#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yaa h ALA 3 N 0.00 0.89 -0.23 -0.43 0.00 -2.10 -3.29 119.26 114.10 1yaa h ALA 3 Ca 0.00 -0.13 -0.19 0.00 0.00 0.00 0.00 54.91 54.59 1yaa h ALA 3 Cb 0.00 -0.02 -0.18 0.00 0.00 0.00 0.00 17.79 17.59 1yaa h ALA 3 CO 0.00 0.18 -0.68 0.25 0.00 0.00 0.00 179.25 179.00 1yaa n THR 4 N -3.11 2.03 -0.19 0.00 -2.24 -1.26 -4.85 114.28 104.65 1yaa n THR 4 Ca 0.03 -3.28 -0.04 0.00 -2.27 0.00 0.00 64.05 58.49 1yaa n THR 4 Cb 0.59 -0.29 0.15 0.00 -2.10 0.00 0.00 70.33 68.68 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 1.41 0.90 -2.07 3.22 5.85 -2.07 -3.05 115.31 119.50 1yaa h LEU 5 Ca 0.07 -0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.65 1yaa h LEU 5 Cb 1.26 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 42.05 1yaa h LEU 5 CO 0.23 0.83 0.00 0.49 -0.34 0.00 0.00 178.44 179.66 1yaa n PHE 6 N -4.28 0.60 0.31 1.25 3.72 -1.26 -4.54 117.46 113.26 1yaa n PHE 6 Ca 0.05 -0.30 0.19 0.00 -0.05 0.00 0.00 57.45 57.34 1yaa n PHE 6 Cb 0.20 0.00 0.99 0.00 -0.94 0.00 0.00 39.48 39.73 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 3.64 0.00 -0.26 4.37 -0.26 -1.91 -2.71 115.58 118.46 1yaa h ASN 7 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 1yaa h ASN 7 Cb 0.82 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.08 1yaa h ASN 7 CO 0.00 0.02 0.00 0.59 -1.06 0.00 0.00 177.43 176.98 1yaa n ASN 8 N -3.28 2.87 -4.68 5.81 4.13 -1.26 -4.97 115.26 113.89 1yaa n ASN 8 Ca -0.02 -1.84 -0.43 0.00 1.68 0.00 0.00 54.58 53.97 1yaa n ASN 8 Cb 0.15 -0.16 -0.02 0.00 -1.54 0.00 0.00 39.78 38.20 1yaa n ASN 8 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1yaa s ILE 9 N -1.22 4.49 0.48 2.41 1.01 -1.02 -5.02 121.20 122.33 1yaa s ILE 9 Ca 0.27 1.79 -0.13 0.00 0.00 0.00 0.00 60.65 62.58 1yaa s ILE 9 Cb 0.16 -4.15 -0.07 0.00 0.01 0.00 0.00 42.46 38.41 1yaa s ILE 9 CO 0.22 -0.05 0.90 -1.83 0.00 0.00 0.00 174.94 174.19 1yaa s GLU 10 N 2.54 3.83 -0.12 2.79 -1.05 -1.26 -5.05 118.70 120.39 1yaa s GLU 10 Ca 0.51 0.73 -0.26 0.00 -0.15 0.00 0.00 54.97 55.80 1yaa s GLU 10 Cb -0.21 -2.23 -0.02 0.00 -0.44 0.00 0.00 34.13 31.23 1yaa s GLU 10 CO 0.17 -0.22 0.83 -1.17 0.95 0.00 0.00 175.26 175.82 1yaa s LEU 11 N -4.13 4.24 0.14 1.83 2.96 -1.26 -5.05 118.68 117.40 1yaa s LEU 11 Ca 0.55 1.26 -0.06 0.00 -0.22 0.00 0.00 54.13 55.67 1yaa s LEU 11 Cb -0.10 -3.26 -0.06 0.00 0.50 0.00 0.00 46.19 43.27 1yaa s LEU 11 CO 0.34 -0.32 0.39 -0.76 -1.32 0.00 0.00 176.35 174.69 1yaa s LEU 12 N 1.67 4.27 0.64 -0.68 1.43 -1.26 -5.08 118.68 119.67 1yaa s LEU 12 Ca 0.41 0.65 -0.13 0.00 -1.03 0.00 0.00 54.13 54.03 1yaa s LEU 12 Cb -0.18 -3.28 -0.02 0.00 0.03 0.00 0.00 46.19 42.75 1yaa s LEU 12 CO 0.16 0.06 1.06 -2.16 0.23 0.00 0.00 176.35 175.70 1yaa s PRO 13 N -2.53 3.15 0.79 1.29 0.04 -1.26 -5.01 135.00 131.46 1yaa s PRO 13 Ca 0.40 1.09 -0.14 0.00 0.04 0.00 0.00 61.00 62.39 1yaa s PRO 13 Cb -0.12 -2.01 0.07 0.00 0.04 0.00 0.00 34.50 32.47 1yaa s PRO 13 CO 0.23 -0.94 1.20 -0.35 0.04 0.00 0.00 177.00 177.19 1yaa n PRO 14 N -2.53 0.31 -1.70 0.56 -0.04 -1.26 -4.91 135.00 125.43 1yaa n PRO 14 Ca 0.08 0.18 -0.43 0.00 -0.04 0.00 0.00 63.50 63.29 1yaa n PRO 14 Cb 0.53 -2.44 -0.01 0.00 -0.04 0.00 0.00 33.50 31.54 1yaa n PRO 14 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1yaa n ASP 15 N -3.04 2.95 -0.35 3.54 2.03 -1.26 -4.84 116.55 115.58 1yaa n ASP 15 Ca 0.14 1.18 0.09 0.00 0.52 0.00 0.00 54.79 56.72 1yaa n ASP 15 Cb 0.50 -1.49 0.26 0.00 -0.72 0.00 0.00 41.12 39.67 1yaa n ASP 15 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1yaa h ALA 16 N 3.30 1.52 0.03 -1.67 0.00 -1.95 0.20 119.26 120.68 1yaa h ALA 16 Ca -0.46 0.05 -0.34 0.00 0.00 0.00 0.00 54.91 54.16 1yaa h ALA 16 Cb 1.27 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.88 1yaa h ALA 16 CO 0.68 0.09 -1.90 1.28 0.00 0.00 0.00 179.25 179.40 1yaa n LEU 17 N -4.71 2.20 0.05 0.00 4.77 -1.26 -4.10 117.00 113.95 1yaa n LEU 17 Ca 0.20 0.28 0.10 0.00 -0.03 0.00 0.00 56.01 56.56 1yaa n LEU 17 Cb 0.43 -0.96 0.43 0.00 -2.33 0.00 0.00 43.42 40.99 1yaa n LEU 17 CO 0.24 0.57 0.82 0.49 -1.33 0.00 0.00 177.39 178.18 1yaa n PHE 18 N -4.02 0.35 0.11 -1.77 3.01 -1.23 -2.70 117.46 111.20 1yaa n PHE 18 Ca -0.39 0.13 -0.18 0.00 1.01 0.00 0.00 57.45 58.01 1yaa n PHE 18 Cb 0.85 -0.71 -0.13 0.00 -0.01 0.00 0.00 39.48 39.49 1yaa n PHE 18 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 1yaa h GLY 19 N 3.05 0.46 2.00 1.37 0.00 -1.13 -3.06 103.07 105.76 1yaa h GLY 19 Ca 0.00 -1.06 -0.06 0.00 0.00 0.00 0.00 47.33 46.20 1yaa h GLY 19 CO 0.00 0.93 -0.30 0.16 0.00 0.00 0.00 176.54 177.33 1yaa h ILE 20 N 0.15 0.97 -0.42 2.60 3.07 -1.66 -1.41 117.51 120.80 1yaa h ILE 20 Ca -0.16 -1.15 -0.08 0.00 1.55 0.00 0.00 64.86 65.02 1yaa h ILE 20 Cb 1.94 1.66 -0.01 0.00 -0.27 0.00 0.00 36.82 40.14 1yaa h ILE 20 CO 0.22 0.30 -0.06 0.50 -1.05 0.00 0.00 178.15 178.05 1yaa h LYS 21 N 0.00 0.79 -0.30 0.16 3.64 -1.57 -0.89 116.57 118.40 1yaa h LYS 21 Ca -0.00 -0.29 -0.07 0.00 -1.27 0.00 0.00 60.65 59.03 1yaa h LYS 21 Cb 0.64 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.40 1yaa h LYS 21 CO 0.04 0.90 -0.07 0.37 -2.27 0.00 0.00 179.45 178.41 1yaa h GLN 22 N 0.62 0.58 -0.50 1.90 4.15 -1.33 -1.08 115.11 119.45 1yaa h GLN 22 Ca 0.11 -0.22 -0.08 0.00 0.77 0.00 0.00 58.65 59.23 1yaa h GLN 22 Cb 0.58 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 28.22 1yaa h GLN 22 CO 0.03 0.77 -0.02 0.00 -1.93 0.00 0.00 178.83 177.68 1yaa h ARG 23 N 0.35 0.85 -0.50 1.69 3.08 -1.21 -2.08 114.38 116.57 1yaa h ARG 23 Ca 0.08 -0.25 -0.04 0.00 0.07 0.00 0.00 59.98 59.84 1yaa h ARG 23 Cb 0.56 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.50 1yaa h ARG 23 CO 0.03 0.87 0.17 -0.92 -1.07 0.00 0.00 179.97 179.04 1yaa h TYR 24 N 0.79 0.78 -0.87 3.04 3.20 -1.04 -2.21 116.97 120.65 1yaa h TYR 24 Ca 0.15 -0.07 -0.02 0.00 3.14 0.00 0.00 58.73 61.92 1yaa h TYR 24 Cb 0.51 -0.23 -0.04 0.00 1.54 0.00 0.00 36.73 38.50 1yaa h TYR 24 CO 0.03 0.68 0.48 0.78 -1.64 0.00 0.00 178.16 178.48 1yaa h GLY 25 N 0.67 1.30 1.68 1.82 0.00 -0.84 -2.85 103.07 104.85 1yaa h GLY 25 Ca 0.16 -0.59 0.00 0.00 0.00 0.00 0.00 47.33 46.90 1yaa h GLY 25 CO -0.01 0.57 -0.16 0.61 0.00 0.00 0.00 176.54 177.55 1yaa n GLN 26 N -4.35 0.01 -2.22 4.80 10.64 -0.81 -4.81 117.38 120.63 1yaa n GLN 26 Ca 0.09 0.00 -0.43 0.00 -1.83 0.00 0.00 57.00 54.84 1yaa n GLN 26 Cb 0.10 -1.51 -0.02 0.00 -0.86 0.00 0.00 30.24 27.95 1yaa n GLN 26 CO 0.00 0.00 