 177.39 1yaa h PHE 118 N 0.86 0.58 -0.52 1.91 3.57 -1.18 -1.56 116.94 120.60 1yaa h PHE 118 Ca 0.21 0.01 -0.11 0.00 3.53 0.00 0.00 57.97 61.61 1yaa h PHE 118 Cb 0.18 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 38.71 1yaa h PHE 118 CO 0.01 0.39 -0.10 0.74 -2.23 0.00 0.00 178.31 177.11 1yaa h PHE 119 N 0.60 1.07 0.00 0.41 0.04 -0.98 -1.82 116.94 116.27 1yaa h PHE 119 Ca 0.16 -0.21 -0.08 0.00 2.80 0.00 0.00 57.97 60.64 1yaa h PHE 119 Cb -0.04 -0.27 -0.01 0.00 2.20 0.00 0.00 35.95 37.83 1yaa h PHE 119 CO -0.04 1.01 -0.37 0.66 -0.60 0.00 0.00 178.31 178.97 1yaa h SER 120 N 0.86 0.00 0.07 2.17 4.64 -0.83 0.16 113.55 120.62 1yaa h SER 120 Ca 0.14 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.33 1yaa h SER 120 Cb 0.65 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.75 1yaa h SER 120 CO 0.05 0.37 -0.54 0.50 -0.87 0.00 0.00 176.83 176.34 1yaa h LYS 121 N 0.00 0.25 0.00 4.77 3.64 -1.06 -3.37 116.57 120.79 1yaa h LYS 121 Ca -0.00 -0.35 -0.33 0.00 -1.27 0.00 0.00 60.65 58.69 1yaa h LYS 121 Cb 0.68 0.12 -0.06 0.00 -0.41 0.00 0.00 32.23 32.56 1yaa h LYS 121 CO 0.05 1.12 -2.26 1.19 -2.27 0.00 0.00 179.45 177.28 1yaa n PHE 122 N -4.29 0.00 -3.11 1.91 3.72 -0.70 -4.79 117.46 110.20 1yaa n PHE 122 Ca -0.12 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.07 1yaa n PHE 122 Cb 0.68 -0.86 -0.04 0.00 -0.94 0.00 0.00 39.48 38.33 1yaa n PHE 122 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 1yaa n PHE 123 N -3.09 1.50 1.09 1.38 3.72 0.34 -4.93 117.46 117.48 1yaa n PHE 123 Ca -0.38 -3.88 0.06 0.00 -0.05 0.00 0.00 57.45 53.20 1yaa n PHE 123 Cb 0.94 -0.44 0.37 0.00 -0.94 0.00 0.00 39.48 39.40 1yaa n PHE 123 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1yaa n PRO 129 N 0.14 0.54 0.08 -1.08 -0.04 0.04 -2.71 135.00 131.98 1yaa n PRO 129 Ca 0.27 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.84 1yaa n PRO 129 Cb 0.56 -1.36 0.03 0.00 -0.04 0.00 0.00 33.50 32.69 1yaa n PRO 129 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1yaa n ASP 130 N -0.86 0.73 -4.74 3.54 5.75 -1.26 -4.77 116.55 114.94 1yaa n ASP 130 Ca 0.09 0.18 -0.41 0.00 -0.01 0.00 0.00 54.79 54.64 1yaa n ASP 130 Cb 0.04 0.54 -0.04 0.00 -1.03 0.00 0.00 41.12 40.64 1yaa n ASP 130 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1yaa s LYS 131 N -3.31 4.52 0.09 0.11 1.02 -1.10 -5.02 119.74 116.06 1yaa s LYS 131 Ca 0.01 1.84 -0.26 0.00 0.02 0.00 0.00 55.97 57.58 1yaa s LYS 131 Cb 0.11 -3.24 -0.06 0.00 -0.52 0.00 0.00 37.83 34.12 1yaa s LYS 131 CO 0.79 -0.03 0.82 -0.51 -0.92 0.00 0.00 175.35 175.49 1yaa s LEU 132 N -0.39 4.50 -0.43 3.17 1.43 -1.26 -4.56 118.68 121.14 1yaa s LEU 132 Ca 0.51 1.59 -0.13 0.00 -1.03 0.00 0.00 54.13 55.08 1yaa s LEU 132 Cb -0.32 -3.34 0.06 0.00 0.03 0.00 0.00 46.19 42.62 1yaa s LEU 132 CO 0.37 0.05 0.31 -0.69 0.23 0.00 0.00 176.35 176.62 1yaa s VAL 133 N -0.33 4.85 -0.19 -1.59 1.01 -0.57 -1.02 120.40 122.55 1yaa s VAL 133 Ca 0.40 -1.08 -0.25 0.00 0.00 0.00 0.00 61.98 61.05 1yaa s VAL 133 Cb -0.22 -3.86 -0.01 0.00 0.00 0.00 0.00 36.38 32.29 1yaa s VAL 133 CO 0.26 -0.47 0.85 -0.31 0.00 0.00 0.00 175.10 175.42 1yaa s TYR 134 N 1.57 3.39 0.06 5.22 1.51 0.13 -1.56 117.35 127.68 1yaa s TYR 134 Ca 0.03 1.25 0.06 0.00 -1.01 0.00 0.00 57.07 57.40 1yaa s TYR 134 Cb -0.22 -3.04 -0.04 0.00 -0.11 0.00 0.00 41.96 38.55 1yaa s TYR 134 CO 0.06 -0.30 -0.09 -0.51 -1.11 0.00 0.00 175.55 173.60 1yaa s LEU 135 N 2.39 3.06 0.73 -1.29 1.43 -0.87 -1.87 118.68 122.25 1yaa s LEU 135 Ca 0.38 -0.30 -0.11 0.00 -1.03 0.00 0.00 54.13 53.07 1yaa s LEU 135 Cb -0.16 -1.82 0.03 0.00 0.03 0.00 0.00 46.19 44.27 1yaa s LEU 135 CO 0.11 0.22 1.08 -0.94 0.23 0.00 0.00 176.35 177.04 1yaa s SER 136 N -1.88 4.95 -0.33 2.29 1.04 -1.26 -1.36 113.70 117.15 1yaa s SER 136 Ca 0.20 1.73 0.01 0.00 0.48 0.00 0.00 55.95 58.36 1yaa s SER 136 Cb -0.11 -2.51 0.08 0.00 0.10 0.00 0.00 66.02 63.58 1yaa s SER 136 CO 0.11 -1.74 0.05 -0.75 0.98 0.00 0.00 173.24 171.89 1yaa s LYS 137 N -4.94 1.99 0.22 4.02 2.20 -0.37 -3.11 119.74 119.75 1yaa s LYS 137 Ca 0.60 -1.61 -0.01 0.00 -0.36 0.00 0.00 55.97 54.58 1yaa s LYS 137 Cb -0.16 -3.24 0.05 0.00 -1.51 0.00 0.00 37.83 32.97 1yaa s LYS 137 CO 0.55 -0.83 0.30 -0.35 -0.36 0.00 0.00 175.35 174.66 1yaa n PRO 138 N 4.46 0.26 -3.75 4.03 -0.04 -1.26 -1.31 135.00 137.40 1yaa n PRO 138 Ca -0.05 -0.73 -0.12 0.00 -0.04 0.00 0.00 63.50 62.56 1yaa n PRO 138 Cb 0.42 -0.23 -0.02 0.00 -0.04 0.00 0.00 33.50 33.64 1yaa n PRO 138 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 1yaa n THR 139 N -1.94 0.00 -1.75 0.52 5.66 -1.18 -4.81 114.28 110.78 1yaa n THR 139 Ca 0.05 -1.48 -0.42 0.00 -3.05 0.00 0.00 64.05 59.15 1yaa n THR 139 Cb 0.17 0.99 -0.03 0.00 -1.55 0.00 0.00 70.33 69.91 1yaa n THR 139 CO 0.00 0.00 0.00 0.86 -3.05 0.00 0.00 175.07 172.88 1yaa s TRP 140 N -2.99 2.44 0.52 1.09 -0.00 -1.24 -4.51 118.94 114.26 1yaa s TRP 140 Ca 0.24 0.15 0.34 0.00 -0.00 0.00 0.00 56.10 56.84 1yaa s TRP 140 Cb -0.02 -4.13 1.49 0.00 -0.00 0.00 0.00 33.47 30.81 1yaa s TRP 140 CO 0.17 -4.52 1.79 0.00 -0.00 0.00 0.00 176.95 174.39 1yaa h ALA 141 N 7.96 3.01 0.00 5.86 0.00 -2.00 -1.39 119.26 132.70 1yaa h ALA 141 Ca -0.45 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1yaa h ALA 141 Cb 1.21 0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1yaa h ALA 141 CO 0.95 -1.38 -0.49 -1.71 0.00 0.00 0.00 179.25 176.62 1yaa n ASN 142 N -4.25 0.49 -0.19 0.00 4.05 -1.26 -4.36 115.26 109.73 1yaa n ASN 142 Ca 0.27 -0.18 -0.00 0.00 0.45 0.00 0.00 54.58 55.11 1yaa n ASN 142 Cb 1.23 0.21 0.10 0.00 1.23 0.00 0.00 39.78 42.55 1yaa n ASN 142 CO 0.00 0.00 0.00 0.45 -3.05 0.00 0.00 177.26 174.66 1yaa h HIS 143 N 0.00 0.27 0.07 1.20 3.86 -1.63 -2.71 115.15 116.21 1yaa h HIS 143 Ca 0.00 0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.24 1yaa h HIS 143 Cb 0.52 -0.03 0.00 0.00 1.06 0.00 0.00 27.41 28.96 1yaa h HIS 143 CO 0.00 0.02 -0.04 1.98 0.86 0.00 0.00 177.93 180.76 1yaa h MET 144 N 0.31 -0.10 -0.44 2.45 1.85 -1.78 -2.98 114.93 114.25 1yaa h MET 144 Ca 0.30 0.01 0.07 0.00 -0.61 0.00 0.00 59.70 59.47 1yaa h MET 144 Cb 0.41 0.02 -0.02 0.00 0.43 0.00 0.00 31.60 32.44 1yaa h MET 144 CO -0.35 0.01 0.30 0.00 -0.40 0.00 0.00 176.91 176.47 1yaa h ALA 145 N 0.74 2.05 -0.04 0.39 0.00 -1.77 -1.16 119.26 119.47 1yaa h ALA 145 Ca -0.01 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1yaa h ALA 145 Cb 0.15 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 1yaa h ALA 145 CO 0.02 -0.14 0.01 0.82 0.00 0.00 0.00 179.25 179.95 1yaa h ILE 146 N 0.28 1.21 -0.01 0.00 2.04 -1.33 -0.57 117.51 119.12 1yaa h ILE 146 Ca 0.20 -0.63 -0.21 0.00 1.00 0.00 0.00 64.86 65.22 1yaa h ILE 146 Cb 0.42 1.57 -0.00 0.00 -0.74 0.00 0.00 36.82 38.07 1yaa h ILE 146 CO -0.04 0.17 -0.88 -0.26 0.00 0.00 0.00 178.15 177.14 1yaa h PHE 147 N -0.19 0.48 0.00 1.37 0.04 -1.44 -3.11 116.94 114.08 1yaa h PHE 147 Ca 0.01 -0.25 -0.01 0.00 2.80 0.00 0.00 57.97 60.52 1yaa h PHE 147 Cb 0.27 -0.06 -0.00 0.00 2.20 0.00 0.00 35.95 38.36 1yaa h PHE 147 CO 0.01 1.06 -0.03 0.93 -0.60 0.00 0.00 178.31 179.68 1yaa h GLU 148 N 0.19 0.00 0.00 1.51 5.08 -1.26 -2.24 114.58 117.87 1yaa h GLU 148 Ca -0.06 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1yaa h GLU 148 Cb 1.50 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.75 1yaa h GLU 148 CO 0.15 0.03 -0.03 -0.97 -1.00 0.00 0.00 179.01 177.18 1yaa h ASN 149 N 0.00 0.00 -0.16 1.42 -1.24 -1.02 -1.52 115.58 113.05 1yaa h ASN 149 Ca -0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 1yaa h ASN 149 Cb 0.83 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.88 1yaa h ASN 149 CO 0.00 0.03 0.00 0.00 -1.29 0.00 0.00 177.43 176.17 1yaa n GLN 150 N -3.22 2.09 -1.29 6.67 1.13 -0.91 -4.97 117.38 116.87 1yaa n GLN 150 Ca -0.01 -1.92 0.00 0.00 -1.94 0.00 0.00 57.00 53.13 1yaa n GLN 150 Cb 0.21 -1.42 0.00 0.00 0.11 0.00 0.00 30.24 29.13 1yaa n GLN 150 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1yaa n GLY 151 N 1.22 0.43 3.81 1.08 0.00 -0.57 -4.77 105.19 106.40 1yaa n GLY 151 Ca 0.14 -0.96 -0.37 0.00 0.00 0.00 0.00 46.02 44.82 1yaa n GLY 151 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1yaa s LEU 152 N 0.00 4.39 0.11 0.99 1.43 -0.89 -5.01 118.68 119.70 1yaa s LEU 152 Ca 0.00 0.76 -0.28 0.00 -1.03 0.00 0.00 54.13 53.58 1yaa s LEU 152 Cb 0.00 -2.45 -0.06 0.00 0.03 0.00 0.00 46.19 43.71 1yaa s LEU 152 CO 0.00 0.27 0.87 -0.54 0.23 0.00 0.00 176.35 177.18 1yaa s LYS 153 N -0.61 4.63 -0.01 1.70 3.01 -1.26 -4.15 119.74 123.06 1yaa s LYS 153 Ca 0.21 1.29 0.05 0.00 -1.01 0.00 0.00 55.97 56.50 1yaa s LYS 153 Cb -0.15 -3.35 -0.03 0.00 -1.01 0.00 0.00 37.83 33.30 1yaa s LYS 153 CO 0.09 0.31 -0.14 0.95 0.51 0.00 0.00 175.35 177.07 1yaa s THR 154 N -0.29 3.06 0.00 2.17 -4.23 -1.26 -1.51 115.64 113.58 1yaa s THR 154 Ca 0.42 -0.89 0.00 0.00 -1.18 0.00 0.00 61.69 60.04 1yaa s THR 154 Cb -0.23 -2.25 0.00 0.00 1.34 0.00 0.00 72.50 71.36 1yaa s THR 154 CO 0.27 0.47 0.00 0.00 -0.54 0.00 0.00 174.62 174.83 1yaa n ALA 155 N 1.93 0.00 -3.01 3.99 0.00 -0.60 -4.91 120.51 117.90 1yaa n ALA 155 Ca -0.16 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.16 1yaa n ALA 155 Cb 0.52 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.90 1yaa n ALA 155 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1yaa s THR 156 N -0.27 0.08 0.03 0.00 -1.32 -1.26 -2.05 115.64 110.85 1yaa s THR 156 Ca 0.00 -0.68 0.07 0.00 -1.21 0.00 0.00 61.69 59.86 1yaa s THR 156 Cb 0.00 -0.90 -0.02 0.00 -1.51 0.00 0.00 72.50 70.07 1yaa s THR 156 CO 0.00 -0.38 -0.19 -0.72 -2.21 0.00 0.00 174.62 171.12 1yaa s TYR 158 N -2.42 1.70 0.23 9.09 -0.85 -0.46 -4.87 117.35 119.76 1yaa s TYR 158 Ca -0.06 -0.36 -0.31 0.00 -0.52 0.00 0.00 57.07 55.82 1yaa s TYR 158 Cb -0.01 -1.03 -0.11 0.00 0.38 0.00 0.00 41.96 41.19 1yaa s TYR 158 CO -0.03 0.06 1.63 -2.14 -1.52 0.00 0.00 175.55 173.55 1yaa s PRO 159 N -1.01 4.15 0.20 -3.49 0.02 -1.26 -1.24 135.00 132.37 1yaa s PRO 159 Ca 0.07 2.53 0.00 0.00 0.02 0.00 0.00 61.00 63.62 1yaa s PRO 159 Cb -0.08 -3.07 0.00 0.00 0.02 0.00 0.00 34.50 31.36 1yaa s PRO 159 CO 0.01 -0.66 0.00 0.98 -0.33 0.00 0.00 177.00 