0.00 0.34 -1.83 0.00 0.00 177.06 175.57 1yaa s ASP 27 N -3.04 6.80 0.00 2.61 -1.08 -0.84 -4.91 116.67 116.21 1yaa s ASP 27 Ca 0.13 1.93 0.29 0.00 -0.52 0.00 0.00 52.55 54.38 1yaa s ASP 27 Cb 0.18 -2.54 1.18 0.00 -1.46 0.00 0.00 42.92 40.29 1yaa s ASP 27 CO 0.59 -0.86 1.82 0.00 0.52 0.00 0.00 175.17 177.23 1yaa n GLN 28 N 6.89 1.57 -2.37 4.34 6.02 -1.26 -4.92 117.38 127.65 1yaa n GLN 28 Ca 0.16 -0.82 -0.41 0.00 -0.01 0.00 0.00 57.00 55.92 1yaa n GLN 28 Cb 0.44 -1.48 -0.03 0.00 1.02 0.00 0.00 30.24 30.18 1yaa n GLN 28 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1yaa s ARG 29 N -2.00 4.51 0.15 -1.09 0.52 -1.26 -4.92 118.95 114.86 1yaa s ARG 29 Ca 0.39 1.89 0.18 0.00 -0.52 0.00 0.00 55.73 57.68 1yaa s ARG 29 Cb 0.21 -3.22 0.80 0.00 0.52 0.00 0.00 34.95 33.26 1yaa s ARG 29 CO 0.34 -0.04 1.56 0.00 0.02 0.00 0.00 175.30 177.19 1yaa n ALA 30 N 2.11 1.55 1.21 2.13 0.00 -1.26 -2.91 120.51 123.35 1yaa n ALA 30 Ca 0.03 0.04 0.13 0.00 0.00 0.00 0.00 53.44 53.64 1yaa n ALA 30 Cb 0.44 -1.30 0.29 0.00 0.00 0.00 0.00 19.45 18.88 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 -1.92 0.00 -1.72 0.00 -2.24 -1.26 -4.99 114.28 102.15 1yaa n THR 31 Ca 0.02 -0.23 -0.42 0.00 -2.27 0.00 0.00 64.05 61.15 1yaa n THR 31 Cb 0.17 0.76 -0.01 0.00 -2.10 0.00 0.00 70.33 69.16 1yaa n THR 31 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 1yaa n LYS 32 N -0.07 2.26 -4.30 -0.78 2.85 -1.15 -4.72 118.16 112.26 1yaa n LYS 32 Ca 0.13 0.79 -0.21 0.00 -1.05 0.00 0.00 58.31 57.97 1yaa n LYS 32 Cb 0.41 -2.41 -0.16 0.00 -0.65 0.00 0.00 35.03 32.22 1yaa n LYS 32 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 1yaa s VAL 33 N -1.08 0.70 -0.34 0.58 1.01 -0.17 -4.98 120.40 116.13 1yaa s VAL 33 Ca 0.55 -0.23 -0.11 0.00 0.00 0.00 0.00 61.98 62.18 1yaa s VAL 33 Cb -0.55 -0.69 -0.00 0.00 0.00 0.00 0.00 36.38 35.14 1yaa s VAL 33 CO 0.62 0.26 0.20 -0.62 0.00 0.00 0.00 175.10 175.56 1yaa s ASP 34 N 0.77 5.79 -0.10 3.32 2.15 -1.26 -0.30 116.67 127.03 1yaa s ASP 34 Ca -0.12 -0.57 0.16 0.00 0.43 0.00 0.00 52.55 52.44 1yaa s ASP 34 Cb -0.14 -2.06 0.35 0.00 -0.30 0.00 0.00 42.92 40.76 1yaa s ASP 34 CO 0.01 -0.25 1.16 0.18 -0.17 0.00 0.00 175.17 176.11 1yaa n LEU 35 N 5.04 1.72 0.00 -1.34 4.77 0.20 -4.47 117.00 122.93 1yaa n LEU 35 Ca -0.13 -2.76 0.00 0.00 -0.03 0.00 0.00 56.01 53.09 1yaa n LEU 35 Cb 0.49 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 1yaa n LEU 35 CO 0.36 0.85 0.00 0.61 -1.33 0.00 0.00 177.39 177.87 1yaa n GLY 36 N -0.48 1.39 3.70 -0.72 0.00 -0.88 -1.13 105.19 107.07 1yaa n GLY 36 Ca 0.12 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.70 1yaa n GLY 36 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1yaa n ILE 37 N 0.00 0.05 -1.84 -0.61 -5.35 -1.26 -4.20 119.36 106.15 1yaa n ILE 37 Ca 0.00 -0.01 -0.36 0.00 -0.27 0.00 0.00 62.75 62.10 1yaa n ILE 37 Cb 0.00 -1.82 -0.04 0.00 -1.74 0.00 0.00 39.64 36.04 1yaa n ILE 37 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1yaa n GLY 38 N 3.68 2.03 3.44 3.28 0.00 -1.26 -4.87 105.19 111.49 1yaa n GLY 38 Ca 0.16 -1.07 -0.33 0.00 0.00 0.00 0.00 46.02 44.79 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 7.43 2.64 0.13 4.61 0.00 -1.26 -5.02 121.76 130.28 1yaa s ALA 39 Ca 0.61 -0.95 -0.31 0.00 0.00 0.00 0.00 51.96 51.31 1yaa s ALA 39 Cb 0.06 -1.05 -0.07 0.00 0.00 0.00 0.00 23.12 22.06 1yaa s ALA 39 CO 0.10 0.45 1.29 -0.47 0.00 0.00 0.00 175.76 177.13 1yaa s TYR 40 N -0.34 3.33 0.07 0.00 5.04 -1.26 -4.62 117.35 119.57 1yaa s TYR 40 Ca 0.03 1.17 0.08 0.00 -2.44 0.00 0.00 57.07 55.91 1yaa s TYR 40 Cb -0.13 -3.56 -0.03 0.00 0.35 0.00 0.00 41.96 38.60 1yaa s TYR 40 CO 0.02 -1.80 -0.20 1.03 -1.34 0.00 0.00 175.55 173.26 1yaa s ARG 41 N 0.65 1.20 0.00 4.97 1.81 -1.25 -3.91 118.95 122.42 1yaa s ARG 41 Ca 0.60 -1.04 0.00 0.00 -1.72 0.00 0.00 55.73 53.56 1yaa s ARG 41 Cb -0.34 -1.38 0.00 0.00 -0.45 0.00 0.00 34.95 32.78 1yaa s ARG 41 CO 0.32 0.33 0.00 -0.40 -0.68 0.00 0.00 175.30 174.88 1yaa n ASP 42 N 1.44 0.00 0.19 0.23 5.68 -0.65 -4.83 116.55 118.61 1yaa n ASP 42 Ca -0.19 -0.58 0.13 0.00 -0.50 0.00 0.00 54.79 53.65 1yaa n ASP 42 Cb 0.54 0.00 0.67 0.00 -1.14 0.00 0.00 41.12 41.19 1yaa n ASP 42 CO 0.00 0.00 0.00 -2.24 -1.33 0.00 0.00 177.20 173.63 1yaa h ASP 43 N 0.00 0.00 -0.15 -1.12 2.03 -1.93 -0.98 116.42 114.28 1yaa h ASP 43 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1yaa h ASP 43 Cb 0.00 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.50 1yaa h ASP 43 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 179.24 178.80 1yaa n ASN 44 N -2.38 2.46 -0.26 4.15 5.03 -1.26 -4.49 115.26 118.51 1yaa n ASN 44 Ca -0.01 -1.71 -0.03 0.00 0.87 0.00 0.00 54.58 53.70 1yaa n ASN 44 Cb 0.06 -0.09 -0.01 0.00 -1.02 0.00 0.00 39.78 38.72 1yaa n ASN 44 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1yaa n GLY 45 N 0.76 0.43 3.54 7.41 0.00 -0.37 -5.06 105.19 111.91 1yaa n GLY 45 Ca 0.10 -0.87 -0.25 0.00 0.00 0.00 0.00 46.02 45.00 1yaa n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yaa s LYS 46 N -3.14 1.95 0.56 1.61 1.02 -1.26 -4.80 119.74 115.68 1yaa s LYS 46 Ca 0.00 -1.44 -0.21 0.00 0.02 0.00 0.00 55.97 54.34 1yaa s LYS 46 Cb 0.00 -2.03 -0.05 0.00 -0.52 0.00 0.00 37.83 35.22 1yaa s LYS 46 CO 0.00 0.39 1.15 -0.35 -0.92 0.00 0.00 175.35 175.63 1yaa n PRO 47 N -0.26 1.30 -3.97 -1.68 -0.04 -1.26 -1.64 135.00 127.45 1yaa n PRO 47 Ca -0.09 0.48 -0.31 0.00 -0.04 0.00 0.00 63.50 63.55 1yaa n PRO 47 Cb 0.57 -2.34 -0.15 0.00 -0.04 0.00 0.00 33.50 31.54 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 -1.38 2.84 -0.37 0.54 -0.00 -1.25 -4.81 118.94 114.51 1yaa s TRP 48 Ca 0.73 -2.16 -0.29 0.00 -0.00 0.00 0.00 56.10 54.38 1yaa s TRP 48 Cb -0.43 -1.96 0.01 0.00 -0.00 0.00 0.00 33.47 31.09 1yaa s TRP 48 CO 0.49 -0.85 1.25 0.08 -0.00 0.00 0.00 176.95 177.92 1yaa s VAL 49 N 1.24 4.16 0.27 5.86 1.01 -1.26 -4.97 120.40 126.72 1yaa s VAL 49 Ca -0.02 1.27 -0.29 0.00 0.00 0.00 0.00 61.98 62.94 1yaa s VAL 49 Cb -0.19 -4.31 -0.14 0.00 0.00 0.00 0.00 36.38 31.74 1yaa s VAL 49 CO -0.08 -0.66 1.18 0.18 0.00 0.00 0.00 175.10 175.71 1yaa n LEU 50 N 7.81 2.39 -0.32 3.92 4.32 -1.26 -4.82 117.00 129.04 1yaa n LEU 50 Ca 0.14 1.17 0.06 0.00 -0.02 0.00 0.00 56.01 57.36 1yaa n LEU 50 Cb 0.48 -1.35 0.26 0.00 -1.62 0.00 0.00 43.42 41.19 1yaa n LEU 50 CO 0.66 -1.00 1.24 -0.65 -1.22 0.00 0.00 177.39 176.42 1yaa h PRO 51 N 2.79 0.94 -0.42 3.23 0.11 -1.93 -1.69 132.00 135.04 1yaa h PRO 51 Ca -0.43 