177.00 1yaa n TYR 160 N 3.23 -1.60 -3.17 6.54 9.36 -1.13 -3.77 117.16 126.63 1yaa n TYR 160 Ca 0.12 0.28 -0.42 0.00 3.32 0.00 0.00 57.90 61.20 1yaa n TYR 160 Cb 0.37 0.43 -0.07 0.00 -0.63 0.00 0.00 39.34 39.44 1yaa n TYR 160 CO 0.00 0.00 0.00 -0.46 0.22 0.00 0.00 176.86 176.62 1yaa s TRP 161 N -2.00 3.14 -0.76 2.98 -0.11 -0.43 -1.16 118.94 120.61 1yaa s TRP 161 Ca 0.00 0.16 -0.24 0.00 1.22 0.00 0.00 56.10 57.23 1yaa s TRP 161 Cb 0.00 -3.10 0.05 0.00 -1.50 0.00 0.00 33.47 28.92 1yaa s TRP 161 CO 0.00 -0.66 1.18 0.00 -4.62 0.00 0.00 176.95 172.85 1yaa s ALA 162 N 2.60 2.92 0.03 5.86 0.00 0.23 -4.87 121.76 128.53 1yaa s ALA 162 Ca 0.21 -1.74 -0.09 0.00 0.00 0.00 0.00 51.96 50.34 1yaa s ALA 162 Cb -0.15 -4.14 -0.03 0.00 0.00 0.00 0.00 23.12 18.80 1yaa s ALA 162 CO 0.15 -3.13 1.15 -0.97 0.00 0.00 0.00 175.76 172.97 1yaa h ASN 163 N 9.76 -0.51 0.21 0.00 -0.00 -1.95 -0.06 115.58 123.02 1yaa h ASN 163 Ca -0.20 0.06 0.00 0.00 -0.00 0.00 0.00 56.30 56.17 1yaa h ASN 163 Cb 1.05 0.20 0.00 0.00 -0.00 0.00 0.00 38.32 39.57 1yaa h ASN 163 CO 1.25 -0.13 0.00 -1.84 -0.00 0.00 0.00 177.43 176.72 1yaa n GLU 164 N -3.41 0.05 -0.01 6.67 0.28 -1.26 -2.31 120.64 120.64 1yaa n GLU 164 Ca -0.01 0.46 0.00 0.00 -0.16 0.00 0.00 57.16 57.45 1yaa n GLU 164 Cb 0.10 -1.64 0.01 0.00 1.43 0.00 0.00 31.44 31.34 1yaa n GLU 164 CO 0.00 0.00 0.00 -2.37 -0.16 0.00 0.00 177.13 174.60 1yaa n THR 165 N -1.74 0.76 -4.10 3.84 5.66 -1.16 -5.02 114.28 112.52 1yaa n THR 165 Ca 0.01 -0.78 -0.34 0.00 -3.05 0.00 0.00 64.05 59.89 1yaa n THR 165 Cb 0.07 0.60 -0.06 0.00 -1.55 0.00 0.00 70.33 69.39 1yaa n THR 165 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 1yaa n LYS 166 N -0.40 -1.14 -3.23 1.09 5.02 -0.06 -4.91 118.16 114.53 1yaa n LYS 166 Ca 0.01 0.11 -0.14 0.00 -2.02 0.00 0.00 58.31 56.27 1yaa n LYS 166 Cb 0.34 -4.59 -0.03 0.00 -0.02 0.00 0.00 35.03 30.73 1yaa n LYS 166 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1yaa n SER 167 N -2.22 1.74 -4.71 4.39 3.41 -1.07 -4.95 113.62 110.21 1yaa n SER 167 Ca 0.10 -2.07 -0.39 0.00 -0.26 0.00 0.00 58.87 56.24 1yaa n SER 167 Cb 0.45 0.37 -0.05 0.00 -0.26 0.00 0.00 64.21 64.72 1yaa n SER 167 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1yaa s LEU 168 N 0.00 4.26 -1.42 1.04 2.96 -1.26 -0.60 118.68 123.67 1yaa s LEU 168 Ca 0.06 0.96 -0.09 0.00 -0.22 0.00 0.00 54.13 54.84 1yaa s LEU 168 Cb 0.00 -2.88 0.06 0.00 0.50 0.00 0.00 46.19 43.88 1yaa s LEU 168 CO 0.04 -0.10 2.40 -0.67 -1.32 0.00 0.00 176.35 176.70 1yaa n ASP 169 N 4.02 6.92 -0.05 3.68 -0.08 -0.31 -4.77 116.55 125.96 1yaa n ASP 169 Ca -0.04 -2.94 -0.08 0.00 -1.51 0.00 0.00 54.79 50.23 1yaa n ASP 169 Cb 0.51 -1.49 -0.01 0.00 2.34 0.00 0.00 41.12 42.47 1yaa n ASP 169 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 1yaa h LEU 170 N 7.16 -0.48 -0.36 -2.67 7.12 -1.89 0.11 115.31 124.30 1yaa h LEU 170 Ca 0.66 0.11 0.06 0.00 0.13 0.00 0.00 57.88 58.83 1yaa h LEU 170 Cb 0.42 0.25 -0.05 0.00 -0.53 0.00 0.00 40.66 40.75 1yaa h LEU 170 CO 1.66 -0.18 0.03 -1.13 -0.13 0.00 0.00 178.44 178.69 1yaa h ASN 171 N -0.13 -0.08 0.51 1.25 -0.73 -1.97 -0.10 115.58 114.34 1yaa h ASN 171 Ca 0.13 0.07 -0.08 0.00 1.87 0.00 0.00 56.30 58.30 1yaa h ASN 171 Cb 0.33 0.12 -0.01 0.00 0.27 0.00 0.00 38.32 39.02 1yaa h ASN 171 CO -0.32 -0.00 -0.37 1.23 -0.37 0.00 0.00 177.43 177.59 1yaa h GLY 172 N 0.14 0.00 0.71 1.57 0.00 -1.79 -1.21 103.07 102.48 1yaa h GLY 172 Ca 0.17 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.49 1yaa h GLY 172 CO -0.26 0.00 -0.00 -2.75 0.00 0.00 0.00 176.54 173.53 1yaa h PHE 173 N 0.00 0.08 -0.19 5.60 3.04 0.26 -2.35 116.94 123.38 1yaa h PHE 173 Ca -0.00 -0.01 -0.08 0.00 3.98 0.00 0.00 57.97 61.85 1yaa h PHE 173 Cb 0.73 -0.02 -0.01 0.00 2.56 0.00 0.00 35.95 39.20 1yaa h PHE 173 CO 0.00 0.37 -0.24 -0.07 -2.02 0.00 0.00 178.31 176.35 1yaa h LEU 174 N -0.24 0.34 -0.81 0.59 3.38 -0.89 -2.71 115.31 114.97 1yaa h LEU 174 Ca 0.01 -0.11 -0.07 0.00 0.09 0.00 0.00 57.88 57.80 1yaa h LEU 174 Cb 0.34 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 1yaa h LEU 174 CO 0.00 0.59 0.10 -1.13 0.09 0.00 0.00 178.44 178.09 1yaa h ASN 175 N 0.31 0.94 -0.57 -0.43 -1.24 -1.11 -2.43 115.58 111.05 1yaa h ASN 175 Ca 0.05 -0.21 -0.09 0.00 0.71 0.00 0.00 56.30 56.75 1yaa h ASN 175 Cb 0.60 -0.25 -0.02 0.00 0.73 0.00 0.00 38.32 39.38 1yaa h ASN 175 CO 0.04 0.94 -0.00 0.00 -1.29 0.00 0.00 177.43 177.12 1yaa h ALA 176 N 1.17 0.87 -0.20 1.57 0.00 -1.11 -1.56 119.26 120.00 1yaa h ALA 176 Ca 0.19 -0.31 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 1yaa h ALA 176 Cb 0.41 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1yaa h ALA 176 CO 0.01 0.66 -0.12 0.82 0.00 0.00 0.00 179.25 180.62 1yaa h ILE 177 N 0.94 1.19 0.00 0.00 2.04 -1.30 -1.47 117.51 118.92 1yaa h ILE 177 Ca 0.17 -0.85 -0.14 0.00 1.00 0.00 0.00 64.86 65.04 1yaa h ILE 177 Cb 0.55 1.18 -0.02 0.00 -0.74 0.00 0.00 36.82 37.79 1yaa h ILE 177 CO 0.03 0.27 -0.71 1.56 0.00 0.00 0.00 178.15 179.30 1yaa h GLN 178 N 0.30 0.00 -0.01 2.37 1.08 -1.05 -3.29 115.11 114.51 1yaa h GLN 178 Ca 0.06 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.26 1yaa h GLN 178 Cb 0.40 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.83 1yaa h GLN 178 CO 0.02 0.62 -0.51 1.63 -0.95 0.00 0.00 178.83 179.64 1yaa n LYS 179 N -3.23 0.70 -2.82 1.46 4.76 -0.62 -4.91 118.16 113.49 1yaa n LYS 179 Ca 0.00 -0.52 -0.37 0.00 -2.87 0.00 0.00 58.31 54.55 1yaa n LYS 179 Cb 0.80 -1.49 -0.06 0.00 -1.84 0.00 0.00 35.03 32.44 1yaa n LYS 179 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1yaa s ALA 180 N -2.65 3.25 0.42 7.82 0.00 -0.58 -5.02 121.76 125.00 1yaa s ALA 180 Ca 0.17 0.49 -0.25 0.00 0.00 0.00 0.00 51.96 52.37 1yaa s ALA 180 Cb 0.18 -3.14 -0.08 0.00 0.00 0.00 0.00 23.12 20.08 1yaa s ALA 180 CO 0.63 0.20 1.29 -1.25 0.00 0.00 0.00 175.76 176.63 1yaa s PRO 181 N -1.92 3.90 0.55 0.00 0.04 -1.26 -4.95 135.00 131.36 1yaa s PRO 181 Ca 0.48 2.13 -0.18 0.00 0.04 0.00 0.00 61.00 63.47 1yaa s PRO 181 Cb -0.19 -2.70 -0.10 0.00 0.04 0.00 0.00 34.50 31.54 1yaa s PRO 181 CO 0.24 -0.54 0.36 0.39 0.04 0.00 0.00 177.00 177.49 1yaa n GLU 182 N 0.01 0.38 -1.27 4.56 1.02 -1.26 -2.61 120.64 121.46 1yaa n GLU 182 Ca 0.04 0.15 -0.09 0.00 -0.02 0.00 0.00 57.16 57.24 1yaa n GLU 182 Cb 0.44 -1.51 -0.04 0.00 -0.02 0.00 0.00 31.44 30.31 1yaa n GLU 182 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1yaa n GLY 183 N 1.97 1.09 3.84 0.62 0.00 -0.91 -4.99 105.19 106.81 1yaa n GLY 183 Ca 0.11 -0.47 -0.32 0.00 0.00 0.00 0.00 46.02 45.34 1yaa n GLY 183 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1yaa s SER 184 N -2.78 6.05 -0.33 1.61 0.01 -1.07 -4.62 113.70 112.56 1yaa s SER 184 Ca 0.00 1.59 -0.15 0.00 1.31 0.00 0.00 55.95 58.70 1yaa s SER 184 Cb 0.00 -2.50 -0.02 0.00 0.21 0.00 0.00 66.02 63.71 1yaa s SER 184 CO 0.00 -0.99 0.36 -0.63 0.41 0.00 0.00 173.24 172.39 1yaa s ILE 185 N -2.83 5.17 -0.45 1.44 -1.09 -0.19 -1.02 121.20 122.22 1yaa s ILE 185 Ca 0.59 0.12 -0.10 0.00 -2.23 0.00 0.00 60.65 59.02 1yaa s ILE 185 Cb -0.12 -3.80 0.10 0.00 -1.58 0.00 0.00 42.46 37.05 1yaa s ILE 185 CO 0.44 -0.06 0.32 -0.36 -1.23 0.00 0.00 174.94 174.05 1yaa s PHE 186 N 2.03 3.35 -0.47 3.97 0.40 -0.43 0.21 117.98 127.03 1yaa s PHE 186 Ca 0.12 -1.57 -0.28 0.00 -0.60 0.00 0.00 56.93 54.60 1yaa s PHE 186 Cb -0.16 -3.22 0.01 0.00 0.51 0.00 0.00 43.02 40.16 1yaa s PHE 186 CO 0.11 -0.90 1.40 0.08 0.70 0.00 0.00 175.22 176.61 1yaa s VAL 187 N 1.44 3.87 0.01 -0.44 1.01 -0.78 -2.04 120.40 123.46 1yaa s VAL 187 Ca 0.04 0.84 0.03 0.00 0.00 0.00 0.00 61.98 62.88 1yaa s VAL 187 Cb -0.25 -4.31 -0.04 0.00 0.00 0.00 0.00 36.38 31.78 1yaa s VAL 187 CO 0.02 -0.93 -0.03 -0.76 0.00 0.00 0.00 175.10 173.40 1yaa s LEU 188 N 5.65 3.37 -0.31 3.92 1.43 0.67 -4.52 118.68 128.89 1yaa s LEU 188 Ca 0.57 -0.08 -0.21 0.00 -1.03 0.00 0.00 54.13 53.38 1yaa s LEU 188 Cb -0.12 -1.95 -0.01 0.00 0.03 0.00 0.00 46.19 44.15 1yaa s LEU 188 CO 0.30 0.27 0.67 -1.00 0.23 0.00 0.00 176.35 176.82 1yaa s HIS 189 N -1.07 3.21 0.26 0.29 3.76 -1.26 0.11 115.29 120.58 1yaa s HIS 189 Ca 0.19 0.63 -0.02 0.00 -0.15 0.00 0.00 55.06 55.71 1yaa s HIS 189 Cb -0.11 -3.05 0.47 0.00 1.11 0.00 0.00 32.58 30.99 1yaa s HIS 189 CO 0.10 -0.50 1.79 0.77 -0.85 0.00 0.00 174.74 176.05 1yaa h SER 190 N 8.18 0.63 -5.04 1.40 0.02 -1.78 -3.46 113.55 113.51 1yaa h SER 190 Ca -0.26 0.07 0.24 0.00 -0.84 0.00 0.00 61.79 60.99 1yaa h SER 190 Cb 1.11 -0.05 -0.14 0.00 0.14 0.00 0.00 62.40 63.47 1yaa h SER 190 CO 0.82 0.32 0.70 0.00 -1.14 0.00 0.00 176.83 177.53 1yaa n ALA 192 N -0.33 -2.54 -1.63 0.00 0.00 -1.26 -4.66 120.51 110.09 1yaa n ALA 192 Ca -0.05 -0.08 -0.53 0.00 0.00 0.00 0.00 53.44 52.78 1yaa n ALA 192 Cb 0.61 -4.02 -0.06 0.00 0.00 0.00 0.00 19.45 15.98 1yaa n ALA 192 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1yaa n HIS 193 N -3.38 2.02 -3.55 0.00 -0.00 -1.26 -4.83 115.22 104.21 1yaa n HIS 193 Ca -0.09 0.28 -0.37 0.00 0.46 0.00 0.00 57.72 58.00 1yaa n HIS 193 Cb 0.59 -2.55 -0.08 0.00 -0.12 0.00 0.00 29.99 27.83 1yaa n HIS 193 CO 0.00 0.00 0.00 1.21 0.46 0.00 0.00 176.34 178.01 1yaa s ASN 194 N 4.85 6.27 0.05 0.26 3.84 -1.26 0.97 114.94 129.92 1yaa s ASN 194 Ca 1.00 0.31 -0.11 0.00 0.21 0.00 0.00 52.86 54.26 1yaa s ASN 194 Cb -0.88 -2.16 -0.32 0.00 -0.55 0.00 0.00 41.25 37.34 1yaa s ASN 194 CO 0.56 0.02 1.07 1.55 -2.79 0.00 0.00 177.10 177.52 1yaa h PRO 195 N 7.32 0.46 -0.10 0.43 0.13 -1.87 -3.28 132.00 135.09 1yaa h PRO 195 Ca -0.38 -0.75 -0.08 0.00 -0.87 0.00 0.00 66.00 63.92 1yaa h PRO 195 Cb 1.16 0.27 -0.01 0.00 0.13 0.00 0.00 31.00 32.56 1yaa h PRO 195 CO 0.70 1.35 -0.32 1.79 -0.23 0.00 0.00 178.00 181.29 1yaa h THR 196 N 0.14 1.26 -0.31 1.56 1.35 -1.92 -3.35 112.91 111.65 1yaa h THR 196 Ca -0.20 -1.24 -0.13 0.00 -0.55 0.00 0.00 66.41 64.28 1yaa h THR 196 Cb 2.06 1.54 -0.05 0.00 -1.73 0.00 0.00 68.15 69.97 1yaa h THR 196 CO 0.25 0.37 -0.12 0.61 -0.25 0.00 0.00 175.52 176.37 1yaa n GLY 197 N -0.46 0.84 3.46 5.82 0.00 0.27 -3.89 105.19 111.23 1yaa n GLY 197 Ca -0.01 -0.39 -0.34 0.00 0.00 0.00 0.00 46.02 45.28 1yaa n GLY 197 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1yaa s LEU 198 N -1.48 3.18 0.09 0.99 2.96 -1.26 -0.74 118.68 122.42 1yaa s LEU 198 Ca 0.00 -0.19 0.08 0.00 -0.22 0.00 0.00 54.13 53.80 1yaa s LEU 198 Cb 0.00 -1.78 -0.03 0.00 0.50 0.00 0.00 46.19 44.88 1yaa s LEU 198 CO 0.00 0.13 -0.21 -1.81 -1.32 0.00 0.00 176.35 173.14 1yaa s ASP 199 N 0.61 2.49 0.51 3.68 1.01 -1.26 -4.45 116.67 119.26 1yaa s ASP 199 Ca -0.02 -0.65 -0.20 0.00 0.71 0.00 0.00 52.55 52.38 1yaa s ASP 199 Cb -0.14 -0.15 -0.07 0.00 1.01 0.00 0.00 42.92 43.57 1yaa s ASP 199 CO 0.02 0.07 1.08 -2.16 0.21 0.00 0.00 175.17 174.40 1yaa s PRO 200 N -1.76 3.61 0.97 8.23 0.04 -1.26 -5.03 135.00 139.81 1yaa s PRO 200 Ca 0.06 1.48 -0.13 0.00 0.04 0.00 0.00 61.00 62.45 1yaa s PRO 200 Cb -0.10 -2.07 0.17 0.00 0.04 0.00 0.00 34.50 32.55 1yaa s PRO 200 CO 0.04 -0.61 1.12 0.95 0.04 0.00 0.00 177.00 178.54 1yaa s THR 201 N -1.88 1.98 0.23 1.26 -4.23 -1.26 -4.74 115.64 107.00 1yaa s THR 201 Ca 0.70 0.00 -0.06 0.00 -1.18 0.00 0.00 61.69 61.14 1yaa s THR 201 Cb -0.20 -2.63 0.18 0.00 1.34 0.00 0.00 72.50 71.20 1yaa s THR 201 CO 0.23 0.00 1.79 0.28 -0.54 0.00 0.00 174.62 176.38 1yaa h SER 202 N -1.76 0.54 -0.16 3.99 0.02 -1.99 -0.38 113.55 113.80 1yaa h SER 202 Ca -0.52 0.05 -0.05 0.00 -0.84 0.00 0.00 61.79 60.43 1yaa h SER 202 Cb 1.33 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 63.81 1yaa h SER 202 CO 0.58 0.31 -0.04 -0.33 -1.14 0.00 0.00 176.83 176.21 1yaa h GLU 203 N 0.67 0.45 -0.04 3.45 3.07 -2.01 -2.29 114.58 117.89 1yaa h GLU 203 Ca 0.36 -0.10 -0.21 0.00 -0.50 0.00 0.00 59.36 58.91 1yaa h GLU 203 Cb 0.35 -0.06 0.00 0.00 -0.84 0.00 0.00 28.75 28.20 1yaa h GLU 203 CO -0.25 0.51 -0.86 1.96 -1.40 0.00 0.00 179.01 178.97 1yaa h GLN 204 N 0.43 0.43 -0.23 2.33 4.20 -1.57 -3.17 115.11 117.54 1yaa h GLN 204 Ca 0.09 -0.42 -0.05 0.00 0.06 0.00 0.00 58.65 58.34 1yaa h GLN 204 Cb 0.35 0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.22 1yaa h GLN 204 CO 0.01 1.07 -0.07 -1.49 -0.67 0.00 0.00 178.83 177.69 1yaa h TRP 205 N 0.27 0.38 -0.27 2.96 -0.00 -0.72 -0.13 115.95 118.43 1yaa h TRP 205 Ca -0.06 -0.04 -0.01 0.00 -0.00 0.00 0.00 58.89 58.78 1yaa h TRP 205 Cb 1.47 -0.11 -0.01 0.00 -0.00 0.00 0.00 29.16 30.51 1yaa h TRP 205 CO 0.06 0.44 0.11 0.28 -0.00 0.00 0.00 178.44 179.32 1yaa h VAL 206 N 0.35 1.17 -0.52 1.49 2.07 -1.40 0.54 116.25 119.95 1yaa h VAL 206 Ca 0.07 -0.51 -0.09 0.00 0.82 0.00 0.00 66.70 66.99 1yaa h VAL 206 Cb 0.34 1.01 -0.02 0.00 -1.52 0.00 0.00 31.29 31.11 1yaa h VAL 206 CO 0.02 0.17 -0.05 1.56 0.02 0.00 0.00 177.57 179.29 1yaa h GLN 207 N 0.28 0.92 -0.36 1.57 4.20 -1.41 -0.02 115.11 120.29 1yaa h GLN 207 Ca 0.09 -0.29 -0.05 0.00 0.06 0.00 0.00 58.65 58.46 1yaa h GLN 207 Cb 0.17 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.85 1yaa h GLN 207 CO -0.01 0.94 0.04 0.82 -0.67 0.00 0.00 178.83 179.96 1yaa h ILE 208 N 0.84 1.24 -0.12 2.54 2.04 -0.81 -2.42 117.51 120.83 1yaa h ILE 208 Ca 0.15 -0.88 -0.17 0.00 1.00 0.00 0.00 64.86 64.96 1yaa h ILE 208 Cb 0.56 1.11 -0.01 0.00 -0.74 0.00 0.00 36.82 37.75 1yaa h ILE 208 CO 0.03 0.30 -0.63 0.58 0.00 0.00 0.00 178.15 178.43 1yaa h VAL 209 N 0.44 1.36 0.00 1.67 2.07 -0.77 -2.51 116.25 118.51 1yaa h VAL 209 Ca 0.11 -1.96 -0.04 0.00 0.82 0.00 0.00 66.70 65.63 1yaa h VAL 209 Cb 0.38 1.95 -0.01 0.00 -1.52 0.00 0.00 31.29 32.10 1yaa h VAL 209 CO 0.01 0.59 -0.18 0.44 0.02 0.00 0.00 177.57 178.46 1yaa h ASP 210 N 0.31 0.00 0.31 0.57 5.19 -0.91 -0.99 116.42 120.90 1yaa h ASP 210 Ca -0.01 0.00 -0.33 0.00 -0.62 0.00 0.00 57.03 56.07 1yaa h ASP 210 Cb 1.17 0.00 0.03 0.00 0.18 0.00 0.00 39.33 40.71 1yaa h ASP 210 CO 0.11 0.18 -1.48 0.00 -3.12 0.00 0.00 179.24 174.93 1yaa h ALA 211 N 1.82 -0.11 -0.70 3.45 0.00 -1.29 -2.91 119.26 119.53 1yaa h ALA 211 Ca -0.00 -0.89 -0.06 0.00 0.00 0.00 0.00 54.91 53.96 1yaa h ALA 211 Cb 0.40 0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 1yaa h ALA 211 CO 0.02 0.76 0.19 0.82 0.00 0.00 0.00 179.25 181.04 1yaa h ILE 212 N 0.14 1.26 -0.16 0.00 2.04 -0.98 -2.33 117.51 117.48 1yaa h ILE 212 Ca -0.25 -0.92 -0.17 0.00 1.00 0.00 0.00 64.86 64.52 1yaa h ILE 212 Cb 2.15 0.51 -0.00 0.00 -0.74 0.00 0.00 36.82 38.73 1yaa h ILE 212 CO 0.26 0.36 -0.61 0.00 0.00 0.00 0.00 178.15 178.16 1yaa h ALA 213 N 1.16 0.65 -0.69 1.87 0.00 -1.30 -0.74 119.26 120.21 1yaa h ALA 213 Ca 0.22 -0.54 -0.08 0.00 0.00 0.00 0.00 54.91 54.51 1yaa h ALA 213 Cb 0.33 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 1yaa h ALA 213 CO -0.00 0.71 0.12 0.66 0.00 0.00 0.00 179.25 180.74 1yaa h SER 214 N 0.40 1.08 -0.17 0.00 4.64 -1.31 -2.83 113.55 115.35 1yaa h SER 214 Ca -0.01 -0.26 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 1yaa h SER 214 Cb 1.17 -0.29 0.00 0.00 -0.31 0.00 0.00 62.40 62.97 1yaa h SER 214 CO 0.11 1.06 0.00 0.29 -0.87 0.00 0.00 176.83 177.42 1yaa n LYS 215 N -4.22 1.67 -3.70 4.77 4.76 -0.90 -4.94 118.16 115.61 1yaa n LYS 215 Ca 0.05 -1.02 -0.27 0.00 -2.87 0.00 0.00 58.31 54.20 1yaa n LYS 215 Cb 0.29 -1.37 0.05 0.00 -1.84 0.00 0.00 35.03 32.16 1yaa n LYS 215 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1yaa n ASN 216 N 0.25 -5.69 -4.89 4.39 3.02 -0.94 -3.36 115.26 108.05 1yaa n ASN 216 Ca 0.15 -0.63 -0.29 0.00 -0.03 0.00 0.00 54.58 53.79 1yaa n ASN 216 Cb 0.30 -4.50 -0.00 0.00 -0.61 0.00 0.00 39.78 34.96 1yaa n ASN 216 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 1yaa s HIS 217 N -3.30 3.56 -0.36 3.10 3.76 -0.33 -2.15 115.29 119.58 1yaa s HIS 217 Ca 0.61 0.95 -0.13 0.00 -0.15 0.00 0.00 55.06 56.34 1yaa s HIS 217 Cb -0.29 -2.41 -0.00 0.00 1.11 0.00 0.00 32.58 30.99 1yaa s HIS 217 CO 0.75 -0.33 0.25 0.42 -0.85 0.00 0.00 174.74 174.98 1yaa s ILE 218 N -2.76 5.15 -0.10 0.60 1.01 -0.19 -4.70 121.20 120.21 1yaa s ILE 218 Ca 0.50 -0.43 -0.22 0.00 0.00 0.00 0.00 60.65 60.49 1yaa s ILE 218 Cb -0.10 -3.74 -0.03 0.00 0.01 0.00 0.00 42.46 38.59 1yaa s ILE 218 CO 0.44 -0.12 0.67 0.00 0.00 0.00 0.00 174.94 175.93 1yaa s ALA 219 N 1.68 3.40 -0.27 9.38 0.00 -1.26 -1.31 121.76 133.38 1yaa s ALA 219 Ca 0.05 0.01 -0.00 0.00 0.00 0.00 0.00 51.96 52.02 1yaa s ALA 219 Cb -0.18 -2.94 0.05 0.00 0.00 0.00 0.00 23.12 20.05 1yaa s ALA 219 CO 0.10 -0.21 -0.05 -1.17 0.00 0.00 0.00 175.76 174.43 1yaa s LEU 220 N 1.07 3.57 -0.49 0.00 0.20 -0.87 -2.28 118.68 119.89 1yaa s LEU 220 Ca 0.34 -1.19 -0.20 0.00 0.69 0.00 0.00 54.13 53.77 1yaa s LEU 220 Cb -0.17 -1.65 0.04 0.00 -0.43 0.00 0.00 46.19 43.98 1yaa s LEU 220 CO 0.15 -0.20 0.66 -0.36 -0.29 0.00 0.00 176.35 176.30 1yaa s PHE 221 N 1.23 3.03 -0.63 5.38 0.40 0.36 -0.24 117.98 127.51 1yaa s PHE 221 Ca -0.05 -0.34 -0.28 0.00 -0.60 0.00 0.00 56.93 55.67 1yaa s PHE 221 Cb -0.19 -3.51 0.03 0.00 0.51 0.00 0.00 43.02 39.86 1yaa s PHE 221 CO -0.03 -1.01 1.22 0.34 0.70 0.00 0.00 175.22 176.44 1yaa s ASP 222 N 2.47 6.36 -0.89 1.36 2.15 0.12 -1.25 116.67 126.98 1yaa s ASP 222 Ca 0.19 -0.07 -0.03 0.00 0.43 0.00 0.00 52.55 53.07 1yaa s ASP 222 Cb -0.17 -2.56 0.22 0.00 -0.30 0.00 0.00 42.92 40.12 1yaa s ASP 222 CO 0.15 -1.60 0.78 -0.89 -0.17 0.00 0.00 175.17 173.44 1yaa s THR 223 N 5.21 4.52 -1.43 1.71 2.01 0.55 -2.25 115.64 125.96 1yaa s THR 223 Ca 0.40 -3.68 0.19 0.00 0.31 0.00 0.00 61.69 58.91 1yaa s THR 223 Cb -0.08 -3.80 -0.07 0.00 0.01 0.00 0.00 72.50 68.56 1yaa s THR 223 CO 0.22 -1.08 0.90 0.00 -0.69 0.00 0.00 174.62 173.97 1yaa n ALA 224 N 2.55 3.71 -2.08 7.40 0.00 -1.26 -1.26 120.51 129.56 1yaa n ALA 224 Ca 0.20 -0.56 0.05 0.00 0.00 0.00 0.00 53.44 53.13 1yaa n ALA 224 Cb 0.38 -0.67 0.11 0.00 0.00 0.00 0.00 19.45 19.26 1yaa n ALA 224 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1yaa n TYR 225 N -0.55 0.00 -1.83 0.00 4.01 -1.26 -4.45 117.16 113.08 1yaa n TYR 225 Ca 0.06 -0.94 -0.43 0.00 -0.16 0.00 0.00 57.90 56.43 1yaa n TYR 225 Cb 0.36 -0.19 -0.03 0.00 -0.31 0.00 0.00 39.34 39.17 1yaa n TYR 225 CO 0.00 0.00 0.00 -1.14 -0.46 0.00 0.00 176.86 175.26 1yaa s GLN 226 N -1.47 3.64 0.00 -0.72 0.74 -1.26 -1.34 119.66 119.25 1yaa s GLN 226 Ca 0.35 2.00 0.00 0.00 0.05 0.00 0.00 55.36 57.77 1yaa s GLN 226 Cb 0.37 -4.19 0.00 0.00 1.10 0.00 0.00 33.01 30.30 1yaa s GLN 226 CO -0.12 -1.51 0.00 0.41 -0.55 0.00 0.00 175.29 173.52 1yaa n GLY 227 N 5.03 1.55 0.76 2.59 0.00 -1.26 -4.79 105.19 109.07 1yaa n GLY 227 Ca 0.23 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.37 1yaa n GLY 227 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1yaa n PHE 228 N -0.67 0.00 -0.10 1.61 3.72 -0.45 -3.25 117.46 118.32 1yaa n PHE 228 Ca 0.00 0.00 -0.18 0.00 -0.05 0.00 0.00 57.45 57.22 1yaa n PHE 228 Cb 0.00 -0.00 -0.08 0.00 -0.94 0.00 0.00 39.48 38.45 1yaa n PHE 228 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1yaa n ALA 229 N 0.79 0.73 -0.04 4.37 0.00 -1.26 -3.03 120.51 122.08 1yaa n ALA 229 Ca 0.13 -0.53 -0.03 0.00 0.00 0.00 0.00 53.44 53.01 1yaa n ALA 229 Cb 0.53 -0.33 -0.07 0.00 0.00 0.00 0.00 19.45 19.58 1yaa n ALA 229 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1yaa n THR 230 N -4.47 0.52 0.00 0.00 -2.24 -1.26 -4.51 114.28 102.32 1yaa n THR 230 Ca -0.27 -0.35 0.00 0.00 -2.27 0.00 0.00 64.05 61.16 1yaa n THR 230 Cb 0.58 -0.62 0.00 0.00 -2.10 0.00 0.00 70.33 68.19 1yaa n THR 230 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yaa n GLY 231 N 2.39 1.38 2.92 3.38 0.00 -1.20 -5.08 105.19 108.97 1yaa n GLY 231 Ca -0.13 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.73 1yaa n GLY 231 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1yaa s ASP 232 N -1.95 0.63 0.37 1.61 -4.77 -1.26 -4.54 116.67 106.76 1yaa s ASP 232 Ca 0.00 -0.09 0.08 0.00 -3.30 0.00 0.00 52.55 49.24 1yaa s ASP 232 Cb 0.00 -0.18 0.79 0.00 -1.09 0.00 0.00 42.92 42.45 1yaa s ASP 232 CO 0.00 0.01 1.93 -0.07 0.70 0.00 0.00 175.17 177.73 1yaa h LEU 233 N 6.49 0.64 -0.34 2.11 3.38 -1.89 -2.86 115.31 122.84 1yaa h LEU 233 Ca -0.33 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.61 1yaa h LEU 233 Cb 1.17 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 1yaa h LEU 233 CO 0.49 0.38 0.04 0.44 0.09 0.00 0.00 178.44 179.88 1yaa h ASP 234 N 0.71 0.55 -0.18 -0.43 3.32 -1.97 -2.54 116.42 115.88 1yaa h ASP 234 Ca 0.36 -0.27 -0.11 0.00 