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1yaa h PRO 51 Cb 1.32 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 1yaa h PRO 51 CO 0.66 0.62 0.26 0.66 -0.21 0.00 0.00 178.00 179.99 1yaa h SER 52 N 0.97 0.49 1.16 -2.05 4.64 -1.89 -1.96 113.55 114.90 1yaa h SER 52 Ca 0.43 -0.02 -0.13 0.00 -0.47 0.00 0.00 61.79 61.61 1yaa h SER 52 Cb 0.36 -0.12 -0.02 0.00 -0.31 0.00 0.00 62.40 62.31 1yaa h SER 52 CO -0.19 0.37 -0.89 -0.37 -0.87 0.00 0.00 176.83 174.88 1yaa h VAL 53 N 0.57 0.69 -0.49 0.95 -1.51 -1.69 -2.61 116.25 112.16 1yaa h VAL 53 Ca 0.15 -2.08 -0.06 0.00 -1.23 0.00 0.00 66.70 63.48 1yaa h VAL 53 Cb -0.04 2.23 -0.02 0.00 -2.13 0.00 0.00 31.29 31.33 1yaa h VAL 53 CO -0.03 0.39 0.06 0.11 -1.23 0.00 0.00 177.57 176.87 1yaa h LYS 54 N 0.00 0.82 -0.38 5.19 1.57 -0.78 0.15 116.57 123.14 1yaa h LYS 54 Ca -0.07 -0.23 -0.08 0.00 -1.87 0.00 0.00 60.65 58.41 1yaa h LYS 54 Cb 1.45 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 33.66 1yaa h LYS 54 CO 0.06 0.83 -0.06 0.00 -0.57 0.00 0.00 179.45 179.70 1yaa h ALA 55 N 0.96 0.51 -0.17 3.86 0.00 -1.44 -2.62 119.26 120.37 1yaa h ALA 55 Ca 0.15 -0.29 -0.09 0.00 0.00 0.00 0.00 54.91 54.67 1yaa h ALA 55 Cb 0.42 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1yaa h ALA 55 CO 0.01 0.35 -0.30 0.00 0.00 0.00 0.00 179.25 179.31 1yaa h ALA 56 N 0.84 1.18 0.00 0.00 0.00 -1.31 -2.64 119.26 117.33 1yaa h ALA 56 Ca 0.10 -0.35 -0.11 0.00 0.00 0.00 0.00 54.91 54.54 1yaa h ALA 56 Cb 0.56 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1yaa h ALA 56 CO 0.03 0.54 -0.54 0.93 0.00 0.00 0.00 179.25 180.20 1yaa h GLU 57 N 0.29 0.00 -0.08 0.00 5.08 -0.90 -2.49 114.58 116.47 1yaa h GLU 57 Ca 0.04 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.23 1yaa h GLU 57 Cb 0.68 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.93 1yaa h GLU 57 CO 0.05 0.54 -0.68 -0.22 -1.00 0.00 0.00 179.01 177.70 1yaa h LYS 58 N 0.00 0.37 -0.24 2.33 3.64 -1.15 -2.82 116.57 118.70 1yaa h LYS 58 Ca -0.01 -0.29 -0.14 0.00 -1.27 0.00 0.00 60.65 58.95 1yaa h LYS 58 Cb 1.06 0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.93 1yaa h LYS 58 CO 0.07 0.92 -0.40 -0.07 -2.27 0.00 0.00 179.45 177.70 1yaa h LEU 59 N 0.26 0.77 -1.21 5.20 3.38 -1.38 -2.77 115.31 119.55 1yaa h LEU 59 Ca -0.02 -0.53 0.03 0.00 0.09 0.00 0.00 57.88 57.45 1yaa h LEU 59 Cb 1.24 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 41.72 1yaa h LEU 59 CO 0.12 1.15 0.54 0.40 0.09 0.00 0.00 178.44 180.73 1yaa h ILE 60 N 0.41 1.16 0.00 1.22 2.04 -1.44 -2.40 117.51 118.50 1yaa h ILE 60 Ca 0.02 -0.36 0.00 0.00 1.00 0.00 0.00 64.86 65.52 1yaa h ILE 60 Cb 0.99 0.02 0.00 0.00 -0.74 0.00 0.00 36.82 37.09 1yaa h ILE 60 CO 0.09 0.19 -0.24 0.45 0.00 0.00 0.00 178.15 178.64 1yaa h HIS 61 N 1.05 0.00 -0.01 1.37 3.86 -1.51 -3.19 115.15 116.72 1yaa h HIS 61 Ca 0.32 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.53 1yaa h HIS 61 Cb -0.01 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.46 1yaa h HIS 61 CO -0.00 0.00 -0.15 0.09 0.86 0.00 0.00 177.93 178.73 1yaa n ASN 62 N -2.81 1.05 -4.70 2.45 5.03 -0.93 -4.85 115.26 110.50 1yaa n ASN 62 Ca 0.03 -1.03 -0.42 0.00 0.87 0.00 0.00 54.58 54.04 1yaa n ASN 62 Cb 0.51 0.06 -0.03 0.00 -1.02 0.00 0.00 39.78 39.30 1yaa n ASN 62 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1yaa s ASP 63 N -2.33 7.29 0.59 6.41 2.15 -1.02 -4.93 116.67 124.82 1yaa s ASP 63 Ca 0.30 1.64 0.38 0.00 0.43 0.00 0.00 52.55 55.29 1yaa s ASP 63 Cb 0.20 -2.56 1.78 0.00 -0.30 0.00 0.00 42.92 42.04 1yaa s ASP 63 CO 0.45 -0.36 2.13 0.77 -0.17 0.00 0.00 175.17 177.99 1yaa h SER 64 N 6.96 0.00 -0.95 -0.34 4.64 -1.90 -2.72 113.55 119.23 1yaa h SER 64 Ca -0.37 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 60.45 1yaa h SER 64 Cb 1.19 0.00 -0.29 0.00 -0.31 0.00 0.00 62.40 62.98 1yaa h SER 64 CO 0.80 0.00 0.63 -1.20 -0.87 0.00 0.00 176.83 176.20 1yaa n SER 65 N -3.06 3.83 -4.69 4.97 7.64 -1.26 -4.96 113.62 116.09 1yaa n SER 65 Ca -0.01 -3.54 -0.42 0.00 1.01 0.00 0.00 58.87 55.91 1yaa n SER 65 Cb 0.21 -0.83 -0.03 0.00 -1.01 0.00 0.00 64.21 62.56 1yaa n SER 65 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1yaa s TYR 66 N -3.15 3.41 0.27 1.43 5.04 -1.03 -5.01 117.35 118.30 1yaa s TYR 66 Ca 0.54 1.48 -0.15 0.00 -2.44 0.00 0.00 57.07 56.51 1yaa s TYR 66 Cb 0.46 -3.26 0.01 0.00 0.35 0.00 0.00 41.96 39.51 1yaa s TYR 66 CO 0.10 -0.54 0.56 0.54 -1.34 0.00 0.00 175.55 174.87 1yaa s ASN 67 N 1.21 -0.09 -0.42 4.32 2.20 -1.26 -5.05 114.94 115.85 1yaa s ASN 67 Ca 0.50 -0.87 0.04 0.00 -0.94 0.00 0.00 52.86 51.59 1yaa s ASN 67 Cb -0.20 0.64 0.45 0.00 -2.00 0.00 0.00 41.25 40.15 1yaa s ASN 67 CO 0.18 -1.23 1.46 1.41 -2.94 0.00 0.00 177.10 175.98 1yaa n HIS 68 N -0.42 2.92 -1.92 1.54 8.25 -1.26 -4.99 115.22 119.35 1yaa n HIS 68 Ca -0.02 -2.50 -0.32 0.00 -0.26 0.00 0.00 57.72 54.62 1yaa n HIS 68 Cb 0.61 -0.68 0.01 0.00 1.12 0.00 0.00 29.99 31.05 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 -3.68 3.37 0.52 -0.41 0.41 -1.26 -5.01 118.70 112.66 1yaa s GLU 69 Ca 0.55 0.98 -0.22 0.00 -0.41 0.00 0.00 54.97 55.87 1yaa s GLU 69 Cb 0.44 -2.05 -0.06 0.00 -1.78 0.00 0.00 34.13 30.68 1yaa s GLU 69 CO 0.01 -0.75 1.20 0.66 -0.49 0.00 0.00 175.26 175.89 1yaa n TYR 70 N -2.45 1.77 -2.93 1.61 4.01 -1.26 -4.95 117.16 112.96 1yaa n TYR 70 Ca 0.07 0.46 -0.20 0.00 -0.16 0.00 0.00 57.90 58.07 1yaa n TYR 70 Cb 0.54 -2.29 0.06 0.00 -0.31 0.00 0.00 39.34 37.33 1yaa n TYR 70 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1yaa s LEU 71 N -2.43 3.20 0.94 7.72 1.43 -1.26 -5.09 118.68 123.19 1yaa s LEU 71 Ca 0.70 -0.64 -0.12 0.00 -1.03 0.00 0.00 54.13 53.04 1yaa s LEU 71 Cb -0.45 -1.96 0.15 0.00 0.03 0.00 0.00 46.19 43.96 1yaa s LEU 71 CO 0.51 -1.31 1.09 -0.83 0.23 0.00 0.00 176.35 176.05 1yaa s GLY 72 N -4.60 1.59 0.31 -3.19 0.00 -1.26 -4.88 107.32 95.29 1yaa s GLY 72 Ca 0.61 -0.22 -0.01 0.00 0.00 0.00 0.00 44.72 45.10 1yaa s GLY 72 CO 0.39 0.33 1.97 -2.22 0.00 0.00 0.00 173.10 173.57 1yaa h ILE 73 N -1.69 1.19 -0.17 0.90 2.04 -1.97 -1.61 117.51 116.21 1yaa h ILE 73 Ca -0.52 -0.36 0.00 0.00 1.00 0.00 0.00 64.86 64.98 1yaa h ILE 73 Cb 1.31 0.04 0.00 0.00 -0.74 0.00 0.00 36.82 37.42 1yaa h ILE 73 CO 0.56 0.19 0.00 0.35 0.00 0.00 0.00 178.15 179.26 1yaa n THR 74 N -4.42 0.22 -1.14 -0.27 -2.24 -1.26 -4.58 114.28 100.59 1yaa n THR 74 Ca 0.09 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 1yaa n THR 74 Cb 0.04 0.18 0.00 0.00 -2.10 0.00 0.00 70.33 