0.02 0.00 0.00 57.03 57.03 1yaa h ASP 234 Cb 0.46 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.85 1yaa h ASP 234 CO -0.14 0.68 -0.26 0.11 -1.72 0.00 0.00 179.24 177.92 1yaa h LYS 235 N 0.40 0.65 0.00 3.56 1.79 -1.97 -2.97 116.57 118.03 1yaa h LYS 235 Ca 0.10 -0.27 0.00 0.00 -2.18 0.00 0.00 60.65 58.30 1yaa h LYS 235 Cb 0.38 -0.03 0.00 0.00 -1.58 0.00 0.00 32.23 31.00 1yaa h LYS 235 CO 0.01 0.85 0.00 -0.25 -1.08 0.00 0.00 179.45 178.98 1yaa n ASP 236 N -4.10 0.27 -0.92 0.86 9.92 -1.09 -2.84 116.55 118.65 1yaa n ASP 236 Ca -0.00 0.54 0.12 0.00 -0.53 0.00 0.00 54.79 54.92 1yaa n ASP 236 Cb 0.44 -0.61 0.19 0.00 -0.64 0.00 0.00 41.12 40.50 1yaa n ASP 236 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1yaa n ALA 237 N -1.60 2.47 -0.15 2.24 0.00 -0.96 -4.60 120.51 117.91 1yaa n ALA 237 Ca 0.05 -0.71 -0.03 0.00 0.00 0.00 0.00 53.44 52.75 1yaa n ALA 237 Cb 0.28 -0.88 0.05 0.00 0.00 0.00 0.00 19.45 18.90 1yaa n ALA 237 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1yaa h TYR 238 N 4.23 -0.02 -0.67 0.00 3.20 -1.57 -1.29 116.97 120.85 1yaa h TYR 238 Ca 0.00 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 61.86 1yaa h TYR 238 Cb 0.91 0.08 -0.03 0.00 1.54 0.00 0.00 36.73 39.23 1yaa h TYR 238 CO 0.05 -0.10 0.24 0.00 -1.64 0.00 0.00 178.16 176.72 1yaa h ALA 239 N 1.42 1.16 -0.22 1.82 0.00 -1.81 -0.28 119.26 121.35 1yaa h ALA 239 Ca 0.24 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 1yaa h ALA 239 Cb 0.35 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1yaa h ALA 239 CO -0.39 0.59 -0.16 0.28 0.00 0.00 0.00 179.25 179.57 1yaa h VAL 240 N 0.98 1.32 0.00 0.00 2.07 -1.78 -1.53 116.25 117.30 1yaa h VAL 240 Ca 0.22 -1.29 -0.04 0.00 0.82 0.00 0.00 66.70 66.42 1yaa h VAL 240 Cb 0.23 1.67 -0.01 0.00 -1.52 0.00 0.00 31.29 31.66 1yaa h VAL 240 CO -0.02 0.39 -0.20 0.03 0.02 0.00 0.00 177.57 177.80 1yaa h ARG 241 N 0.19 0.00 -0.01 1.57 3.08 -1.07 -0.89 114.38 117.26 1yaa h ARG 241 Ca 0.04 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.99 1yaa h ARG 241 Cb 0.69 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.75 1yaa h ARG 241 CO 0.04 0.20 -0.41 1.25 -1.07 0.00 0.00 179.97 179.98 1yaa h LEU 242 N 0.00 0.37 -0.12 3.04 6.46 -0.92 -2.47 115.31 121.67 1yaa h LEU 242 Ca -0.00 -0.76 0.00 0.00 -0.12 0.00 0.00 57.88 57.00 1yaa h LEU 242 Cb 0.49 -0.11 -0.01 0.00 -0.73 0.00 0.00 40.66 40.30 1yaa h LEU 242 CO 0.03 1.08 0.07 1.23 -0.62 0.00 0.00 178.44 180.23 1yaa h GLY 242 N -0.31 0.16 1.41 3.75 0.00 -0.87 -1.23 103.07 105.99 1yaa h GLY 242 Ca -0.05 -0.05 -0.01 0.00 0.00 0.00 0.00 47.33 47.21 1yaa h GLY 242 CO 0.08 0.05 0.29 -2.08 0.00 0.00 0.00 176.54 174.88 1yaa h VAL 242 N 0.15 1.18 -0.33 4.60 2.07 -1.26 0.17 116.25 122.83 1yaa h VAL 242 Ca 0.05 -0.47 -0.17 0.00 0.82 0.00 0.00 66.70 66.93 1yaa h VAL 242 Cb -0.01 0.43 -0.00 0.00 -1.52 0.00 0.00 31.29 30.20 1yaa h VAL 242 CO -0.02 0.20 -0.46 -0.08 0.02 0.00 0.00 177.57 177.23 1yaa h GLU 242 N 0.79 0.89 0.00 1.57 4.81 -1.15 -3.16 114.58 118.32 1yaa h GLU 242 Ca 0.20 -0.52 -0.12 0.00 -0.13 0.00 0.00 59.36 58.79 1yaa h GLU 242 Cb 0.05 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.45 1yaa h GLU 242 CO -0.03 1.16 -1.35 1.63 -0.73 0.00 0.00 179.01 179.69 1yaa n LYS 243 N -4.06 0.62 -0.36 1.92 5.02 -0.49 -4.07 118.16 116.75 1yaa n LYS 243 Ca -0.04 0.17 0.10 0.00 -2.02 0.00 0.00 58.31 56.53 1yaa n LYS 243 Cb 0.58 -1.80 0.28 0.00 -0.02 0.00 0.00 35.03 34.08 1yaa n LYS 243 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1yaa n LEU 244 N -2.80 3.52 -0.11 -0.35 4.32 0.56 -4.50 117.00 117.64 1yaa n LEU 244 Ca -0.07 -1.76 0.17 0.00 -0.02 0.00 0.00 56.01 54.32 1yaa n LEU 244 Cb 0.76 -0.44 0.56 0.00 -1.62 0.00 0.00 43.42 42.67 1yaa n LEU 244 CO 0.42 0.82 1.20 -1.28 -1.22 0.00 0.00 177.39 177.34 1yaa h SER 245 N 3.67 0.27 0.00 -1.43 0.87 -1.69 -1.78 113.55 113.47 1yaa h SER 245 Ca 0.00 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.57 1yaa h SER 245 Cb 0.92 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 62.84 1yaa h SER 245 CO 0.04 0.14 -0.07 0.35 -0.53 0.00 0.00 176.83 176.75 1yaa n THR 246 N -4.45 1.51 0.02 2.23 -2.24 -1.26 -0.90 114.28 109.20 1yaa n THR 246 Ca 0.13 -1.80 -0.02 0.00 -2.27 0.00 0.00 64.05 60.09 1yaa n THR 246 Cb 0.55 -0.05 -0.01 0.00 -2.10 0.00 0.00 70.33 68.72 1yaa n THR 246 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1yaa n VAL 247 N -1.13 1.27 -3.81 2.28 0.31 -0.74 -4.99 118.33 111.52 1yaa n VAL 247 Ca 0.12 0.34 -0.09 0.00 -0.01 0.00 0.00 64.34 64.70 1yaa n VAL 247 Cb 0.62 -1.75 -0.06 0.00 -0.91 0.00 0.00 33.84 31.73 1yaa n VAL 247 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1yaa s SER 248 N -5.97 0.01 0.15 4.52 0.01 -0.77 -4.97 113.70 106.68 1yaa s SER 248 Ca -0.06 -0.59 -0.30 0.00 1.31 0.00 0.00 55.95 56.31 1yaa s SER 248 Cb 0.01 0.39 -0.07 0.00 0.21 0.00 0.00 66.02 66.56 1yaa s SER 248 CO 0.10 -0.79 1.16 -2.84 0.41 0.00 0.00 173.24 171.27 1yaa s PRO 249 N -3.86 4.52 -0.33 12.44 0.02 -1.26 -4.57 135.00 141.97 1yaa s PRO 249 Ca 0.06 1.78 -0.11 0.00 0.02 0.00 0.00 61.00 62.75 1yaa s PRO 249 Cb 0.04 -3.28 -0.01 0.00 0.02 0.00 0.00 34.50 31.27 1yaa s PRO 249 CO -0.10 -0.06 0.19 0.08 -0.33 0.00 0.00 177.00 176.78 1yaa s VAL 250 N 0.13 4.85 -0.05 3.83 1.01 -0.36 -4.31 120.40 125.50 1yaa s VAL 250 Ca 0.53 -0.38 -0.18 0.00 0.00 0.00 0.00 61.98 61.95 1yaa s VAL 250 Cb -0.30 -3.50 -0.05 0.00 0.00 0.00 0.00 36.38 32.53 1yaa s VAL 250 CO 0.34 0.02 0.49 -0.36 0.00 0.00 0.00 175.10 175.59 1yaa s PHE 251 N 1.65 3.62 -0.18 5.22 0.40 -0.96 -0.98 117.98 126.75 1yaa s PHE 251 Ca 0.05 1.01 -0.00 0.00 -0.60 0.00 0.00 56.93 57.39 1yaa s PHE 251 Cb -0.17 -2.50 0.04 0.00 0.51 0.00 0.00 43.02 40.90 1yaa s PHE 251 CO 0.08 0.35 -0.06 0.08 0.70 0.00 0.00 175.22 176.37 1yaa s VAL 252 N -0.08 1.20 -0.55 -0.44 1.01 -0.13 -0.49 120.40 120.92 1yaa s VAL 252 Ca 0.27 -0.73 -0.17 0.00 0.00 0.00 0.00 61.98 61.35 1yaa s VAL 252 Cb -0.16 -1.39 0.12 0.00 0.00 0.00 0.00 36.38 34.95 1yaa s VAL 252 CO 0.13 0.10 0.54 0.00 0.00 0.00 0.00 175.10 175.88 1yaa s GLN 254 N 1.87 4.04 0.08 0.00 0.74 -0.79 -0.33 119.66 125.28 1yaa s GLN 254 Ca 0.05 0.20 0.09 0.00 0.05 0.00 0.00 55.36 55.75 1yaa s GLN 254 Cb -0.28 -3.33 -0.03 0.00 1.10 0.00 0.00 33.01 30.47 1yaa s GLN 254 CO 0.04 0.45 -0.24 0.45 -0.55 0.00 0.00 175.29 175.44 1yaa s SER 255 N -0.21 2.88 -0.02 6.67 0.15 -0.39 -2.16 113.70 120.62 1yaa s SER 255 Ca 0.20 -0.64 0.02 0.00 0.70 0.00 0.00 55.95 56.23 1yaa s SER 255 Cb -0.14 -0.21 0.04 0.00 -1.71 0.00 0.00 66.02 63.99 1yaa s SER 255 CO 0.08 0.17 0.96 0.49 1.20 0.00 0.00 173.24 176.13 1yaa n PHE 256 N 1.41 0.00 -0.21 3.44 3.72 -0.93 -4.74 117.46 120.15 1yaa n PHE 256 Ca -0.18 -0.49 -0.09 0.00 -0.05 0.00 0.00 57.45 56.64 1yaa n PHE 256 Cb 0.53 -0.06 0.03 0.00 -0.94 0.00 0.00 39.48 39.04 1yaa n PHE 256 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1yaa h ALA 257 N 0.00 0.80 0.00 4.37 0.00 -1.88 -2.67 119.26 119.89 1yaa h ALA 257 Ca 0.00 -0.26 -0.25 0.00 0.00 0.00 0.00 54.91 54.40 1yaa h ALA 257 Cb 0.64 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 1yaa h ALA 257 CO 0.00 0.56 -1.53 1.63 0.00 0.00 0.00 179.25 179.92 1yaa n LYS 258 N -4.29 0.55 0.20 0.00 4.01 -1.26 -1.74 118.16 115.63 1yaa n LYS 258 Ca 0.03 0.44 0.05 0.00 -0.51 0.00 0.00 58.31 58.31 1yaa n LYS 258 Cb 0.28 -1.63 0.41 0.00 -0.51 0.00 0.00 35.03 33.59 1yaa n LYS 258 CO 0.00 0.00 0.00 -2.95 -1.11 0.00 0.00 177.40 173.34 1yaa h ASN 259 N -1.00 0.00 -0.01 4.39 7.08 -1.80 -2.89 115.58 121.35 1yaa h ASN 259 Ca -0.38 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 52.84 1yaa h ASN 259 Cb 1.26 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.50 1yaa h ASN 259 CO -0.23 0.33 -0.05 0.00 -2.08 0.00 0.00 177.43 175.40 1yaa n ALA 260 N -2.41 2.57 -2.73 4.14 0.00 -1.17 -4.83 120.51 116.08 1yaa n ALA 260 Ca -0.02 -0.57 -0.18 0.00 0.00 0.00 0.00 53.44 52.68 1yaa n ALA 260 Cb 0.39 -0.41 0.02 0.00 0.00 0.00 0.00 19.45 19.46 1yaa n ALA 260 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yaa n GLY 261 N 0.74 -0.30 0.10 0.00 0.00 -1.09 -4.76 105.19 99.87 1yaa n GLY 261 Ca 0.07 -0.08 0.13 0.00 0.00 0.00 0.00 46.02 46.13 1yaa n GLY 261 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1yaa h MET 262 N -0.83 0.00 0.00 1.61 2.86 -1.07 -3.46 114.93 114.03 1yaa h MET 262 Ca -0.42 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.22 1yaa h MET 262 Cb 1.30 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.96 1yaa h MET 262 CO 0.46 0.00 0.00 0.66 1.06 0.00 0.00 176.91 179.09 1yaa n TYR 263 N -2.26 0.00 0.50 -0.22 4.01 -0.71 0.11 117.16 118.60 1yaa n TYR 263 Ca 0.05 0.00 0.05 0.00 -0.16 0.00 0.00 57.90 57.84 1yaa n TYR 263 Cb 0.44 0.00 0.27 0.00 -0.31 0.00 0.00 39.34 39.74 1yaa n TYR 263 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1yaa n GLY 264 N 0.00 -0.70 0.07 2.72 0.00 -1.26 -2.65 105.19 103.36 1yaa n GLY 264 Ca 0.00 -0.05 0.12 0.00 0.00 0.00 0.00 46.02 46.09 1yaa n GLY 264 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1yaa n GLU 265 N -1.33 0.24 -3.30 1.61 -0.58 0.12 -4.98 120.64 112.42 1yaa n GLU 265 Ca 0.05 0.11 -0.16 0.00 -0.42 0.00 0.00 57.16 56.74 1yaa n GLU 265 Cb 0.10 -1.69 0.08 0.00 -0.57 0.00 0.00 31.44 29.35 1yaa n GLU 265 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1yaa n ARG 266 N -2.07 -3.51 -3.49 3.49 5.12 -1.09 -4.67 116.66 110.45 1yaa n ARG 266 Ca 0.04 0.86 -0.40 0.00 -1.93 0.00 0.00 57.85 56.42 1yaa n ARG 266 Cb 0.42 -5.85 -0.10 0.00 -1.16 0.00 0.00 32.46 25.77 1yaa n ARG 266 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1yaa s VAL 267 N -3.38 5.24 0.31 1.55 1.01 -1.26 -2.76 120.40 121.11 1yaa s VAL 267 Ca 0.33 -0.10 -0.16 0.00 0.00 0.00 0.00 61.98 62.05 1yaa s VAL 267 Cb -0.04 -3.74 0.02 0.00 0.00 0.00 0.00 36.38 32.62 1yaa s VAL 267 CO 0.74 -0.03 0.67 -0.83 0.00 0.00 0.00 175.10 175.65 1yaa s GLY 268 N 1.73 0.29 0.02 4.51 0.00 -1.11 -2.18 107.32 110.58 1yaa s GLY 268 Ca 0.08 -0.64 0.00 0.00 0.00 0.00 0.00 44.72 44.16 1yaa s GLY 268 CO 0.11 -0.33 -0.03 0.00 0.00 0.00 0.00 173.10 172.85 1yaa s PHE 269 N -1.44 2.90 -0.00 0.00 5.36 0.31 -1.88 117.98 