68.45 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 0.99 -2.56 3.66 3.38 0.00 -0.61 -1.57 105.19 108.49 1yaa n GLY 75 Ca 0.13 -1.75 -0.43 0.00 0.00 0.00 0.00 46.02 43.97 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 4.15 0.37 0.99 2.96 -1.26 -4.18 118.68 121.72 1yaa s LEU 76 Ca 0.00 1.66 0.05 0.00 -0.22 0.00 0.00 54.13 55.63 1yaa s LEU 76 Cb 0.00 -3.54 0.75 0.00 0.50 0.00 0.00 46.19 43.90 1yaa s LEU 76 CO 0.00 -0.80 2.00 -0.65 -1.32 0.00 0.00 176.35 175.58 1yaa h PRO 77 N 8.38 0.70 -0.83 0.98 0.11 -1.99 -1.84 132.00 137.51 1yaa h PRO 77 Ca -0.27 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.79 1yaa h PRO 77 Cb 1.11 -0.16 -0.04 0.00 0.11 0.00 0.00 31.00 32.02 1yaa h PRO 77 CO 0.98 0.46 0.46 1.03 -0.21 0.00 0.00 178.00 180.72 1yaa h SER 78 N 0.72 1.03 0.30 -2.05 0.87 -1.97 -0.02 113.55 112.43 1yaa h SER 78 Ca 0.24 -0.09 -0.01 0.00 -1.23 0.00 0.00 61.79 60.69 1yaa h SER 78 Cb 0.07 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 61.77 1yaa h SER 78 CO -0.06 0.82 -0.14 0.25 -0.53 0.00 0.00 176.83 177.17 1yaa h LEU 79 N 1.15 -0.34 -0.22 2.23 5.85 -1.65 -2.86 115.31 119.48 1yaa h LEU 79 Ca 0.29 -0.20 0.02 0.00 0.84 0.00 0.00 57.88 58.83 1yaa h LEU 79 Cb 0.02 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.11 1yaa h LEU 79 CO -0.05 0.09 0.08 0.71 -0.34 0.00 0.00 178.44 178.94 1yaa h THR 80 N -0.87 0.96 0.04 1.05 1.35 -1.30 0.15 112.91 114.29 1yaa h THR 80 Ca -0.04 -0.06 -0.00 0.00 -0.55 0.00 0.00 66.41 65.75 1yaa h THR 80 Cb 0.52 0.75 0.00 0.00 -1.73 0.00 0.00 68.15 67.69 1yaa h THR 80 CO 0.07 0.03 -0.02 0.77 -0.25 0.00 0.00 175.52 176.12 1yaa h SER 81 N 0.19 -0.05 0.26 5.36 4.64 -1.11 -1.84 113.55 121.00 1yaa h SER 81 Ca 0.09 -0.01 -0.12 0.00 -0.47 0.00 0.00 61.79 61.28 1yaa h SER 81 Cb 0.05 0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 62.14 1yaa h SER 81 CO -0.09 -0.02 -0.48 0.78 -0.87 0.00 0.00 176.83 176.15 1yaa h ASN 82 N -0.07 0.28 -0.46 4.97 2.35 -1.44 -3.06 115.58 118.15 1yaa h ASN 82 Ca -0.01 -0.13 -0.05 0.00 -0.55 0.00 0.00 56.30 55.56 1yaa h ASN 82 Cb 0.06 -0.08 -0.02 0.00 0.05 0.00 0.00 38.32 38.33 1yaa h ASN 82 CO 0.01 0.72 0.11 0.00 -1.65 0.00 0.00 177.43 176.62 1yaa h ALA 83 N 1.29 0.61 0.00 -0.83 0.00 -0.54 -2.52 119.26 117.26 1yaa h ALA 83 Ca 0.01 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 1yaa h ALA 83 Cb 0.93 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 1yaa h ALA 83 CO 0.08 0.30 -0.14 0.00 0.00 0.00 0.00 179.25 179.49 1yaa h ALA 84 N 0.97 1.57 -0.38 0.00 0.00 -1.30 -2.59 119.26 117.53 1yaa h ALA 84 Ca 0.14 -0.12 -0.14 0.00 0.00 0.00 0.00 54.91 54.79 1yaa h ALA 84 Cb 0.33 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1yaa h ALA 84 CO 0.00 0.17 -0.33 0.87 0.00 0.00 0.00 179.25 179.96 1yaa h LYS 85 N 0.00 0.85 0.00 0.00 6.56 -1.35 -1.33 116.57 121.30 1yaa h LYS 85 Ca -0.00 -0.41 -0.06 0.00 -1.06 0.00 0.00 60.65 59.12 1yaa h LYS 85 Cb 0.27 -0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 31.92 1yaa h LYS 85 CO 0.02 1.05 -0.26 -0.84 -2.06 0.00 0.00 179.45 177.36 1yaa h ILE 86 N 0.71 0.54 0.00 1.86 3.07 -1.33 -1.17 117.51 121.20 1yaa h ILE 86 Ca 0.07 -1.39 -0.03 0.00 1.55 0.00 0.00 64.86 65.06 1yaa h ILE 86 Cb 0.89 1.98 -0.00 0.00 -0.27 0.00 0.00 36.82 39.41 1yaa h ILE 86 CO 0.08 0.26 -0.40 0.40 -1.05 0.00 0.00 178.15 177.44 1yaa h ILE 87 N 0.00 0.25 0.00 0.16 1.08 -1.45 -3.41 117.51 114.15 1yaa h ILE 87 Ca -0.00 -1.25 -0.16 0.00 -0.39 0.00 0.00 64.86 63.06 1yaa h ILE 87 Cb 0.96 0.53 -0.02 0.00 -3.07 0.00 0.00 36.82 35.21 1yaa h ILE 87 CO 0.03 0.08 -0.74 -0.26 -0.69 0.00 0.00 178.15 176.58 1yaa h PHE 88 N -1.00 0.00 0.00 1.37 0.04 -1.37 -3.43 116.94 112.55 1yaa h PHE 88 Ca -0.04 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.73 1yaa h PHE 88 Cb 0.48 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.63 1yaa h PHE 88 CO -0.07 0.74 0.00 0.41 -0.60 0.00 0.00 178.31 178.79 1yaa n GLY 89 N 0.68 2.46 0.25 -1.45 0.00 -0.44 -4.55 105.19 102.14 1yaa n GLY 89 Ca -0.01 -1.80 -0.09 0.00 0.00 0.00 0.00 46.02 44.12 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 1.29 -1.87 2.61 1.35 -1.93 -3.11 112.91 111.25 1yaa h THR 90 Ca 0.00 -1.54 -0.76 0.00 -0.55 0.00 0.00 66.41 63.56 1yaa h THR 90 Cb 0.00 1.45 -0.27 0.00 -1.73 0.00 0.00 68.15 67.60 1yaa h THR 90 CO 0.00 0.50 1.04 0.00 -0.25 0.00 0.00 175.52 176.81 1yaa n GLN 91 N -4.05 2.74 -3.18 4.72 3.00 -1.26 -4.94 117.38 114.42 1yaa n GLN 91 Ca -0.02 -3.49 -0.39 0.00 -0.01 0.00 0.00 57.00 53.09 1yaa n GLN 91 Cb 0.52 -2.27 -0.05 0.00 0.00 0.00 0.00 30.24 28.43 1yaa n GLN 91 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 1yaa s SER 92 N -1.18 6.90 0.14 1.08 0.15 -1.18 -4.97 113.70 114.63 1yaa s SER 92 Ca 0.54 1.07 -0.14 0.00 0.70 0.00 0.00 55.95 58.13 1yaa s SER 92 Cb 0.45 -2.36 -0.00 0.00 -1.71 0.00 0.00 66.02 62.40 1yaa s SER 92 CO -0.37 -0.01 1.58 0.44 1.20 0.00 0.00 173.24 176.09 1yaa h ASP 93 N 6.36 0.76 -0.51 5.45 3.32 -1.92 -1.03 116.42 128.86 1yaa h ASP 93 Ca -0.42 -0.31 0.04 0.00 0.02 0.00 0.00 57.03 56.36 1yaa h ASP 93 Cb 1.19 -0.21 -0.04 0.00 0.22 0.00 0.00 39.33 40.49 1yaa h ASP 93 CO 0.73 0.88 0.26 0.00 -1.72 0.00 0.00 179.24 179.40 1yaa h ALA 94 N 0.91 0.65 -0.03 3.45 0.00 -1.93 0.82 119.26 123.12 1yaa h ALA 94 Ca 0.13 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1yaa h ALA 94 Cb 0.49 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 1yaa h ALA 94 CO 0.02 -0.09 -0.01 -0.07 0.00 0.00 0.00 179.25 179.11 1yaa h LEU 95 N 0.50 0.06 -1.28 0.00 3.38 -1.89 -0.58 115.31 115.50 1yaa h LEU 95 Ca 0.22 -0.36 0.03 0.00 0.09 0.00 0.00 57.88 57.87 1yaa h LEU 95 Cb 0.13 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 40.82 1yaa h LEU 95 CO -0.16 0.40 0.50 -0.61 0.09 0.00 0.00 178.44 178.67 1yaa h GLN 96 N -0.28 0.92 -0.00 1.13 4.15 -1.00 -1.41 115.11 118.62 1yaa h GLN 96 Ca 0.01 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.37 1yaa h GLN 96 Cb 0.37 -0.21 0.00 0.00 0.21 0.00 0.00 27.48 27.86 1yaa h GLN 96 CO 0.00 0.61 -0.03 0.39 -1.93 0.00 0.00 178.83 177.87 1yaa n GLU 97 N -4.45 0.77 -3.31 1.69 1.02 0.26 -4.93 120.64 111.69 1yaa n GLU 97 Ca 0.10 -0.14 -0.18 0.00 -0.02 0.00 0.00 57.16 56.93 1yaa n GLU 97 Cb 0.11 -1.50 0.07 0.00 -0.02 0.00 0.00 31.44 30.10 1yaa n GLU 97 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1yaa n ASP 98 N -1.00 -4.35 -0.86 1.62 2.03 -0.53 -4.93 116.55 108.53 1yaa n ASP 98 Ca 0.18 -0.46 0.08 0.00 0.52 0.00 0.00 54.79 55.11 1yaa