123.23 1yaa s PHE 269 Ca -0.15 -1.20 0.06 0.00 -0.96 0.00 0.00 56.93 54.67 1yaa s PHE 269 Cb -0.10 -2.04 -0.03 0.00 -0.34 0.00 0.00 43.02 40.52 1yaa s PHE 269 CO -0.01 -0.65 -0.18 -1.01 -1.46 0.00 0.00 175.22 171.92 1yaa s HIS 269 N 1.41 2.57 -0.20 10.12 3.76 -0.65 -1.15 115.29 131.16 1yaa s HIS 269 Ca 0.05 -0.25 -0.04 0.00 -0.15 0.00 0.00 55.06 54.68 1yaa s HIS 269 Cb -0.14 -1.53 0.07 0.00 1.11 0.00 0.00 32.58 32.09 1yaa s HIS 269 CO -0.07 0.18 0.07 -1.17 -0.85 0.00 0.00 174.74 172.90 1yaa s LEU 269 N -1.04 0.81 -0.47 0.89 0.20 0.70 -0.95 118.68 118.82 1yaa s LEU 269 Ca 0.13 -0.81 -0.21 0.00 0.69 0.00 0.00 54.13 53.93 1yaa s LEU 269 Cb -0.10 -0.43 0.03 0.00 -0.43 0.00 0.00 46.19 45.26 1yaa s LEU 269 CO 0.02 -0.34 0.68 0.00 -0.29 0.00 0.00 176.35 176.42 1yaa s ALA 269 N 1.99 3.33 0.76 5.97 0.00 -0.15 -1.16 121.76 132.50 1yaa s ALA 269 Ca 0.02 -1.34 -0.11 0.00 0.00 0.00 0.00 51.96 50.53 1yaa s ALA 269 Cb -0.17 -3.38 0.05 0.00 0.00 0.00 0.00 23.12 19.63 1yaa s ALA 269 CO -0.12 -1.92 1.08 -0.51 0.00 0.00 0.00 175.76 174.29 1yaa s LEU 270 N 2.93 2.94 0.43 0.00 1.43 -0.05 -1.22 118.68 125.14 1yaa s LEU 270 Ca 0.22 1.65 -0.18 0.00 -1.03 0.00 0.00 54.13 54.79 1yaa s LEU 270 Cb -0.15 -4.38 -0.10 0.00 0.03 0.00 0.00 46.19 41.59 1yaa s LEU 270 CO 0.17 -1.87 0.91 0.42 0.23 0.00 0.00 176.35 176.22 1yaa s THR 271 N -2.99 4.49 -0.19 5.49 -4.23 -1.26 -4.90 115.64 112.06 1yaa s THR 271 Ca 0.60 1.29 -0.28 0.00 -1.18 0.00 0.00 61.69 62.12 1yaa s THR 271 Cb -0.16 -3.64 -0.05 0.00 1.34 0.00 0.00 72.50 69.99 1yaa s THR 271 CO 0.56 -0.39 2.15 -0.54 -0.54 0.00 0.00 174.62 175.85 1yaa s LYS 272 N -3.39 3.30 -0.04 3.99 1.02 -0.07 -4.94 119.74 119.61 1yaa s LYS 272 Ca 0.59 2.07 -0.14 0.00 0.02 0.00 0.00 55.97 58.52 1yaa s LYS 272 Cb -0.09 -4.33 0.02 0.00 -0.52 0.00 0.00 37.83 32.91 1yaa s LYS 272 CO 0.19 -1.92 0.31 -0.65 -0.92 0.00 0.00 175.35 172.36 1yaa s GLN 273 N 6.01 0.59 0.28 1.68 -0.21 -1.26 -4.95 119.66 121.81 1yaa s GLN 273 Ca 0.97 -0.05 0.13 0.00 0.02 0.00 0.00 55.36 56.43 1yaa s GLN 273 Cb -0.34 0.27 0.32 0.00 1.00 0.00 0.00 33.01 34.26 1yaa s GLN 273 CO 0.36 -0.15 1.57 0.00 -2.12 0.00 0.00 175.29 174.95 1yaa h ALA 274 N 4.29 0.84 0.00 6.09 0.00 -2.06 -2.92 119.26 125.50 1yaa h ALA 274 Ca -0.29 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.07 1yaa h ALA 274 Cb 1.18 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1yaa h ALA 274 CO 0.38 0.75 0.00 0.94 0.00 0.00 0.00 179.25 181.32 1yaa n GLN 275 N -3.58 0.02 0.24 0.00 -0.06 -1.26 -3.60 117.38 109.14 1yaa n GLN 275 Ca -0.00 0.24 0.18 0.00 -2.00 0.00 0.00 57.00 55.42 1yaa n GLN 275 Cb 0.66 -1.50 0.88 0.00 -4.06 0.00 0.00 30.24 26.21 1yaa n GLN 275 CO 0.00 0.00 0.00 -0.91 -0.20 0.00 0.00 177.06 175.95 1yaa h ASN 276 N 0.00 0.00 0.04 1.69 -0.26 -1.88 -0.85 115.58 114.32 1yaa h ASN 276 Ca 0.00 0.00 -0.01 0.00 -0.56 0.00 0.00 56.30 55.73 1yaa h ASN 276 Cb 0.24 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 37.50 1yaa h ASN 276 CO 0.00 0.00 -0.03 0.50 -1.06 0.00 0.00 177.43 176.84 1yaa h LYS 277 N 0.00 0.00 0.00 0.81 3.64 -1.84 -1.45 116.57 117.73 1yaa h LYS 277 Ca 0.07 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.32 1yaa h LYS 277 Cb 0.51 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.31 1yaa h LYS 277 CO -0.00 0.03 -1.73 -2.37 -2.27 0.00 0.00 179.45 173.11 1yaa n THR 278 N -4.30 0.47 -0.10 1.00 5.66 -0.53 -4.50 114.28 111.98 1yaa n THR 278 Ca -0.03 -0.42 -0.13 0.00 -3.05 0.00 0.00 64.05 60.42 1yaa n THR 278 Cb 0.11 -0.30 -0.04 0.00 -1.55 0.00 0.00 70.33 68.56 1yaa n THR 278 CO 0.00 0.00 0.00 0.40 -3.05 0.00 0.00 175.07 172.42 1yaa h ILE 279 N 0.00 1.29 0.30 1.09 2.04 -0.94 -2.55 117.51 118.74 1yaa h ILE 279 Ca -0.19 -1.52 -0.01 0.00 1.00 0.00 0.00 64.86 64.14 1yaa h ILE 279 Cb 1.25 1.53 0.00 0.00 -0.74 0.00 0.00 36.82 38.86 1yaa h ILE 279 CO 0.01 0.49 -0.14 0.50 0.00 0.00 0.00 178.15 179.01 1yaa h LYS 280 N 0.56 -0.39 -0.02 2.37 3.64 -1.53 -0.98 116.57 120.23 1yaa h LYS 280 Ca 0.05 0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.43 1yaa h LYS 280 Cb 0.93 0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.83 1yaa h LYS 280 CO 0.08 -0.18 -0.10 -1.00 -2.27 0.00 0.00 179.45 175.99 1yaa h PRO 281 N -0.52 0.03 -0.06 1.90 0.13 -1.79 -2.03 132.00 129.66 1yaa h PRO 281 Ca -0.04 -0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.06 1yaa h PRO 281 Cb 0.39 -0.01 -0.00 0.00 0.13 0.00 0.00 31.00 31.51 1yaa h PRO 281 CO 0.07 0.13 -0.07 0.00 -0.23 0.00 0.00 178.00 177.90 1yaa h ALA 282 N 1.87 0.09 -0.49 -0.56 0.00 -1.18 -2.59 119.26 116.39 1yaa h ALA 282 Ca 0.01 -0.28 -0.09 0.00 0.00 0.00 0.00 54.91 54.54 1yaa h ALA 282 Cb 0.19 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1yaa h ALA 282 CO 0.01 -0.10 -0.05 0.28 0.00 0.00 0.00 179.25 179.39 1yaa h VAL 283 N -0.30 1.26 -0.96 0.00 2.07 -1.10 -2.25 116.25 114.98 1yaa h VAL 283 Ca 0.01 -1.11 0.06 0.00 0.82 0.00 0.00 66.70 66.47 1yaa h VAL 283 Cb 0.58 0.93 -0.06 0.00 -1.52 0.00 0.00 31.29 31.22 1yaa h VAL 283 CO 0.02 0.39 0.62 0.74 0.02 0.00 0.00 177.57 179.36 1yaa h THR 284 N 0.79 1.10 -0.28 2.57 2.02 -1.38 -1.17 112.91 116.56 1yaa h THR 284 Ca 0.14 -0.39 0.01 0.00 0.77 0.00 0.00 66.41 66.94 1yaa h THR 284 Cb 0.54 -0.13 -0.02 0.00 -1.74 0.00 0.00 68.15 66.80 1yaa h THR 284 CO 0.03 0.21 0.17 0.28 0.37 0.00 0.00 175.52 176.58 1yaa h SER 285 N 1.14 0.29 -0.63 4.18 0.02 -1.00 -0.34 113.55 117.21 1yaa h SER 285 Ca 0.40 -0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 61.31 1yaa h SER 285 Cb 0.13 -0.07 -0.03 0.00 0.14 0.00 0.00 62.40 62.57 1yaa h SER 285 CO -0.15 0.21 0.26 1.56 -1.14 0.00 0.00 176.83 177.57 1yaa h GLN 286 N 0.36 0.97 -0.09 3.45 1.08 -1.07 -1.51 115.11 118.31 1yaa h GLN 286 Ca 0.11 -0.16 -0.07 0.00 -1.45 0.00 0.00 58.65 57.07 1yaa h GLN 286 Cb -0.02 -0.17 0.00 0.00 -0.05 0.00 0.00 27.48 27.25 1yaa h GLN 286 CO -0.04 0.79 -0.23 -0.07 -0.95 0.00 0.00 178.83 178.34 1yaa h LEU 287 N 0.95 0.35 -1.45 1.46 3.38 -0.91 -2.79 115.31 116.31 1yaa h LEU 287 Ca 0.22 -0.59 -0.00 0.00 0.09 0.00 0.00 57.88 57.60 1yaa h LEU 287 Cb 0.19 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 1yaa h LEU 287 CO -0.02 0.88 0.29 0.00 0.09 0.00 0.00 178.44 179.68 1yaa h ALA 288 N 0.48 1.59 -0.67 1.53 0.00 -1.01 -2.10 119.26 119.08 1yaa h ALA 288 Ca -0.00 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 1yaa h ALA 288 Cb 0.84 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 1yaa h ALA 288 CO 0.05 0.36 0.11 -0.22 0.00 0.00 0.00 179.25 179.55 1yaa h LYS 289 N 0.68 1.12 -0.44 0.00 3.11 -1.24 0.86 116.57 120.66 1yaa h LYS 289 Ca 0.18 -0.30 -0.11 0.00 -2.81 0.00 0.00 60.65 57.61 1yaa h LYS 289 Cb -0.02 -0.13 -0.02 0.00 -1.00 0.00 0.00 32.23 31.07 1yaa h LYS 289 CO -0.03 1.02 -0.16 0.82 -2.81 0.00 0.00 179.45 178.28 1yaa h ILE 290 N 1.04 1.27 -0.01 2.00 2.04 -1.15 -1.47 117.51 121.23 1yaa h ILE 290 Ca 0.20 -1.27 -0.00 0.00 1.00 0.00 0.00 64.86 64.79 1yaa h ILE 290 Cb 0.45 1.11 -0.00 0.00 -0.74 0.00 0.00 36.82 37.63 1yaa h ILE 290 CO 0.01 0.43 -0.01 0.40 0.00 0.00 0.00 178.15 178.99 1yaa h ILE 291 N 0.74 1.39 -0.82 -0.67 2.04 -1.01 -2.63 117.51 116.55 1yaa h ILE 291 Ca 0.11 -1.17 0.00 0.00 1.00 0.00 0.00 64.86 64.80 1yaa h ILE 291 Cb 0.68 2.17 -0.04 0.00 -0.74 0.00 0.00 36.82 38.89 1yaa h ILE 291 CO 0.05 0.31 0.53 -0.09 0.00 0.00 0.00 178.15 178.94 1yaa h ARG 292 N -0.47 1.09 0.00 2.37 9.65 -0.84 0.33 114.38 126.51 1yaa h ARG 292 Ca 0.00 -0.08 0.00 0.00 -1.10 0.00 0.00 59.98 58.81 1yaa h ARG 292 Cb 0.51 -0.24 0.00 0.00 -1.39 0.00 0.00 29.97 28.85 1yaa h ARG 292 CO 0.00 0.74 0.00 0.77 2.80 0.00 0.00 179.97 184.28 1yaa h SER 293 N 1.12 0.00 0.00 -3.80 0.02 -1.27 -3.09 113.55 106.52 1yaa h SER 293 Ca 0.30 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 61.11 1yaa h SER 293 Cb -0.10 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.42 1yaa h SER 293 CO -0.06 0.00 -1.49 -0.62 -1.14 0.00 0.00 176.83 173.52 1yaa n GLU 294 N -3.00 0.20 -0.00 3.45 1.02 -0.89 -4.86 120.64 116.56 1yaa n GLU 294 Ca 0.02 0.07 0.00 0.00 -0.02 0.00 0.00 57.16 57.23 1yaa n GLU 294 Cb 0.38 -0.96 -0.00 0.00 -0.02 0.00 0.00 31.44 30.84 1yaa n GLU 294 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1yaa n VAL 295 N -3.13 0.00 0.00 2.62 0.31 0.21 -5.04 118.33 113.30 1yaa n VAL 295 Ca -0.16 -0.32 0.00 0.00 -0.01 0.00 0.00 64.34 63.85 1yaa n VAL 295 Cb 0.64 0.82 0.00 0.00 -0.91 0.00 0.00 33.84 34.38 1yaa n VAL 295 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1yaa n SER 296 N -1.20 0.00 -3.76 4.52 2.88 0.92 -4.73 113.62 112.25 1yaa n SER 296 Ca 0.00 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.42 1yaa n SER 296 Cb 0.01 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.40 1yaa n SER 296 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1yaa s ASN 297 N 0.00 -0.12 0.55 -3.46 2.20 -1.26 -3.89 114.94 108.96 1yaa s ASN 297 Ca 0.00 -0.16 -0.11 0.00 -0.94 0.00 0.00 52.86 51.65 1yaa s ASN 297 Cb 0.00 0.35 -0.05 0.00 -2.00 0.00 0.00 41.25 39.55 1yaa s ASN 297 CO 0.00 -0.59 0.96 -2.16 -2.94 0.00 0.00 177.10 172.37 1yaa s PRO 298 N -2.37 3.69 -0.02 3.55 0.04 -1.26 -5.02 135.00 133.61 1yaa s PRO 298 Ca -0.06 0.68 -0.36 0.00 0.04 0.00 0.00 61.00 61.30 1yaa s PRO 298 Cb -0.02 -2.17 -0.15 0.00 0.04 0.00 0.00 34.50 32.21 1yaa s PRO 298 CO -0.02 -0.39 1.60 -2.30 0.04 0.00 0.00 177.00 175.93 1yaa n PRO 299 N -2.27 1.60 -0.02 0.56 -0.02 -1.26 -4.73 135.00 128.86 1yaa n PRO 299 Ca 0.05 0.58 -0.07 0.00 -2.02 0.00 0.00 63.50 62.04 1yaa n PRO 299 Cb 0.54 -2.30 -0.06 0.00 -0.02 0.00 0.00 33.50 31.66 1yaa n PRO 299 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1yaa h ALA 300 N 6.44 -0.08 -0.42 3.55 0.00 -1.93 -3.35 119.26 123.46 1yaa h ALA 300 Ca -0.47 -0.20 0.05 0.00 0.00 0.00 0.00 54.91 54.29 1yaa h ALA 300 Cb 1.30 0.03 -0.08 0.00 0.00 0.00 0.00 17.79 19.04 1yaa h ALA 300 CO 0.88 -0.10 -0.51 -0.92 0.00 0.00 0.00 179.25 178.60 1yaa h TYR 301 N -0.98 -1.56 -1.00 0.00 3.20 -1.92 -2.35 116.97 112.35 1yaa h TYR 301 Ca -0.01 0.08 0.13 0.00 3.14 0.00 0.00 58.73 62.07 1yaa h TYR 301 Cb 0.43 0.74 -0.09 0.00 1.54 0.00 0.00 36.73 39.35 1yaa h TYR 301 CO 0.10 -0.43 