n ASP 98 Cb 0.22 -4.21 0.17 0.00 -0.72 0.00 0.00 41.12 36.58 1yaa n ASP 98 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1yaa n ARG 99 N -3.95 2.30 -3.80 -0.67 1.74 -0.26 -4.95 116.66 107.06 1yaa n ARG 99 Ca -0.08 -2.04 -0.36 0.00 -0.77 0.00 0.00 57.85 54.60 1yaa n ARG 99 Cb 0.58 -1.37 -0.12 0.00 -1.02 0.00 0.00 32.46 30.53 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 -1.13 4.48 -0.40 1.55 1.01 -1.25 -0.21 120.40 124.44 1yaa s VAL 100 Ca 0.29 -0.12 -0.15 0.00 0.00 0.00 0.00 61.98 62.01 1yaa s VAL 100 Cb 0.17 -3.08 0.02 0.00 0.00 0.00 0.00 36.38 33.48 1yaa s VAL 100 CO 0.23 0.35 0.30 -0.63 0.00 0.00 0.00 175.10 175.35 1yaa s ILE 101 N 1.41 5.26 -0.18 2.22 1.01 -0.07 -4.92 121.20 125.93 1yaa s ILE 101 Ca 0.05 -0.61 -0.03 0.00 0.00 0.00 0.00 60.65 60.07 1yaa s ILE 101 Cb -0.15 -3.91 -0.01 0.00 0.01 0.00 0.00 42.46 38.40 1yaa s ILE 101 CO 0.04 -0.28 -0.07 -0.44 0.00 0.00 0.00 174.94 174.19 1yaa s SER 102 N 1.69 4.31 0.03 3.58 0.01 -1.26 -1.62 113.70 120.44 1yaa s SER 102 Ca 0.05 -0.33 0.05 0.00 1.31 0.00 0.00 55.95 57.04 1yaa s SER 102 Cb -0.19 -1.71 -0.02 0.00 0.21 0.00 0.00 66.02 64.31 1yaa s SER 102 CO 0.10 0.07 -0.14 0.68 0.41 0.00 0.00 173.24 174.35 1yaa s VAL 103 N 0.96 1.13 0.08 3.43 -7.23 -0.19 -4.98 120.40 113.61 1yaa s VAL 103 Ca -0.01 -0.90 -0.30 0.00 -1.81 0.00 0.00 61.98 58.96 1yaa s VAL 103 Cb -0.15 -1.00 -0.05 0.00 0.56 0.00 0.00 36.38 35.74 1yaa s VAL 103 CO 0.00 0.09 0.99 -1.58 -0.31 0.00 0.00 175.10 174.29 1yaa s GLN 104 N -0.93 4.64 0.40 4.82 0.74 -0.61 -0.09 119.66 128.62 1yaa s GLN 104 Ca 0.03 1.47 0.04 0.00 0.05 0.00 0.00 55.36 56.95 1yaa s GLN 104 Cb -0.07 -3.39 -0.04 0.00 1.10 0.00 0.00 33.01 30.60 1yaa s GLN 104 CO 0.01 0.10 0.07 -1.54 -0.55 0.00 0.00 175.29 173.39 1yaa s SER 105 N 0.34 2.95 -1.29 6.67 1.04 -0.36 -4.68 113.70 118.37 1yaa s SER 105 Ca 0.49 -1.54 -0.16 0.00 0.48 0.00 0.00 55.95 55.21 1yaa s SER 105 Cb -0.23 0.23 0.09 0.00 0.10 0.00 0.00 66.02 66.22 1yaa s SER 105 CO 0.30 -0.77 1.72 0.18 0.98 0.00 0.00 173.24 175.65 1yaa n LEU 106 N -0.90 5.25 0.00 2.42 4.32 -1.26 -2.92 117.00 123.92 1yaa n LEU 106 Ca -0.07 -4.09 0.00 0.00 -0.02 0.00 0.00 56.01 51.83 1yaa n LEU 106 Cb 0.66 -1.70 0.00 0.00 -1.62 0.00 0.00 43.42 40.76 1yaa n LEU 106 CO 0.39 0.42 0.00 -1.20 -1.22 0.00 0.00 177.39 175.78 1yaa n SER 107 N 7.37 -3.89 0.16 -1.43 7.64 -1.02 -0.94 113.62 121.50 1yaa n SER 107 Ca 0.46 0.00 0.03 0.00 1.01 0.00 0.00 58.87 60.37 1yaa n SER 107 Cb 0.44 0.00 0.41 0.00 -1.01 0.00 0.00 64.21 64.06 1yaa n SER 107 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 1yaa h GLY 108 N 0.00 0.15 1.27 0.23 0.00 -1.82 -2.81 103.07 100.09 1yaa h GLY 108 Ca 0.00 -0.10 -0.19 0.00 0.00 0.00 0.00 47.33 47.05 1yaa h GLY 108 CO 0.00 0.09 -0.60 -0.84 0.00 0.00 0.00 176.54 175.19 1yaa h THR 109 N 0.14 1.29 -0.71 4.70 2.02 -1.94 -2.34 112.91 116.07 1yaa h THR 109 Ca 0.03 -1.81 -0.05 0.00 0.77 0.00 0.00 66.41 65.35 1yaa h THR 109 Cb 0.40 1.75 -0.03 0.00 -1.74 0.00 0.00 68.15 68.53 1yaa h THR 109 CO 0.03 0.58 0.25 1.23 0.37 0.00 0.00 175.52 177.97 1yaa h GLY 110 N 0.80 1.15 1.29 2.16 0.00 -0.97 0.09 103.07 107.58 1yaa h GLY 110 Ca -0.00 -0.64 -0.09 0.00 0.00 0.00 0.00 47.33 46.59 1yaa h GLY 110 CO 0.12 0.60 -0.08 0.00 0.00 0.00 0.00 176.54 177.18 1yaa h ALA 111 N 1.23 0.96 0.00 3.60 0.00 -1.45 -1.22 119.26 122.38 1yaa h ALA 111 Ca 0.23 -0.31 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 1yaa h ALA 111 Cb 0.25 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1yaa h ALA 111 CO -0.01 0.61 -0.25 -0.07 0.00 0.00 0.00 179.25 179.53 1yaa h LEU 112 N 0.76 0.00 0.13 0.00 3.38 -0.88 -2.60 115.31 116.10 1yaa h LEU 112 Ca 0.13 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.82 1yaa h LEU 112 Cb 0.58 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.33 1yaa h LEU 112 CO 0.04 0.25 -1.27 -0.74 0.09 0.00 0.00 178.44 176.81 1yaa h HIS 113 N 0.00 0.48 -0.50 1.13 2.76 -0.44 -2.36 115.15 116.22 1yaa h HIS 113 Ca -0.00 -0.35 -0.10 0.00 -2.20 0.00 0.00 60.37 57.72 1yaa h HIS 113 Cb 0.86 -0.02 -0.02 0.00 1.55 0.00 0.00 27.41 29.78 1yaa h HIS 113 CO 0.00 1.29 -0.08 0.82 -1.30 0.00 0.00 177.93 178.66 1yaa h ILE 114 N 0.07 1.26 -0.23 6.26 2.04 -1.15 0.57 117.51 126.33 1yaa h ILE 114 Ca -0.14 -1.18 -0.04 0.00 1.00 0.00 0.00 64.86 64.50 1yaa h ILE 114 Cb 1.98 0.96 -0.01 0.00 -0.74 0.00 0.00 36.82 39.01 1yaa h ILE 114 CO 0.20 0.41 0.01 0.28 0.00 0.00 0.00 178.15 179.05 1yaa h SER 115 N 0.81 0.40 -0.72 1.72 0.02 -1.51 -0.61 113.55 113.66 1yaa h SER 115 Ca 0.14 -0.30 -0.06 0.00 -0.84 0.00 0.00 61.79 60.73 1yaa h SER 115 Cb 0.59 -0.11 -0.03 0.00 0.14 0.00 0.00 62.40 63.00 1yaa h SER 115 CO 0.04 0.61 0.23 0.00 -1.14 0.00 0.00 176.83 176.56 1yaa h ALA 116 N 0.81 0.95 -0.28 3.77 0.00 -1.26 -0.54 119.26 122.70 1yaa h ALA 116 Ca 0.07 -0.22 -0.13 0.00 0.00 0.00 0.00 54.91 54.63 1yaa h ALA 116 Cb 0.40 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1yaa h ALA 116 CO 0.01 0.62 -0.34 -0.22 0.00 0.00 0.00 179.25 179.32 1yaa h LYS 117 N 1.07 0.62 -0.22 0.00 1.63 -0.81 -0.80 116.57 118.06 1yaa h LYS 117 Ca 0.23 -0.29 -0.03 0.00 -0.85 0.00 0.00 60.65 59.71 1yaa h LYS 117 Cb 0.30 -0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 31.91 1yaa h LYS 117 CO -0.01 0.88 0.00 0.35 -3.45 0.00 0.00 179.45 177.22 1yaa h PHE 118 N 0.53 0.41 -0.59 1.91 3.57 -0.85 -2.82 116.94 119.11 1yaa h PHE 118 Ca 0.06 -0.07 -0.03 0.00 3.53 0.00 0.00 57.97 61.46 1yaa h PHE 118 Cb 0.84 -0.11 -0.03 0.00 2.79 0.00 0.00 35.95 39.45 1yaa h PHE 118 CO 0.04 0.56 0.26 0.74 -2.23 0.00 0.00 178.31 177.68 1yaa h PHE 119 N 0.15 0.86 0.00 0.41 0.04 -0.95 -2.33 116.94 115.12 1yaa h PHE 119 Ca 0.06 -0.05 0.00 0.00 2.80 0.00 0.00 57.97 60.78 1yaa h PHE 119 Cb 0.40 -0.26 0.00 0.00 2.20 0.00 0.00 35.95 38.28 1yaa h PHE 119 CO 0.03 0.67 0.00 0.66 -0.60 0.00 0.00 178.31 179.08 1yaa h SER 120 N 0.80 0.00 0.04 2.17 4.64 -1.08 -0.43 113.55 119.70 1yaa h SER 120 Ca 0.20 0.00 -0.36 0.00 -0.47 0.00 0.00 61.79 61.15 1yaa h SER 120 Cb 0.15 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.17 1yaa h SER 120 CO -0.02 0.00 -2.33 0.29 -0.87 0.00 0.00 176.83 173.90 1yaa n LYS 121 N -2.38 0.68 -0.06 4.77 5.02 -0.98 -4.47 118.16 120.75 1yaa n LYS 121 Ca 0.01 0.03 -0.07 0.00 -2.02 0.00 0.00 58.31 56.25 1yaa n LYS 121 Cb 0.18 -1.55 -0.05 0.00 -0.02 0.00 0.00 35.03 33.59 1yaa n LYS 121 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1yaa n PHE 122 N -2.81 0.00 -3.18 2.13 3.72 -0.91 -4.84 117.46 111.56 1yaa n PHE 122 Ca -0.32 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 56.85 1yaa n PHE 122 Cb 1.14 -0.43 -0.05 0.00 -0.94 0.00 0.00 39.48 39.20 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 -2.78 1.25 0.26 1.38 3.72 -0.23 -4.94 117.46 116.11 1yaa n PHE 123 Ca -0.19 -3.83 0.17 0.00 -0.05 0.00 0.00 57.45 53.54 1yaa n PHE 123 Cb 0.72 -0.43 0.87 0.00 -0.94 0.00 0.00 39.48 39.69 1yaa n PHE 123 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 1yaa h PRO 129 N 3.46 0.00 0.00 -1.08 0.11 -1.62 -2.86 132.00 130.01 1yaa h PRO 129 Ca 0.11 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 66.06 1yaa h PRO 129 Cb 0.81 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.90 1yaa h PRO 129 CO 0.60 0.00 -1.01 0.38 -0.21 0.00 0.00 178.00 177.75 1yaa h ASP 130 N 0.00 0.00 -2.52 -2.05 2.03 -1.92 -3.44 116.42 108.51 1yaa h ASP 130 Ca 0.00 0.00 -0.55 0.00 -0.73 0.00 0.00 57.03 55.75 1yaa h ASP 130 Cb 0.05 0.00 0.06 0.00 -0.83 0.00 0.00 39.33 38.61 1yaa h ASP 130 CO 0.00 0.64 0.91 0.29 -1.03 0.00 0.00 179.24 180.05 1yaa n LYS 131 N -3.10 2.50 -2.76 4.15 4.76 -1.08 -4.94 118.16 117.69 1yaa n LYS 131 Ca -0.04 0.90 -0.38 0.00 -2.87 0.00 0.00 58.31 55.92 1yaa n LYS 131 Cb 0.83 -2.71 -0.06 0.00 -1.84 0.00 0.00 35.03 31.25 1yaa n LYS 131 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1yaa s LEU 132 N 0.97 4.43 -0.39 -0.35 1.43 -1.26 -4.53 118.68 118.98 1yaa s LEU 132 Ca 0.76 1.88 -0.08 0.00 -1.03 0.00 0.00 54.13 55.66 1yaa s LEU 132 Cb -0.58 -3.89 0.07 0.00 0.03 0.00 0.00 46.19 41.81 1yaa s LEU 132 CO 0.36 -0.01 0.21 -0.69 0.23 0.00 0.00 176.35 176.44 1yaa s VAL 133 N -1.48 4.06 -0.07 -1.59 1.01 -0.24 -2.10 120.40 119.99 1yaa s VAL 133 Ca 0.48 -1.34 -0.23 0.00 0.00 0.00 0.00 61.98 60.89 1yaa s VAL 133 Cb -0.21 -3.44 -0.04 0.00 0.00 0.00 0.00 36.38 32.69 1yaa s VAL 133 CO 0.27 -0.41 0.70 -0.31 0.00 0.00 0.00 175.10 175.34 1yaa s TYR 134 N 1.41 3.57 0.29 5.22 1.51 -0.16 -0.52 117.35 128.67 1yaa s TYR 134 Ca 0.02 1.24 0.11 0.00 -1.01 0.00 0.00 57.07 57.43 1yaa s TYR 134 Cb -0.22 -2.80 -0.05 0.00 -0.11 0.00 0.00 41.96 38.78 1yaa s TYR 134 CO 0.02 0.08 -0.15 -0.51 -1.11 0.00 0.00 175.55 173.88 1yaa s LEU 135 N 0.82 2.70 0.34 -1.29 1.43 -0.02 -1.97 118.68 120.70 1yaa s LEU 135 Ca 0.37 -1.00 -0.28 0.00 -1.03 0.00 0.00 54.13 52.19 1yaa s LEU 135 Cb -0.18 -1.17 -0.09 0.00 0.03 0.00 0.00 46.19 44.78 1yaa s LEU 135 CO 0.18 -0.01 1.16 -0.44 0.23 0.00 0.00 176.35 177.47 1yaa s SER 136 N -3.55 6.90 0.05 2.29 0.01 -1.26 -0.41 113.70 117.73 1yaa s SER 136 Ca 0.31 2.36 -0.31 0.00 1.31 0.00 0.00 55.95 59.62 1yaa s SER 136 Cb -0.04 -2.62 -0.05 0.00 0.21 0.00 0.00 66.02 63.51 1yaa s SER 136 CO 0.16 -0.41 1.19 -0.75 0.41 0.00 0.00 173.24 173.84 1yaa s LYS 137 N -1.86 4.43 -0.34 12.44 2.20 0.68 -2.81 119.74 134.47 1yaa s LYS 137 Ca 0.50 1.75 -0.08 0.00 -0.36 0.00 0.00 55.97 57.78 1yaa s LYS 137 Cb -0.32 -3.37 0.01 0.00 -1.51 0.00 0.00 37.83 32.64 1yaa s LYS 137 CO 0.42 -0.26 0.31 -0.35 -0.36 0.00 0.00 175.35 175.10 1yaa n PRO 138 N 4.02 -2.58 -3.73 4.03 -0.04 -1.26 -3.88 135.00 131.55 1yaa n PRO 138 Ca 0.09 2.23 -0.25 0.00 -0.04 0.00 0.00 63.50 65.53 1yaa n PRO 138 Cb 0.46 -5.13 -0.00 0.00 -0.04 0.00 0.00 33.50 28.79 1yaa n PRO 138 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1yaa s THR 139 N -2.03 1.87 0.27 0.52 -1.32 -1.12 -4.29 115.64 109.54 1yaa s THR 139 Ca 0.13 -1.41 -0.29 0.00 -1.21 0.00 0.00 61.69 58.91 1yaa s THR 139 Cb -0.04 -2.27 -0.14 0.00 -1.51 0.00 0.00 72.50 68.54 1yaa s THR 139 CO 0.70 0.00 1.08 1.87 -2.21 0.00 0.00 174.62 176.06 1yaa n TRP 140 N -1.79 1.40 0.31 9.09 -0.00 -1.25 -4.68 117.44 120.53 1yaa n TRP 140 Ca 0.01 0.67 0.19 0.00 -0.00 0.00 0.00 57.50 58.37 1yaa n TRP 140 Cb 0.64 -2.28 1.04 0.00 -0.00 0.00 0.00 31.31 30.71 1yaa n TRP 140 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 1yaa h ALA 141 N 2.41 1.24 -0.01 5.87 0.00 -1.98 -2.88 119.26 123.92 1yaa h ALA 141 Ca -0.41 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1yaa h ALA 141 Cb 1.33 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.12 1yaa h ALA 141 CO 0.63 0.01 -0.77 -1.71 0.00 0.00 0.00 179.25 177.42 1yaa n ASN 142 N -3.45 1.39 -0.07 0.00 5.15 -1.26 -4.57 115.26 112.44 1yaa n ASN 142 Ca -0.03 -1.19 -0.07 0.00 -0.60 0.00 0.00 54.58 52.69 1yaa n ASN 142 Cb 0.10 0.79 -0.01 0.00 -0.53 0.00 0.00 39.78 40.13 1yaa n ASN 142 CO 0.00 0.00 0.00 0.45 1.40 0.00 0.00 177.26 179.11 1yaa h HIS 143 N 0.96 -0.11 -0.37 1.20 3.86 -1.88 -2.35 115.15 116.46 1yaa h HIS 143 Ca 0.00 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.23 1yaa h HIS 143 Cb 0.59 0.09 -0.02 0.00 1.06 0.00 0.00 27.41 29.13 1yaa h HIS 143 CO 0.00 -0.10 0.23 1.98 0.86 0.00 0.00 177.93 180.91 1yaa h MET 144 N 0.03 0.50 -0.84 2.45 1.85 -1.81 -3.01 114.93 114.10 1yaa h MET 144 Ca 0.14 -0.04 -0.04 0.00 -0.61 0.00 0.00 59.70 59.15 1yaa h MET 144 Cb 0.20 -0.11 -0.04 0.00 0.43 0.00 0.00 31.60 32.09 1yaa h MET 144 CO -0.27 0.35 0.38 0.00 -0.40 0.00 0.00 176.91 176.98 1yaa h ALA 145 N 1.11 1.08 -0.64 0.39 0.00 -1.81 0.32 119.26 119.71 1yaa h ALA 145 Ca 0.13 -0.17 0.05 0.00 0.00 0.00 0.00 54.91 54.92 1yaa h ALA 145 Cb -0.02 -0.33 -0.05 0.00 0.00 0.00 0.00 17.79 17.39 1yaa h ALA 145 CO -0.03 0.66 0.36 0.82 0.00 0.00 0.00 179.25 181.07 1yaa h ILE 146 N 1.20 1.00 0.18 0.00 2.04 -1.30 0.16 117.51 120.79 1yaa h ILE 146 Ca 0.29 -0.24 -0.30 0.00 1.00 0.00 0.00 64.86 65.61 1yaa h ILE 146 Cb 0.15 0.25 0.02 0.00 -0.74 0.00 0.00 36.82 36.50 1yaa h ILE 146 CO -0.03 0.13 -1.37 -0.26 0.00 0.00 0.00 178.15 176.61 1yaa h PHE 147 N 0.69 0.70 0.00 1.37 0.04 -1.41 -3.28 116.94 115.05 1yaa h PHE 147 Ca 0.28 -0.51 0.00 0.00 2.80 0.00 0.00 57.97 60.54 1yaa h PHE 147 Cb 0.13 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 38.25 1yaa h PHE 147 CO -0.07 1.41 0.00 0.39 -0.60 0.00 0.00 178.31 179.44 1yaa n GLU 148 N -3.60 0.21 0.13 1.51 1.02 0.08 -2.25 120.64 117.73 1yaa n GLU 148 Ca -0.13 0.27 0.13 0.00 -0.02 0.00 0.00 57.16 57.41 1yaa n GLU 148 Cb 1.06 -1.79 0.46 0.00 -0.02 0.00 0.00 31.44 31.15 1yaa n GLU 148 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1yaa n ASN 149 N -2.16 0.76 -0.66 1.62 5.15 0.54 -2.45 115.26 118.07 1yaa n ASN 149 Ca 0.04 0.64 0.06 0.00 -0.60 0.00 0.00 54.58 54.72 1yaa n ASN 149 Cb 0.34 -0.82 0.17 0.00 -0.53 0.00 0.00 39.78 38.95 1yaa n ASN 149 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1yaa n GLN 150 N -2.29 2.88 -0.97 