0.63 0.78 -1.64 0.00 0.00 178.16 177.59 1yaa h GLY 302 N -0.33 1.66 1.47 1.82 0.00 -1.83 -1.84 103.07 104.02 1yaa h GLY 302 Ca 0.07 -0.41 -0.08 0.00 0.00 0.00 0.00 47.33 46.91 1yaa h GLY 302 CO -0.57 0.12 -0.12 0.00 0.00 0.00 0.00 176.54 175.97 1yaa h ALA 303 N 1.56 1.11 -0.19 3.60 0.00 -1.60 -2.88 119.26 120.86 1yaa h ALA 303 Ca 0.51 -0.30 -0.09 0.00 0.00 0.00 0.00 54.91 55.03 1yaa h ALA 303 Cb 0.55 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1yaa h ALA 303 CO -0.29 0.55 -0.29 0.87 0.00 0.00 0.00 179.25 180.09 1yaa h LYS 304 N 0.58 0.37 0.11 0.00 1.57 -0.83 -1.27 116.57 117.09 1yaa h LYS 304 Ca 0.10 -0.14 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 1yaa h LYS 304 Cb 0.55 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.84 1yaa h LYS 304 CO 0.03 0.63 -0.05 0.82 -0.57 0.00 0.00 179.45 180.32 1yaa h ILE 305 N 0.32 1.08 0.00 1.86 2.04 -1.28 -2.37 117.51 119.16 1yaa h ILE 305 Ca 0.04 -0.76 -0.06 0.00 1.00 0.00 0.00 64.86 65.08 1yaa h ILE 305 Cb 0.69 1.56 -0.01 0.00 -0.74 0.00 0.00 36.82 38.32 1yaa h ILE 305 CO 0.05 0.18 -0.30 0.58 0.00 0.00 0.00 178.15 178.67 1yaa h VAL 306 N -0.50 1.16 -0.24 1.67 2.07 -1.52 -1.75 116.25 117.15 1yaa h VAL 306 Ca -0.01 -1.03 -0.03 0.00 0.82 0.00 0.00 66.70 66.45 1yaa h VAL 306 Cb 0.41 1.56 -0.01 0.00 -1.52 0.00 0.00 31.29 31.73 1yaa h VAL 306 CO 0.02 0.29 0.04 0.00 0.02 0.00 0.00 177.57 177.95 1yaa h ALA 307 N 1.70 0.32 -0.05 1.67 0.00 -1.14 -1.49 119.26 120.27 1yaa h ALA 307 Ca -0.00 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.65 1yaa h ALA 307 Cb 0.54 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1yaa h ALA 307 CO 0.04 -0.01 -0.33 0.87 0.00 0.00 0.00 179.25 179.82 1yaa h LYS 308 N 0.20 0.10 -0.39 0.00 1.79 -1.14 -2.02 116.57 115.12 1yaa h LYS 308 Ca 0.07 -0.04 -0.05 0.00 -2.18 0.00 0.00 60.65 58.46 1yaa h LYS 308 Cb 0.31 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 30.94 1yaa h LYS 308 CO 0.00 0.42 0.05 1.25 -1.08 0.00 0.00 179.45 180.09 1yaa h LEU 309 N 0.09 0.63 0.00 2.94 5.85 -0.99 -2.20 115.31 121.63 1yaa h LEU 309 Ca 0.01 -0.27 0.00 0.00 0.84 0.00 0.00 57.88 58.46 1yaa h LEU 309 Cb 0.62 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.49 1yaa h LEU 309 CO 0.05 0.74 -0.27 -0.07 -0.34 0.00 0.00 178.44 178.55 1yaa h LEU 310 N 0.49 0.00 0.10 2.25 3.38 -1.09 -2.65 115.31 117.79 1yaa h LEU 310 Ca 0.12 -0.04 -0.37 0.00 0.09 0.00 0.00 57.88 57.68 1yaa h LEU 310 Cb 0.39 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.11 1yaa h LEU 310 CO 0.01 0.02 -2.10 -0.62 0.09 0.00 0.00 178.44 175.84 1yaa n GLU 311 N -2.62 0.73 -2.84 1.13 1.02 -0.78 -4.83 120.64 112.45 1yaa n GLU 311 Ca 0.04 0.24 -0.43 0.00 -0.02 0.00 0.00 57.16 56.99 1yaa n GLU 311 Cb 0.49 -1.67 -0.04 0.00 -0.02 0.00 0.00 31.44 30.20 1yaa n GLU 311 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1yaa s THR 312 N -2.55 4.55 0.29 2.62 2.01 -0.83 -4.95 115.64 116.77 1yaa s THR 312 Ca -0.25 0.89 0.03 0.00 0.31 0.00 0.00 61.69 62.66 1yaa s THR 312 Cb 0.07 -4.37 0.28 0.00 0.01 0.00 0.00 72.50 68.49 1yaa s THR 312 CO 0.73 -0.69 1.80 -0.65 -0.69 0.00 0.00 174.62 175.13 1yaa h PRO 313 N 8.81 0.81 -0.53 4.92 0.11 -1.88 0.21 132.00 144.46 1yaa h PRO 313 Ca -0.24 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 65.79 1yaa h PRO 313 Cb 1.08 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 31.98 1yaa h PRO 313 CO 0.99 0.54 0.19 1.49 -0.21 0.00 0.00 178.00 181.00 1yaa h GLU 314 N 0.84 0.78 0.11 1.05 4.81 -1.94 -1.56 114.58 118.66 1yaa h GLU 314 Ca 0.52 -0.13 -0.26 0.00 -0.13 0.00 0.00 59.36 59.36 1yaa h GLU 314 Cb 0.67 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.92 1yaa h GLU 314 CO -0.33 0.66 -1.19 -0.07 -0.73 0.00 0.00 179.01 177.35 1yaa h LEU 315 N 0.76 0.42 -0.75 1.64 4.07 -1.28 -2.93 115.31 117.24 1yaa h LEU 315 Ca 0.18 -0.43 -0.12 0.00 0.08 0.00 0.00 57.88 57.58 1yaa h LEU 315 Cb 0.19 -0.14 -0.01 0.00 1.08 0.00 0.00 40.66 41.78 1yaa h LEU 315 CO -0.01 1.32 -0.38 0.74 -1.08 0.00 0.00 178.44 179.02 1yaa h THR 316 N 0.09 1.30 -0.25 0.22 2.02 -0.29 -1.96 112.91 114.04 1yaa h THR 316 Ca -0.12 -1.52 -0.15 0.00 0.77 0.00 0.00 66.41 65.39 1yaa h THR 316 Cb 1.90 1.55 -0.00 0.00 -1.74 0.00 0.00 68.15 69.86 1yaa h THR 316 CO 0.20 0.48 -0.42 -0.33 0.37 0.00 0.00 175.52 175.82 1yaa h GLU 317 N 0.41 0.73 -0.47 6.66 5.08 -1.37 -2.48 114.58 123.13 1yaa h GLU 317 Ca 0.04 -0.44 -0.04 0.00 -1.00 0.00 0.00 59.36 57.92 1yaa h GLU 317 Cb 0.86 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.13 1yaa h GLU 317 CO 0.07 1.07 0.13 0.37 -1.00 0.00 0.00 179.01 179.65 1yaa h GLN 318 N 0.46 0.71 -0.64 2.33 5.75 -1.44 -2.15 115.11 120.12 1yaa h GLN 318 Ca 0.02 -0.12 -0.07 0.00 -0.15 0.00 0.00 58.65 58.32 1yaa h GLN 318 Cb 1.01 -0.12 -0.03 0.00 1.07 0.00 0.00 27.48 29.42 1yaa h GLN 318 CO 0.09 0.63 0.12 2.35 -2.65 0.00 0.00 178.83 179.37 1yaa h TRP 319 N 0.69 1.10 -0.40 3.99 7.01 -1.23 -0.30 115.95 126.80 1yaa h TRP 319 Ca 0.16 -0.14 -0.00 0.00 2.11 0.00 0.00 58.89 61.02 1yaa h TRP 319 Cb 0.23 -0.31 -0.02 0.00 -2.10 0.00 0.00 29.16 26.97 1yaa h TRP 319 CO 0.01 0.92 0.23 0.45 -2.79 0.00 0.00 178.44 177.26 1yaa h HIS 320 N 0.98 0.54 0.00 2.65 3.86 -0.93 -1.73 115.15 120.52 1yaa h HIS 320 Ca 0.20 -0.01 -0.05 0.00 -1.16 0.00 0.00 60.37 59.35 1yaa h HIS 320 Cb 0.40 -0.17 -0.01 0.00 1.06 0.00 0.00 27.41 28.69 1yaa h HIS 320 CO 0.03 0.40 -0.25 0.87 0.86 0.00 0.00 177.93 179.84 1yaa h LYS 321 N 0.52 0.00 -0.51 2.45 1.57 -1.17 -2.74 116.57 116.69 1yaa h LYS 321 Ca 0.14 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.80 1yaa h LYS 321 Cb 0.03 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.32 1yaa h LYS 321 CO -0.03 0.25 -0.15 -0.44 -0.57 0.00 0.00 179.45 178.52 1yaa h ASP 322 N 0.00 1.01 0.69 0.86 3.32 -0.20 -2.17 116.42 119.94 1yaa h ASP 322 Ca -0.00 -0.37 -0.08 0.00 0.02 0.00 0.00 57.03 56.60 1yaa h ASP 322 Cb 0.51 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 1yaa h ASP 322 CO 0.03 1.15 -0.39 0.24 -1.72 0.00 0.00 179.24 178.56 1yaa h MET 323 N 0.87 0.00 -0.02 3.56 2.86 -1.09 -1.99 114.93 119.13 1yaa h MET 323 Ca 0.13 0.00 -0.18 0.00 -2.06 0.00 0.00 59.70 57.59 1yaa h MET 323 Cb 0.72 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.37 1yaa h MET 323 CO 0.06 0.39 -0.79 0.28 1.06 0.00 0.00 176.91 177.91 1yaa h VAL 324 N 0.00 1.47 -0.23 -2.22 2.07 -1.42 0.00 116.25 115.93 1yaa h VAL 324 Ca -0.00 -2.45 -0.01 0.00 0.82 0.00 0.00 66.70 65.06 1yaa h VAL 324 Cb 0.83 2.33 -0.01 0.00 -1.52 0.00 0.00 31.29 32.93 1yaa h VAL 324 CO 0.05 0.71 0.09 0.74 0.02 0.00 0.00 177.57 179.18 1yaa h THR 325 N 0.11 1.17 -0.11 2.57 2.02 -0.88 -0.84 112.91 116.96 1yaa h THR 325 Ca -0.03 -0.52 -0.03 0.00 0.77 0.00 0.00 66.41 66.60 1yaa h THR 325 Cb 1.37 1.09 -0.00 0.00 -1.74 0.00 0.00 68.15 68.87 1yaa h THR 325 CO 0.12 0.17 -0.06 0.24 0.37 0.00 0.00 175.52 176.36 1yaa h MET 326 N 0.22 0.23 -0.36 6.66 2.86 -1.30 -2.94 114.93 120.30 1yaa h MET 326 Ca 0.08 -0.10 -0.09 0.00 -2.06 0.00 0.00 59.70 57.52 1yaa h MET 326 Cb 0.19 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.82 1yaa h MET 326 CO -0.01 0.58 -0.16 0.66 1.06 0.00 0.00 176.91 179.05 1yaa h SER 327 N -0.14 0.65 -0.64 1.22 4.64 -1.00 -2.75 113.55 115.53 1yaa h SER 327 Ca 0.02 -0.20 -0.05 0.00 -0.47 0.00 0.00 61.79 61.09 1yaa h SER 327 Cb 0.52 -0.18 -0.03 0.00 -0.31 0.00 0.00 62.40 62.41 1yaa h SER 327 CO 0.02 0.83 0.21 0.28 -0.87 0.00 0.00 176.83 177.30 1yaa h SER 328 N 0.59 0.92 -0.16 4.97 0.02 -1.19 -1.27 113.55 117.43 1yaa h SER 328 Ca 0.10 -0.20 -0.11 0.00 -0.84 0.00 0.00 61.79 60.74 1yaa h SER 328 Cb 0.61 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.90 1yaa h SER 328 CO 0.04 0.88 -0.26 -0.09 -1.14 0.00 0.00 176.83 176.26 1yaa h ARG 329 N 0.92 0.62 -0.28 3.45 2.43 -1.45 -0.48 114.38 119.59 1yaa h ARG 329 Ca 0.21 -0.25 -0.13 0.00 -0.81 0.00 0.00 59.98 59.00 1yaa h ARG 329 Cb 0.28 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.79 1yaa h ARG 329 CO -0.01 0.82 -0.35 0.82 -1.51 0.00 0.00 179.97 179.74 1yaa h ILE 330 N 0.54 1.29 -0.12 1.20 2.04 -1.27 -1.69 117.51 119.49 1yaa h ILE 330 Ca 0.07 -1.48 -0.14 0.00 1.00 0.00 0.00 64.86 64.31 1yaa h ILE 330 Cb 0.73 1.45 -0.01 0.00 -0.74 0.00 0.00 36.82 38.24 1yaa h ILE 330 CO 0.06 0.47 -0.52 0.74 0.00 0.00 0.00 178.15 178.90 1yaa h THR 331 N 0.52 1.34 -0.44 -0.27 2.02 -0.98 -2.16 112.91 112.93 1yaa h THR 331 Ca 0.06 -1.79 -0.08 0.00 0.77 0.00 0.00 66.41 65.37 1yaa h THR 331 Cb 0.84 1.83 -0.02 0.00 -1.74 0.00 0.00 68.15 69.06 1yaa h THR 331 CO 0.07 0.54 -0.06 0.50 0.37 0.00 0.00 175.52 176.94 1yaa h LYS 332 N 0.27 0.77 0.00 6.66 3.64 -0.71 -2.76 116.57 124.43 1yaa h LYS 332 Ca 0.01 -0.23 -0.12 0.00 -1.27 0.00 0.00 60.65 59.04 1yaa h LYS 332 Cb 1.01 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.74 1yaa h LYS 332 CO 0.09 0.81 -0.55 0.52 -2.27 0.00 0.00 179.45 178.05 1yaa h MET 333 N 0.70 0.00 -0.42 1.90 2.86 -1.09 -1.63 114.93 117.26 1yaa h MET 333 Ca 0.13 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.68 1yaa h MET 333 Cb 0.52 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.16 1yaa h MET 333 CO 0.03 0.55 -0.11 0.00 1.06 0.00 0.00 176.91 178.44 1yaa h ARG 334 N 0.00 0.76 -0.04 1.72 3.08 -1.14 -1.61 114.38 117.15 1yaa h ARG 334 Ca -0.01 -0.25 -0.15 0.00 0.07 0.00 0.00 59.98 59.64 1yaa h ARG 334 Cb 1.27 -0.06 0.01 0.00 0.08 0.00 0.00 29.97 31.26 1yaa h ARG 334 CO 0.07 0.84 -0.56 0.45 -1.07 0.00 0.00 179.97 179.71 1yaa h HIS 335 N 0.69 0.64 -0.83 3.04 3.86 -1.41 -2.74 115.15 118.41 1yaa h HIS 335 Ca 0.12 -0.32 -0.01 0.00 -1.16 0.00 0.00 60.37 59.00 1yaa h HIS 335 Cb 0.59 -0.09 -0.04 0.00 1.06 0.00 0.00 27.41 28.93 1yaa h HIS 335 CO 0.03 1.12 0.48 0.00 0.86 0.00 0.00 177.93 180.42 1yaa h ALA 336 N 0.39 1.29 -0.11 2.45 0.00 -1.21 -0.24 119.26 121.83 1yaa h ALA 336 Ca -0.06 -0.10 -0.14 0.00 0.00 0.00 0.00 54.91 54.61 1yaa h ALA 336 Cb 1.24 -0.33 0.01 0.00 0.00 0.00 0.00 17.79 18.70 1yaa h ALA 336 CO 0.11 0.60 -0.47 1.25 0.00 0.00 0.00 179.25 180.74 1yaa h LEU 337 N 1.15 0.61 -0.55 0.00 5.85 -1.37 -2.24 115.31 118.77 1yaa h LEU 337 Ca 0.30 -0.63 -0.07 0.00 0.84 0.00 0.00 57.88 58.32 1yaa h LEU 337 Cb -0.02 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 40.81 1yaa h LEU 337 CO -0.05 1.14 0.08 -0.09 -0.34 0.00 0.00 178.44 179.17 1yaa h ARG 338 N 0.12 0.91 -0.35 1.25 1.12 -1.38 -2.43 114.38 113.63 1yaa h ARG 338 Ca -0.03 -0.25 -0.07 0.00 -1.11 0.00 0.00 59.98 58.52 1yaa h ARG 338 Cb 1.11 -0.10 -0.02 0.00 -0.01 0.00 0.00 29.97 30.95 1yaa h ARG 338 CO 0.10 0.89 -0.07 -0.44 -3.11 0.00 0.00 179.97 177.33 1yaa h ASP 339 N 0.80 0.57 0.41 -3.80 3.32 -1.07 -1.69 116.42 114.96 1yaa h ASP 339 Ca 0.16 -0.14 -0.16 0.00 0.02 0.00 0.00 57.03 56.91 1yaa h ASP 339 Cb 0.42 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.81 1yaa h ASP 339 CO 0.01 0.69 -0.69 0.45 -1.72 0.00 0.00 179.24 177.98 1yaa h HIS 340 N 0.55 0.32 -0.25 4.55 3.86 -1.29 -2.04 115.15 120.85 1yaa h HIS 340 Ca 0.11 -0.14 -0.11 0.00 -1.16 0.00 0.00 60.37 59.06 1yaa h HIS 340 Cb 0.46 -0.05 -0.01 0.00 1.06 0.00 0.00 27.41 28.87 1yaa h HIS 340 CO 0.02 0.85 -0.32 -0.07 0.86 0.00 0.00 177.93 179.27 1yaa h LEU 341 N 0.17 0.53 -0.22 2.43 4.07 -1.02 -1.91 115.31 119.37 1yaa h LEU 341 Ca -0.02 -0.21 -0.17 0.00 0.08 0.00 0.00 57.88 57.56 1yaa h LEU 341 Cb 1.23 -0.15 0.00 0.00 1.08 0.00 0.00 40.66 42.82 1yaa h LEU 341 CO 0.11 0.82 -0.54 0.58 -1.08 0.00 0.00 178.44 178.33 1yaa h VAL 342 N 0.44 1.30 -0.21 1.22 2.07 -1.22 -1.83 116.25 118.02 1yaa h VAL 342 Ca 0.05 -1.75 -0.10 0.00 0.82 0.00 0.00 66.70 65.72 1yaa h VAL 342 Cb 0.78 1.81 -0.01 0.00 -1.52 0.00 0.00 31.29 32.35 1yaa h VAL 342 CO 0.06 0.56 -0.31 0.07 0.02 0.00 0.00 177.57 177.97 1yaa h LYS 343 N 0.49 0.42 0.00 1.57 2.10 -1.28 -2.44 116.57 117.43 1yaa h LYS 343 Ca -0.00 -0.17 0.00 0.00 -2.00 0.00 0.00 60.65 58.47 1yaa h LYS 343 Cb 1.16 -0.02 0.00 0.00 -0.90 0.00 0.00 32.23 32.47 1yaa h LYS 343 CO 0.12 0.69 0.00 1.28 -2.00 0.00 0.00 179.45 179.54 1yaa n LEU 344 N -4.09 0.47 -1.34 7.07 4.77 -0.73 -4.92 117.00 118.24 1yaa n LEU 344 Ca -0.01 0.57 -0.11 0.00 -0.03 0.00 0.00 56.01 56.42 1yaa n LEU 344 Cb 0.44 -0.44 -0.00 0.00 -2.33 0.00 0.00 43.42 41.08 1yaa n LEU 344 CO 0.42 -0.23 -0.14 0.61 -1.33 0.00 0.00 177.39 176.73 1yaa n GLY 345 N 0.90 -0.09 3.74 -0.72 0.00 -0.92 -4.97 105.19 103.13 1yaa n GLY 345 Ca 0.05 -0.40 -0.42 0.00 0.00 0.00 0.00 46.02 45.26 1yaa n GLY 345 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1yaa n THR 346 N -4.01 0.86 -1.63 2.61 -1.04 -0.74 -4.94 114.28 105.39 1yaa n THR 346 Ca -0.13 -0.21 -0.37 0.00 -2.04 0.00 0.00 64.05 61.29 1yaa n THR 346 Cb 0.60 -1.99 0.06 0.00 -1.82 0.00 0.00 70.33 67.18 1yaa n THR 346 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1yaa n PRO 347 N 2.46 0.92 0.00 -2.82 -0.02 -1.26 -4.82 135.00 129.46 1yaa n PRO 347 Ca 0.10 0.36 0.00 0.00 -2.02 0.00 0.00 63.50 61.94 1yaa n PRO 347 Cb 0.37 -2.32 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 1yaa n PRO 347 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1yaa n GLY 348 N 1.13 -2.14 3.68 -1.23 0.00 -1.26 -4.94 105.19 100.43 1yaa n GLY 348 Ca 0.15 -1.58 -0.32 0.00 0.00 0.00 0.00 46.02 44.26 1yaa n GLY 348 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1yaa s ASN 349 N -3.58 5.04 -0.06 1.61 3.84 -1.26 -5.03 114.94 115.49 1yaa s ASN 349 Ca 0.00 -0.07 0.09 0.00 0.21 0.00 0.00 52.86 53.09 1yaa s ASN 349 Cb 0.00 -1.27 0.14 0.00 -0.55 0.00 0.00 41.25 39.57 1yaa s ASN 349 CO 0.00 0.25 1.06 0.79 -2.79 0.00 0.00 177.10 176.41 1yaa n TRP 350 N 1.15 0.00 0.29 0.43 7.02 -1.26 -4.80 117.44 120.26 1yaa n TRP 350 Ca -0.13 -0.50 0.17 0.00 -1.02 0.00 0.00 57.50 56.02 1yaa n TRP 350 Cb 0.52 -0.10 0.68 0.00 -2.42 0.00 0.00 31.31 30.00 1yaa n TRP 350 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 1yaa h ASP 351 N 0.00 0.00 0.34 -0.99 3.32 -1.96 -3.06 116.42 114.07 1yaa h ASP 351 Ca 0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 1yaa h ASP 351 Cb 1.17 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.72 1yaa h ASP 351 CO 0.00 0.00 -0.08 1.12 -1.72 0.00 0.00 179.24 178.56 1yaa h HIS 352 N 0.00 0.00 -0.78 4.55 2.07 -1.98 -2.32 115.15 116.69 1yaa h HIS 352 Ca 0.00 0.00 -0.04 0.00 -2.85 0.00 0.00 60.37 57.48 1yaa h HIS 352 Cb 0.50 0.00 -0.04 0.00 2.57 0.00 0.00 27.41 30.44 1yaa h HIS 352 CO 0.00 0.08 0.35 0.82 -3.07 0.00 0.00 177.93 176.11 1yaa h ILE 353 N 0.00 1.25 0.09 6.12 5.03 -1.89 -2.09 117.51 126.02 1yaa h ILE 353 Ca -0.00 -0.74 -0.26 0.00 -0.12 0.00 0.00 64.86 63.74 1yaa h ILE 353 Cb 0.27 0.29 -0.00 0.00 -3.03 0.00 0.00 36.82 34.35 1yaa h ILE 353 CO 0.01 0.31 -1.17 -0.37 -0.68 0.00 0.00 178.15 176.25 1yaa h VAL 354 N 1.11 1.54 -0.21 1.67 -1.51 -1.64 -3.33 116.25 113.88 1yaa h VAL 354 Ca 0.26 -3.08 -0.09 0.00 -1.23 0.00 0.00 66.70 62.56 1yaa h VAL 354 Cb 0.16 2.88 -0.01 0.00 -2.13 0.00 0.00 31.29 32.19 1yaa h VAL 354 CO -0.03 0.90 -0.26 0.78 -1.23 0.00 0.00 177.57 177.73 1yaa h ASN 355 N 0.07 0.40 -4.15 4.19 2.35 -1.30 -3.44 115.58 113.69 1yaa h ASN 355 Ca -0.10 -0.13 -0.49 0.00 -0.55 0.00 0.00 56.30 55.02 1yaa h ASN 355 Cb 1.90 -0.11 0.07 0.00 0.05 0.00 0.00 38.32 40.23 1yaa h ASN 355 CO 0.19 0.66 0.39 -1.10 -1.65 0.00 0.00 177.43 175.91 1yaa s GLN 356 N -4.47 3.28 0.43 0.81 -0.21 -0.80 -5.02 119.66 113.68 1yaa s GLN 356 Ca -0.06 1.37 0.06 0.00 0.02 0.00 0.00 55.36 56.75 1yaa s GLN 356 Cb 0.14 -2.02 -0.07 0.00 1.00 0.00 0.00 33.01 32.07 1yaa s GLN 356 CO 0.78 -0.86 0.04 0.00 -2.12 0.00 0.00 175.29 173.12 1yaa n GLY 358 N -1.06 0.61 0.00 0.00 0.00 -1.17 -4.41 105.19 99.17 1yaa n GLY 358 Ca -0.06 -1.68 0.06 0.00 0.00 0.00 0.00 46.02 44.33 1yaa n GLY 358 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1yaa n MET 359 N 0.27 2.65 -4.34 1.61 0.00 -1.26 -4.91 117.12 111.14 1yaa n MET 359 Ca 0.00 -0.01 -0.26 0.00 -0.00 0.00 0.00 57.70 57.43 1yaa n MET 359 Cb 0.00 -1.12 -0.09 0.00 0.00 0.00 0.00 33.22 32.02 1yaa n MET 359 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 175.97 175.91 1yaa s PHE 360 N -2.24 2.54 -0.10 1.12 0.08 -1.26 -1.36 117.98 116.76 1yaa s PHE 360 Ca 0.04 -0.63 -0.04 0.00 0.12 0.00 0.00 56.93 56.42 1yaa s PHE 360 Cb 0.10 -1.88 0.05 0.00 -0.57 0.00 0.00 43.02 40.72 1yaa s PHE 360 CO 0.53 0.29 0.21 0.45 -0.10 0.00 0.00 175.22 176.59 1yaa s SER 361 N -3.83 0.33 -0.99 1.36 0.15 -0.79 -4.62 113.70 105.30 1yaa s SER 361 Ca 0.38 0.45 -0.19 0.00 0.70 0.00 0.00 55.95 57.28 1yaa s SER 361 Cb 0.06 0.42 0.11 0.00 -1.71 0.00 0.00 66.02 64.91 1yaa s SER 361 CO 0.20 -0.22 1.26 0.12 1.20 0.00 0.00 173.24 175.81 1yaa s PHE 362 N 2.00 2.99 0.33 3.44 5.36 -1.25 -1.28 117.98 129.57 1yaa s PHE 362 Ca -0.01 -1.33 0.04 0.00 -0.96 0.00 0.00 56.93 54.67 1yaa s PHE 362 Cb -0.12 -4.41 0.66 0.00 -0.34 0.00 0.00 43.02 38.81 1yaa s PHE 362 CO -0.07 -1.61 1.91 1.79 -1.46 0.00 0.00 175.22 175.78 1yaa h THR 363 N 5.96 0.99 0.00 0.12 1.35 -1.69 -3.47 112.91 116.17 1yaa h THR 363 Ca 0.19 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.76 1yaa h THR 363 Cb 1.00 0.04 0.00 0.00 -1.73 0.00 0.00 68.15 67.46 1yaa h THR 363 CO 1.22 0.16 0.00 0.61 -0.25 0.00 0.00 175.52 177.25 1yaa n GLY 364 N -1.42 0.39 3.75 5.82 0.00 -1.26 -5.03 105.19 107.45 1yaa n GLY 364 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 1yaa n GLY 364 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1yaa s LEU 365 N 0.00 4.38 0.79 0.99 1.02 -1.26 -5.00 118.68 119.60 1yaa s LEU 365 Ca 0.00 2.75 -0.11 0.00 0.02 0.00 0.00 54.13 56.78 1yaa s LEU 365 Cb 0.00 -3.63 0.07 0.00 0.02 0.00 0.00 46.19 42.65 1yaa s LEU 365 CO 0.00 -0.75 1.09 0.42 0.02 0.00 0.00 176.35 177.12 1yaa s THR 366 N -0.06 3.20 0.42 5.49 -4.23 -1.26 -4.23 115.64 114.97 1yaa s THR 366 Ca 0.60 0.39 0.14 0.00 -1.18 0.00 0.00 61.69 61.64 1yaa s THR 366 Cb -0.43 -3.06 0.34 0.00 1.34 0.00 0.00 72.50 70.69 1yaa s THR 366 CO 0.45 -0.51 1.94 1.55 -0.54 0.00 0.00 174.62 177.51 1yaa h PRO 367 N -1.11 0.44 -0.86 3.99 0.13 -1.95 -1.30 132.00 131.34 1yaa h PRO 367 Ca -0.46 -0.03 0.04 0.00 -0.87 0.00 0.00 66.00 64.68 1yaa h PRO 367 Cb 1.26 -0.10 -0.06 0.00 0.13 0.00 0.00 31.00 32.23 1yaa h PRO 367 CO 0.57 0.29 0.55 0.37 -0.23 0.00 0.00 178.00 179.55 1yaa h GLN 368 N 0.45 1.02 -0.09 0.86 4.15 -1.92 -0.67 115.11 118.92 1yaa h GLN 368 Ca 0.34 -0.06 -0.08 0.00 0.77 0.00 0.00 58.65 59.62 1yaa h GLN 368 Cb 0.68 -0.23 0.00 0.00 0.21 0.00 0.00 27.48 28.14 1yaa h GLN 368 CO -0.11 0.67 -0.25 0.52 -1.93 0.00 0.00 178.83 177.74 1yaa h MET 369 N 1.05 0.33 -0.75 1.69 2.86 -1.62 -2.68 114.93 115.80 1yaa h MET 369 Ca 0.36 -0.23 0.04 0.00 -2.06 0.00 0.00 59.70 57.80 1yaa h MET 369 Cb 0.07 0.04 -0.04 0.00 0.06 0.00 0.00 31.60 31.72 1yaa h MET 369 CO -0.14 0.85 0.50 0.28 1.06 0.00 0.00 176.91 179.46 1yaa h VAL 370 N -0.14 1.10 -0.27 -2.22 2.07 -1.09 -1.06 116.25 114.64 1yaa h VAL 370 Ca -0.01 -0.31 -0.08 0.00 0.82 0.00 0.00 66.70 67.12 1yaa h VAL 370 Cb 0.86 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.75 1yaa h VAL 370 CO 0.05 0.16 -0.16 0.50 0.02 0.00 0.00 177.57 178.15 1yaa h LYS 371 N 0.90 0.59 -0.58 1.57 3.64 -1.13 -2.96 116.57 118.60 1yaa h LYS 371 Ca 0.30 -0.27 -0.06 0.00 -1.27 0.00 0.00 60.65 59.36 1yaa h LYS 371 Cb 0.08 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 31.86 1yaa h LYS 371 CO -0.09 0.84 0.13 -0.09 -2.27 0.00 0.00 179.45 177.97 1yaa h ARG 372 N 0.33 0.92 -0.61 1.90 2.43 -1.07 -2.33 114.38 115.95 1yaa h ARG 372 Ca 0.06 -0.20 0.06 0.00 -0.81 0.00 0.00 59.98 59.09 1yaa h ARG 372 Cb 0.68 -0.13 -0.05 0.00 -0.42 0.00 0.00 29.97 30.05 1yaa h ARG 372 CO 0.04 0.83 0.31 -0.07 -1.51 0.00 0.00 179.97 179.57 1yaa h LEU 373 N 0.88 0.44 0.47 3.80 3.38 -1.13 0.89 115.31 124.03 1yaa h LEU 373 Ca 0.19 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.17 1yaa h LEU 373 Cb 0.34 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1yaa h LEU 373 CO 0.00 0.28 -0.23 -0.08 0.09 0.00 0.00 178.44 178.51 1yaa h GLU 374 N 0.58 -0.61 -0.80 1.13 4.81 -1.34 0.10 114.58 118.44 1yaa h GLU 374 Ca 0.28 0.04 0.05 0.00 -0.13 0.00 0.00 59.36 59.60 1yaa h GLU 374 Cb 0.21 0.14 -0.06 0.00 0.63 0.00 0.00 28.75 29.67 1yaa h GLU 374 CO -0.20 -0.41 0.49 0.93 -0.73 0.00 0.00 179.01 179.10 1yaa h GLU 375 N -1.14 0.88 0.05 1.92 5.08 -1.42 -0.28 114.58 119.68 1yaa h GLU 375 Ca -0.06 -0.05 -0.37 0.00 -1.00 0.00 0.00 59.36 57.87 1yaa h GLU 375 Cb 0.49 -0.20 -0.04 0.00 0.50 0.00 0.00 28.75 29.49 1yaa h GLU 375 CO 0.11 0.59 -2.18 2.41 -1.00 0.00 0.00 179.01 178.93 1yaa n THR 376 N -4.65 1.62 0.82 1.13 -1.04 0.30 -4.60 114.28 107.86 1yaa n THR 376 Ca 0.11 -0.54 0.10 0.00 -2.04 0.00 0.00 64.05 61.68 1yaa n THR 376 Cb 0.15 -1.65 0.08 0.00 -1.82 0.00 0.00 70.33 67.09 1yaa n THR 376 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 1yaa n HIS 377 N -3.56 0.00 -2.35 -1.42 8.25 -0.14 -4.97 115.22 111.03 1yaa n HIS 377 Ca -0.40 0.00 -0.18 0.00 -0.26 0.00 0.00 57.72 56.88 1yaa n HIS 377 Cb 0.98 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 32.07 1yaa n HIS 377 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1yaa n ALA 378 N 1.04 -0.65 -3.17 -1.41 0.00 -0.11 -4.76 120.51 111.44 1yaa n ALA 378 Ca 0.11 0.15 -0.37 0.00 0.00 0.00 0.00 53.44 53.33 1yaa n ALA 378 Cb 0.49 -1.93 -0.12 0.00 0.00 0.00 0.00 19.45 17.89 1yaa n ALA 378 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1yaa s VAL 379 N -2.85 3.97 -0.21 0.00 1.01 -0.61 -0.64 120.40 121.07 1yaa s VAL 379 Ca 0.00 -0.75 -0.21 0.00 0.00 0.00 0.00 61.98 61.03 1yaa s VAL 379 Cb 0.00 -3.08 -0.02 0.00 0.00 0.00 0.00 36.38 33.28 1yaa s VAL 379 CO 0.00 0.04 0.63 -0.31 0.00 0.00 0.00 175.10 175.46 1yaa s TYR 380 N 1.49 3.36 0.08 5.22 1.51 0.27 -2.85 117.35 126.44 1yaa s TYR 380 Ca 0.02 0.91 0.01 0.00 -1.01 0.00 0.00 57.07 57.00 1yaa s TYR 380 Cb -0.17 -2.81 -0.04 0.00 -0.11 0.00 0.00 41.96 38.83 1yaa s TYR 380 CO 0.03 -0.20 -0.05 -0.51 -1.11 0.00 0.00 175.55 173.70 1yaa s LEU 381 N 2.01 2.48 0.38 -1.29 1.02 -1.26 -1.12 118.68 120.89 1yaa s LEU 381 Ca 0.28 -0.96 -0.26 0.00 0.02 0.00 0.00 54.13 53.22 1yaa s LEU 381 Cb -0.16 0.01 -0.09 0.00 0.02 0.00 0.00 46.19 45.98 1yaa s LEU 381 CO 0.10 -0.49 1.11 -0.69 0.02 0.00 0.00 176.35 176.41 1yaa s VAL 382 N -3.50 3.43 -0.49 -1.59 1.01 -1.02 -4.88 120.40 113.36 1yaa s VAL 382 Ca 0.08 1.20 0.09 0.00 0.00 0.00 0.00 61.98 63.35 1yaa s VAL 382 Cb 0.05 -3.67 0.09 0.00 0.00 0.00 0.00 36.38 32.84 1yaa s VAL 382 CO -0.06 0.11 1.21 0.00 0.00 0.00 0.00 175.10 176.36 1yaa n ALA 383 N 0.23 0.86 1.01 5.51 0.00 -1.26 -0.79 120.51 126.06 1yaa n ALA 383 Ca 0.04 0.08 0.13 0.00 0.00 0.00 0.00 53.44 53.69 1yaa n ALA 383 Cb 0.47 -0.97 0.49 0.00 0.00 0.00 0.00 19.45 19.44 1yaa n ALA 383 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1yaa n SER 384 N -1.79 0.19 0.00 0.00 3.41 -1.26 -4.18 113.62 109.99 1yaa n SER 384 Ca -0.01 0.21 0.00 0.00 -0.26 0.00 0.00 58.87 58.81 1yaa n SER 384 Cb 0.11 -0.22 0.00 0.00 -0.26 0.00 0.00 64.21 63.83 1yaa n SER 384 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1yaa n GLY 385 N 1.49 0.65 3.74 5.00 0.00 0.03 -4.73 105.19 111.37 1yaa n GLY 385 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 1yaa n GLY 385 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1yaa s ARG 386 N -0.84 4.54 -0.03 1.61 3.52 -1.24 -1.77 118.95 124.74 1yaa s ARG 386 Ca 0.00 1.79 0.02 0.00 -0.13 0.00 0.00 55.73 57.41 1yaa s ARG 386 Cb 0.00 -3.26 0.01 0.00 -1.56 0.00 0.00 34.95 30.13 1yaa s ARG 386 CO 0.00 -0.02 -0.07 0.00 -0.81 0.00 0.00 175.30 174.40 1yaa s ALA 387 N -0.10 0.73 -0.52 6.12 0.00 -0.40 -2.43 121.76 125.16 1yaa s ALA 387 Ca 0.51 -0.24 -0.28 0.00 0.00 0.00 0.00 51.96 51.95 1yaa s ALA 387 Cb -0.31 -0.30 0.03 0.00 0.00 0.00 0.00 23.12 22.54 1yaa s ALA 387 CO 0.36 0.10 1.14 -1.12 0.00 0.00 0.00 175.76 176.23 1yaa s SER 388 N 0.31 6.54 0.51 0.00 0.01 -0.02 -1.89 113.70 119.16 1yaa s SER 388 Ca -0.04 0.26 0.24 0.00 1.31 0.00 0.00 55.95 57.72 1yaa s SER 388 Cb -0.09 -2.54 1.38 0.00 0.21 0.00 0.00 66.02 64.98 1yaa s SER 388 CO 0.00 -1.34 2.07 0.40 0.41 0.00 0.00 173.24 174.79 1yaa h ILE 389 N 6.19 0.71 0.00 1.44 1.08 -1.56 -1.34 117.51 124.04 1yaa h ILE 389 Ca -0.24 -0.49 0.00 0.00 -0.39 0.00 0.00 64.86 63.74 1yaa h ILE 389 Cb 1.06 1.30 0.00 0.00 -3.07 0.00 0.00 36.82 36.11 1yaa h ILE 389 CO 1.15 0.12 0.00 0.00 -0.69 0.00 0.00 178.15 178.72 1yaa h ALA 390 N 1.88 1.00 0.00 1.87 0.00 -1.91 -1.02 119.26 121.09 1yaa h ALA 390 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1yaa h ALA 390 Cb 0.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1yaa h ALA 390 CO 0.02 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.68 1yaa n GLY 391 N -0.50 -1.30 3.87 0.00 0.00 -0.50 -4.04 105.19 102.71 1yaa n GLY 391 Ca -0.00 -0.08 -0.33 0.00 0.00 0.00 0.00 46.02 45.60 1yaa n GLY 391 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1yaa s LEU 392 N -2.99 4.26 0.23 0.99 1.43 -0.39 -4.74 118.68 117.47 1yaa s LEU 392 Ca 0.12 0.90 -0.18 0.00 -1.03 0.00 0.00 54.13 53.94 1yaa s LEU 392 Cb 0.15 -3.41 0.02 0.00 0.03 0.00 0.00 46.19 42.99 1yaa s LEU 392 CO 0.42 0.03 0.57 0.54 0.23 0.00 0.00 176.35 178.15 1yaa s ASN 393 N -2.09 -0.24 0.53 2.29 2.20 -1.26 -4.91 114.94 111.45 1yaa s ASN 393 Ca 0.42 -0.59 0.25 0.00 -0.94 0.00 0.00 52.86 52.00 1yaa s ASN 393 Cb -0.13 0.62 1.39 0.00 -2.00 0.00 0.00 41.25 41.13 1yaa s ASN 393 CO 0.20 -1.15 1.75 1.56 -2.94 0.00 0.00 177.10 176.52 1yaa h GLN 394 N 2.14 0.00 -0.02 3.55 7.50 -1.97 -0.31 115.11 126.00 1yaa h GLN 394 Ca -0.26 0.00 0.00 0.00 0.50 0.00 0.00 58.65 58.89 1yaa h GLN 394 Cb 1.26 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.79 1yaa h GLN 394 CO 0.33 0.00 -0.22 0.41 -1.50 0.00 0.00 178.83 177.85 1yaa n GLY 395 N -1.23 0.24 0.00 3.46 0.00 -1.26 -4.54 105.19 101.85 1yaa n GLY 395 Ca -0.02 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.41 1yaa n GLY 395 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1yaa n ASN 396 N 0.35 0.08 -0.18 1.61 0.23 -0.27 -4.89 115.26 112.19 1yaa n ASN 396 Ca 0.13 -0.05 -0.01 0.00 -0.53 0.00 0.00 54.58 54.11 1yaa n ASN 396 Cb 0.48 0.12 0.07 0.00 -2.08 0.00 0.00 39.78 38.37 1yaa n ASN 396 CO 0.00 0.00 0.00 0.58 -0.93 0.00 0.00 177.26 176.91 1yaa h VAL 397 N 0.00 0.53 0.09 3.53 2.07 -1.41 -1.21 116.25 119.86 1yaa h VAL 397 Ca 0.00 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.49 1yaa h VAL 397 Cb 0.00 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 30.19 1yaa h VAL 397 CO 0.00 0.02 -0.07 -0.33 0.02 0.00 0.00 177.57 177.21 1yaa h GLU 398 N 0.10 -0.16 -0.81 1.57 5.08 -1.88 -0.47 114.58 118.00 1yaa h GLU 398 Ca 0.28 0.01 0.10 0.00 -1.00 0.00 0.00 59.36 58.75 1yaa h GLU 398 Cb 0.44 0.04 -0.07 0.00 0.50 0.00 0.00 28.75 29.66 1yaa h GLU 398 CO -0.49 -0.11 0.45 -0.92 -1.00 0.00 0.00 179.01 176.95 1yaa h TYR 399 N -0.17 0.82 -0.41 4.33 3.20 -1.76 0.23 116.97 123.20 1yaa h TYR 399 Ca -0.00 0.03 -0.12 0.00 3.14 0.00 0.00 58.73 61.78 1yaa h TYR 399 Cb 0.15 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.17 1yaa h TYR 399 CO -0.10 0.32 -0.20 0.28 -1.64 0.00 0.00 178.16 176.83 1yaa h VAL 400 N 0.75 1.28 -0.69 1.81 2.07 -1.02 -2.05 116.25 118.40 1yaa h VAL 400 Ca 0.39 -1.34 -0.04 0.00 0.82 0.00 0.00 66.70 66.54 1yaa h VAL 400 Cb 0.38 1.26 -0.03 0.00 -1.52 0.00 0.00 31.29 31.38 1yaa h VAL 400 CO -0.26 0.45 0.26 0.00 0.02 0.00 0.00 177.57 178.05 1yaa h ALA 401 N 0.82 1.17 -0.06 1.67 0.00 -0.18 -1.12 119.26 121.56 1yaa h ALA 401 Ca 0.09 -0.18 -0.16 0.00 0.00 0.00 0.00 54.91 54.66 1yaa h ALA 401 Cb 0.76 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1yaa h ALA 401 CO 0.06 0.60 -0.67 0.87 0.00 0.00 0.00 179.25 180.11 1yaa h LYS 402 N 1.00 0.24 -0.24 0.00 1.57 -0.91 -2.01 116.57 116.23 1yaa h LYS 402 Ca 0.23 -0.19 -0.10 0.00 -1.87 0.00 0.00 60.65 58.72 1yaa h LYS 402 Cb 0.21 0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.55 1yaa h LYS 402 CO -0.02 0.82 -0.26 0.00 -0.57 0.00 0.00 179.45 179.43 1yaa h ALA 403 N 1.13 0.35 -0.66 3.86 0.00 -0.99 -0.73 119.26 122.21 1yaa h ALA 403 Ca -0.02 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1yaa h ALA 403 Cb 1.20 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.88 1yaa h ALA 403 CO 0.10 0.34 0.43 0.82 0.00 0.00 0.00 179.25 180.94 1yaa h ILE 404 N 0.30 1.18 -0.39 0.00 2.04 -1.23 -1.22 117.51 118.19 1yaa h ILE 404 Ca 0.04 -0.34 0.02 0.00 1.00 0.00 0.00 64.86 65.57 1yaa h ILE 404 Cb 0.82 0.22 -0.03 0.00 -0.74 0.00 0.00 36.82 37.09 1yaa h ILE 404 CO 0.06 0.17 0.22 -0.78 0.00 0.00 0.00 178.15 177.83 1yaa h ASP 405 N 0.90 0.36 0.18 1.72 3.58 -1.20 -0.02 116.42 121.93 1yaa h ASP 405 Ca 0.24 0.01 -0.01 0.00 0.42 0.00 0.00 57.03 57.69 1yaa h ASP 405 Cb -0.08 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 40.90 1yaa h ASP 405 CO -0.05 0.26 -0.09 -0.08 -2.88 0.00 0.00 179.24 176.40 1yaa h GLU 406 N 0.46 -0.23 -0.61 0.28 4.22 -0.75 -2.69 114.58 115.26 1yaa h GLU 406 Ca 0.16 0.02 0.04 0.00 0.08 0.00 0.00 59.36 59.65 1yaa h GLU 406 Cb 0.01 0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.27 1yaa h GLU 406 CO -0.08 -0.15 0.36 0.28 -2.18 0.00 0.00 179.01 177.25 1yaa h VAL 407 N -0.25 1.04 -0.89 0.32 2.07 -0.98 0.03 116.25 117.60 1yaa h VAL 407 Ca -0.02 -0.24 -0.02 0.00 0.82 0.00 0.00 66.70 67.24 1yaa h VAL 407 Cb 0.19 0.28 -0.04 0.00 -1.52 0.00 0.00 31.29 30.19 1yaa h VAL 407 CO 0.04 0.13 0.49 0.58 0.02 0.00 0.00 177.57 178.83 1yaa h VAL 408 N 0.70 1.25 0.01 2.57 2.07 -0.93 -2.79 116.25 119.13 1yaa h VAL 408 Ca 0.25 -0.62 -0.21 0.00 0.82 0.00 0.00 66.70 66.95 1yaa h VAL 408 Cb 0.07 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 29.88 1yaa h VAL 408 CO -0.13 0.28 -0.91 0.03 0.02 0.00 0.00 177.57 176.86 1yaa h ARG 409 N 1.23 0.25 -0.38 1.57 3.08 -1.18 -3.27 114.38 115.68 1yaa h ARG 409 Ca 0.31 -0.28 -0.03 0.00 0.07 0.00 0.00 59.98 60.05 1yaa h ARG 409 Cb 0.01 0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.13 1yaa h ARG 409 CO -0.05 1.01 0.11 0.35 -1.07 0.00 0.00 179.97 180.32 1yaa h PHE 410 N 0.13 0.55 -0.76 3.04 3.57 -0.75 -3.07 116.94 119.66 1yaa h PHE 410 Ca -0.06 -0.03 -0.45 0.00 3.53 0.00 0.00 57.97 60.97 1yaa h PHE 410 Cb 1.55 -0.17 -0.25 0.00 2.79 0.00 0.00 35.95 39.87 1yaa h PHE 410 CO 0.04 0.47 0.30 0.66 -2.23 0.00 0.00 178.31 177.55 1yaa n TYR 411 N -4.35 2.43 1.18 0.41 4.01 -1.08 -5.09 117.16 114.67 1yaa n TYR 411 Ca 0.02 -2.09 0.13 0.00 -0.16 0.00 0.00 57.90 55.80 1yaa n TYR 411 Cb 0.17 -0.85 0.26 0.00 -0.31 0.00 0.00 39.34 38.61 1yaa n TYR 411 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40