1.20 1.13 -0.95 -4.99 117.38 113.39 1yaa n GLN 150 Ca 0.03 -2.20 0.00 0.00 -1.94 0.00 0.00 57.00 52.90 1yaa n GLN 150 Cb 0.31 -1.38 0.00 0.00 0.11 0.00 0.00 30.24 29.29 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 0.24 0.76 3.79 1.08 0.00 -1.03 -4.78 105.19 105.24 1yaa n GLY 151 Ca 0.13 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.79 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 4.07 -0.13 0.99 1.43 -1.08 -5.00 118.68 118.95 1yaa s LEU 152 Ca 0.00 1.97 -0.19 0.00 -1.03 0.00 0.00 54.13 54.89 1yaa s LEU 152 Cb 0.00 -4.29 -0.04 0.00 0.03 0.00 0.00 46.19 41.89 1yaa s LEU 152 CO 0.00 -0.52 0.51 -0.54 0.23 0.00 0.00 176.35 176.02 1yaa s LYS 153 N -2.69 4.31 -0.04 1.70 3.01 -1.26 -4.29 119.74 120.47 1yaa s LYS 153 Ca 0.60 0.48 -0.01 0.00 -1.01 0.00 0.00 55.97 56.03 1yaa s LYS 153 Cb -0.19 -3.47 -0.04 0.00 -1.01 0.00 0.00 37.83 33.12 1yaa s LYS 153 CO 0.24 0.07 0.02 0.95 0.51 0.00 0.00 175.35 177.14 1yaa s THR 154 N 0.90 4.36 0.46 2.17 -4.23 -1.26 -1.07 115.64 116.97 1yaa s THR 154 Ca 0.26 -0.38 0.03 0.00 -1.18 0.00 0.00 61.69 60.42 1yaa s THR 154 Cb -0.15 -2.90 -0.04 0.00 1.34 0.00 0.00 72.50 70.75 1yaa s THR 154 CO 0.11 0.48 0.02 0.00 -0.54 0.00 0.00 174.62 174.69 1yaa s ALA 155 N -1.01 3.62 0.03 3.99 0.00 0.32 -4.88 121.76 123.82 1yaa s ALA 155 Ca 0.17 -1.11 0.04 0.00 0.00 0.00 0.00 51.96 51.06 1yaa s ALA 155 Cb -0.12 0.19 -0.02 0.00 0.00 0.00 0.00 23.12 23.17 1yaa s ALA 155 CO 0.07 -0.10 -0.12 -0.08 0.00 0.00 0.00 175.76 175.53 1yaa s THR 156 N -2.89 0.91 -0.01 0.00 -1.32 -1.26 -0.84 115.64 110.22 1yaa s THR 156 Ca 0.18 -0.83 0.08 0.00 -1.21 0.00 0.00 61.69 59.90 1yaa s THR 156 Cb 0.04 -0.83 -0.02 0.00 -1.51 0.00 0.00 72.50 70.19 1yaa s THR 156 CO 0.09 0.00 -0.25 -0.72 -2.21 0.00 0.00 174.62 171.54 1yaa s TYR 158 N -0.74 2.20 0.36 9.09 -0.85 0.46 -4.87 117.35 123.00 1yaa s TYR 158 Ca 0.00 -0.41 -0.28 0.00 -0.52 0.00 0.00 57.07 55.86 1yaa s TYR 158 Cb -0.07 -1.41 -0.12 0.00 0.38 0.00 0.00 41.96 40.75 1yaa s TYR 158 CO 0.01 -0.03 1.33 -2.30 -1.52 0.00 0.00 175.55 173.04 1yaa n PRO 159 N 2.43 2.22 0.09 -3.49 -0.02 -1.26 -0.23 135.00 134.74 1yaa n PRO 159 Ca -0.16 0.78 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 1yaa n PRO 159 Cb 0.52 -2.41 0.00 0.00 -0.02 0.00 0.00 33.50 31.58 1yaa n PRO 159 CO 0.00 0.00 0.00 0.98 1.98 0.00 0.00 175.50 178.46 1yaa n TYR 160 N 0.28 -1.74 -3.17 6.00 9.36 -1.25 -3.73 117.16 122.91 1yaa n TYR 160 Ca 0.04 0.34 -0.39 0.00 3.32 0.00 0.00 57.90 61.21 1yaa n TYR 160 Cb 0.37 0.84 -0.06 0.00 -0.63 0.00 0.00 39.34 39.87 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 -1.52 3.44 -0.42 2.98 -0.11 -1.25 -0.05 118.94 122.01 1yaa s TRP 161 Ca 0.00 0.95 -0.11 0.00 1.22 0.00 0.00 56.10 58.15 1yaa s TRP 161 Cb 0.00 -2.73 0.06 0.00 -1.50 0.00 0.00 33.47 29.30 1yaa s TRP 161 CO 0.00 -0.05 0.28 0.00 -4.62 0.00 0.00 176.95 172.56 1yaa s ALA 162 N 1.42 3.35 0.39 5.86 0.00 -0.30 -4.83 121.76 127.66 1yaa s ALA 162 Ca 0.29 -2.02 0.06 0.00 0.00 0.00 0.00 51.96 50.29 1yaa s ALA 162 Cb -0.16 -2.73 0.79 0.00 0.00 0.00 0.00 23.12 21.02 1yaa s ALA 162 CO 0.11 -1.60 2.02 -0.97 0.00 0.00 0.00 175.76 175.32 1yaa h ASN 163 N 8.50 0.49 0.18 0.00 -1.24 -1.95 -0.73 115.58 120.82 1yaa h ASN 163 Ca -0.25 -0.03 0.01 0.00 0.71 0.00 0.00 56.30 56.74 1yaa h ASN 163 Cb 1.09 -0.12 -0.04 0.00 0.73 0.00 0.00 38.32 39.98 1yaa h ASN 163 CO 0.76 0.40 -0.47 -0.33 -1.29 0.00 0.00 177.43 176.50 1yaa h GLU 164 N 0.56 -0.69 -0.30 6.67 4.39 -1.95 -3.10 114.58 120.17 1yaa h GLU 164 Ca 0.15 0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.89 1yaa h GLU 164 Cb 0.02 0.16 0.00 0.00 -0.10 0.00 0.00 28.75 28.82 1yaa h GLU 164 CO -0.02 -0.46 0.00 0.25 -1.16 0.00 0.00 179.01 177.61 1yaa n THR 165 N -5.14 0.38 -1.20 1.13 -2.24 -1.22 -4.94 114.28 101.05 1yaa n THR 165 Ca -0.08 -0.64 -0.07 0.00 -2.27 0.00 0.00 64.05 60.99 1yaa n THR 165 Cb 0.38 0.95 -0.03 0.00 -2.10 0.00 0.00 70.33 69.52 1yaa n THR 165 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1yaa n LYS 166 N 1.27 -1.69 -3.09 -0.78 3.00 -0.29 -4.94 118.16 111.64 1yaa n LYS 166 Ca 0.18 0.73 -0.20 0.00 -0.00 0.00 0.00 58.31 59.02 1yaa n LYS 166 Cb 0.56 -5.11 0.04 0.00 0.00 0.00 0.00 35.03 30.52 1yaa n LYS 166 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 1yaa n SER 167 N -1.02 2.16 -4.57 3.14 3.41 -1.17 -4.89 113.62 110.68 1yaa n SER 167 Ca -0.07 -2.52 -0.41 0.00 -0.26 0.00 0.00 58.87 55.61 1yaa n SER 167 Cb 0.53 -0.27 -0.08 0.00 -0.26 0.00 0.00 64.21 64.13 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 4.29 -0.97 1.04 0.20 -1.26 -1.15 118.68 120.82 1yaa s LEU 168 Ca 0.47 0.04 -0.24 0.00 0.69 0.00 0.00 54.13 55.09 1yaa s LEU 168 Cb -0.04 -2.52 -0.04 0.00 -0.43 0.00 0.00 46.19 43.17 1yaa s LEU 168 CO 0.30 -0.39 1.87 -0.62 -0.29 0.00 0.00 176.35 177.23 1yaa s ASP 169 N 1.71 5.35 0.25 3.68 2.15 0.93 -4.77 116.67 125.98 1yaa s ASP 169 Ca 0.17 -0.98 0.01 0.00 0.43 0.00 0.00 52.55 52.18 1yaa s ASP 169 Cb -0.16 -2.57 0.31 0.00 -0.30 0.00 0.00 42.92 40.21 1yaa s ASP 169 CO 0.12 -2.59 1.65 0.25 -0.17 0.00 0.00 175.17 174.43 1yaa h LEU 170 N 17.04 0.50 -0.55 -1.34 7.12 -1.92 -2.15 115.31 134.01 1yaa h LEU 170 Ca 0.14 -0.20 -0.12 0.00 0.13 0.00 0.00 57.88 57.83 1yaa h LEU 170 Cb 0.99 -0.14 -0.02 0.00 -0.53 0.00 0.00 40.66 40.97 1yaa h LEU 170 CO 1.25 0.82 -0.56 0.78 -0.13 0.00 0.00 178.44 180.60 1yaa h ASN 171 N 0.40 0.00 0.69 1.25 2.35 -1.97 -1.66 115.58 116.64 1yaa h ASN 171 Ca 0.04 0.00 -0.21 0.00 -0.55 0.00 0.00 56.30 55.58 1yaa h ASN 171 Cb 0.82 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.18 1yaa h ASN 171 CO 0.07 0.56 -0.95 1.23 -1.65 0.00 0.00 177.43 176.68 1yaa h GLY 172 N 2.47 0.18 0.49 2.83 0.00 -1.85 -2.69 103.07 104.49 1yaa h GLY 172 Ca -0.01 -0.35 -0.02 0.00 0.00 0.00 0.00 47.33 46.95 1yaa h GLY 172 CO 0.07 0.31 -0.15 -2.75 0.00 0.00 0.00 176.54 174.03 1yaa h PHE 173 N 0.07 -0.39 -0.02 5.60 3.04 -1.28 -2.63 116.94 121.34 1yaa h PHE 173 Ca -0.05 -0.01 0.00 0.00 3.98 0.00 0.00 57.97 61.90 1yaa h PHE 173 Cb 1.63 0.13 -0.00 0.00 2.56 0.00 0.00 35.95 40.26 1yaa h PHE 173 CO 0.03 -0.05 0.01 -0.07 -2.02 0.00 0.00 178.31 176.21 1yaa h LEU 174 N -0.93 0.00 -0.18 0.59 4.07 -1.41 -2.15 115.31 115.30 1yaa h LEU 174 Ca -0.04 0.00 -0.12 0.00 0.08 0.00 0.00 57.88 57.79 1yaa h LEU 174 Cb 0.51 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.25 1yaa h LEU 174 CO 0.07 0.00 -0.37 -1.13 -1.08 0.00 0.00 178.44 175.93 1yaa h ASN 175 N 0.00 0.63 -0.11 -0.43 -1.24 -1.50 -3.02 115.58 109.91 1yaa h ASN 175 Ca 0.01 -0.56 -0.00 0.00 0.71 0.00 0.00 56.30 56.46 1yaa h ASN 175 Cb 0.03 -0.18 -0.01 0.00 0.73 0.00 0.00 38.32 38.89 1yaa h ASN 175 CO -0.00 1.07 0.07 0.00 -1.29 0.00 0.00 177.43 177.28 1yaa h ALA 176 N 0.58 1.86 0.00 1.57 0.00 -1.00 0.60 119.26 122.86 1yaa h ALA 176 Ca 0.00 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 1yaa h ALA 176 Cb 0.97 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 1yaa h ALA 176 CO 0.08 0.12 -0.22 0.82 0.00 0.00 0.00 179.25 180.05 1yaa h ILE 177 N 0.18 0.44 0.06 0.00 2.04 -1.44 -3.10 117.51 115.70 1yaa h ILE 177 Ca 0.05 -1.29 -0.22 0.00 1.00 0.00 0.00 64.86 64.40 1yaa h ILE 177 Cb 0.02 1.94 -0.01 0.00 -0.74 0.00 0.00 36.82 38.03 1yaa h ILE 177 CO -0.01 0.21 -1.16 1.56 0.00 0.00 0.00 178.15 178.75 1yaa h GLN 178 N 0.00 0.12 -1.11 2.37 4.20 -0.96 -3.35 115.11 116.38 1yaa h GLN 178 Ca -0.00 -0.21 -0.08 0.00 0.06 0.00 0.00 58.65 58.42 1yaa h GLN 178 Cb 0.93 0.08 -0.05 0.00 0.30 0.00 0.00 27.48 28.74 1yaa h GLN 178 CO 0.03 1.10 0.10 1.63 -0.67 0.00 0.00 178.83 181.02 1yaa n LYS 179 N -4.19 1.20 -4.74 1.46 5.02 0.03 -4.82 118.16 112.12 1yaa n LYS 179 Ca -0.25 -0.46 -0.30 0.00 -2.02 0.00 0.00 58.31 55.28 1yaa n LYS 179 Cb 0.77 -1.18 -0.14 0.00 -0.02 0.00 0.00 35.03 34.46 1yaa n LYS 179 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1yaa s ALA 180 N -0.51 2.35 0.24 7.82 0.00 -1.17 -4.98 121.76 125.51 1yaa s ALA 180 Ca 0.09 -1.30 -0.31 0.00 0.00 0.00 0.00 51.96 50.43 1yaa s ALA 180 Cb 0.07 -0.50 -0.13 0.00 0.00 0.00 0.00 23.12 22.56 1yaa s ALA 180 CO 0.01 0.54 1.50 -2.30 0.00 0.00 0.00 175.76 175.52 1yaa n PRO 181 N 1.53 2.27 -1.71 0.00 -0.02 -1.26 -4.89 135.00 130.92 1yaa n PRO 181 Ca -0.17 0.81 -0.43 0.00 -2.02 0.00 0.00 63.50 61.69 1yaa n PRO 181 Cb 0.52 -2.53 -0.03 0.00 -0.02 0.00 0.00 33.50 31.44 1yaa n PRO 181 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1yaa n GLU 182 N 2.40 2.67 -0.30 -0.52 1.02 -1.26 -2.19 120.64 122.45 1yaa n GLU 182 Ca 0.12 0.96 0.00 0.00 -0.02 0.00 0.00 57.16 58.22 1yaa n GLU 182 Cb 0.33 -2.80 0.00 0.00 -0.02 0.00 0.00 31.44 28.95 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 3.87 0.84 3.81 0.62 0.00 -0.94 -4.98 105.19 108.41 1yaa n GLY 183 Ca 0.16 -0.13 -0.33 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.12 6.75 -0.29 1.61 0.01 -0.93 -4.49 113.70 114.24 1yaa s SER 184 Ca 0.00 1.75 -0.20 0.00 1.31 0.00 0.00 55.95 58.82 1yaa s SER 184 Cb 0.00 -2.54 -0.01 0.00 0.21 0.00 0.00 66.02 63.67 1yaa s SER 184 CO 0.00 -0.49 0.60 -0.63 0.41 0.00 0.00 173.24 173.13 1yaa s ILE 185 N -2.14 4.97 -0.29 1.44 1.01 -0.89 -0.54 121.20 124.76 1yaa s ILE 185 Ca 0.63 0.86 -0.07 0.00 0.00 0.00 0.00 60.65 62.07 1yaa s ILE 185 Cb -0.11 -3.96 0.00 0.00 0.01 0.00 0.00 42.46 38.40 1yaa s ILE 185 CO 0.16 -0.08 0.09 -0.36 0.00 0.00 0.00 174.94 174.74 1yaa s PHE 186 N 2.53 3.14 -0.37 3.97 0.40 0.31 -0.98 117.98 126.97 1yaa s PHE 186 Ca 0.24 -0.83 -0.23 0.00 -0.60 0.00 0.00 56.93 55.51 1yaa s PHE 186 Cb -0.15 -2.27 0.01 0.00 0.51 0.00 0.00 43.02 41.12 1yaa s PHE 186 CO 0.11 -0.53 0.77 0.08 0.70 0.00 0.00 175.22 176.35 1yaa s VAL 187 N 1.53 4.75 -0.03 -0.44 1.01 -0.83 -1.40 120.40 124.99 1yaa s VAL 187 Ca 0.04 0.83 0.05 0.00 0.00 0.00 0.00 61.98 62.89 1yaa s VAL 187 Cb -0.17 -4.20 -0.03 0.00 0.00 0.00 0.00 36.38 31.98 1yaa s VAL 187 CO 0.03 -0.43 -0.16 -0.76 0.00 0.00 0.00 175.10 173.77 1yaa s LEU 188 N 3.07 2.64 -0.45 3.92 1.43 0.00 -4.53 118.68 124.76 1yaa s LEU 188 Ca 0.31 -0.27 -0.25 0.00 -1.03 0.00 0.00 54.13 52.89 1yaa s LEU 188 Cb -0.13 -1.53 0.03 0.00 0.03 0.00 0.00 46.19 44.58 1yaa s LEU 188 CO 0.17 0.33 0.92 -1.00 0.23 0.00 0.00 176.35 176.99 1yaa s HIS 189 N -0.75 2.94 0.30 0.29 3.76 -1.26 -0.74 115.29 119.82 1yaa s HIS 189 Ca 0.12 0.41 0.06 0.00 -0.15 0.00 0.00 55.06 55.50 1yaa s HIS 189 Cb -0.11 -3.92 0.80 0.00 1.11 0.00 0.00 32.58 30.47 1yaa s HIS 189 CO 0.01 -1.07 1.71 0.77 -0.85 0.00 0.00 174.74 175.31 1yaa h SER 190 N 9.01 0.48 -4.71 1.40 0.02 -1.86 -3.45 113.55 114.44 1yaa h SER 190 Ca -0.24 0.15 0.18 0.00 -0.84 0.00 0.00 61.79 61.04 1yaa h SER 190 Cb 1.08 0.09 -0.15 0.00 0.14 0.00 0.00 62.40 63.56 1yaa h SER 190 CO 1.02 0.04 0.62 0.00 -1.14 0.00 0.00 176.83 177.36 1yaa n ALA 192 N -0.25 -2.59 -1.64 0.00 0.00 -1.26 -4.62 120.51 110.14 1yaa n ALA 192 Ca -0.06 -0.12 -0.51 0.00 0.00 0.00 0.00 53.44 52.76 1yaa n ALA 192 Cb 0.61 -2.32 -0.06 0.00 0.00 0.00 0.00 19.45 17.68 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 -2.71 2.10 -3.12 0.00 -0.00 -1.26 -4.81 115.22 105.42 1yaa n HIS 193 Ca -0.11 0.18 -0.39 0.00 0.46 0.00 0.00 57.72 57.85 1yaa n HIS 193 Cb 0.58 -2.59 -0.05 0.00 -0.12 0.00 0.00 29.99 27.81 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 4.82 6.85 -0.07 0.26 3.84 -1.26 0.75 114.94 130.12 1yaa s ASN 194 Ca 0.98 1.02 0.01 0.00 0.21 0.00 0.00 52.86 55.08 1yaa s ASN 194 Cb -0.80 -2.37 -0.25 0.00 -0.55 0.00 0.00 41.25 37.28 1yaa s ASN 194 CO 0.54 -0.13 0.56 -0.65 -2.79 0.00 0.00 177.10 174.63 1yaa h PRO 195 N 6.92 0.17 -0.36 0.43 0.11 -1.83 -3.32 132.00 134.11 1yaa h PRO 195 Ca -0.39 -0.29 -0.03 0.00 0.11 0.00 0.00 66.00 65.40 1yaa h PRO 195 Cb 1.18 0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.38 1yaa h PRO 195 CO 0.76 0.94 0.10 1.79 -0.21 0.00 0.00 178.00 181.38 1yaa h THR 196 N 0.05 1.22 -0.22 -1.15 1.35 -1.82 -3.34 112.91 109.00 1yaa h THR 196 Ca -0.34 -0.74 -0.06 0.00 -0.55 0.00 0.00 66.41 64.72 1yaa h THR 196 Cb 2.03 1.02 -0.02 0.00 -1.73 0.00 0.00 68.15 69.44 1yaa h THR 196 CO 0.10 0.25 -0.06 0.61 -0.25 0.00 0.00 175.52 176.17 1yaa n GLY 197 N -0.59 0.53 3.06 5.82 0.00 0.23 -3.96 105.19 110.27 1yaa n GLY 197 Ca -0.01 -0.89 -0.32 0.00 0.00 0.00 0.00 46.02 44.80 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 -0.76 3.22 0.18 0.99 2.96 -1.26 -0.91 118.68 123.09 1yaa s LEU 198 Ca 0.00 -1.30 0.05 0.00 -0.22 0.00 0.00 54.13 52.67 1yaa s LEU 198 Cb 0.00 -1.50 -0.04 0.00 0.50 0.00 0.00 46.19 45.16 1yaa s LEU 198 CO 0.00 -0.18 0.15 -1.81 -1.32 0.00 0.00 176.35 173.20 1yaa s ASP 199 N 1.15 5.54 0.57 3.68 1.01 -1.26 -4.69 116.67 122.68 1yaa s ASP 199 Ca -0.07 -0.15 -0.18 0.00 0.71 0.00 0.00 52.55 52.86 1yaa s ASP 199 Cb -0.19 -1.44 -0.04 0.00 1.01 0.00 0.00 42.92 42.25 1yaa s ASP 199 CO -0.06 0.04 1.11 -2.84 0.21 0.00 0.00 175.17 173.63 1yaa s PRO 200 N -3.27 3.26 1.01 8.23 0.02 -1.26 -5.02 135.00 137.97 1yaa s PRO 200 Ca 0.31 1.49 -0.15 0.00 0.02 0.00 0.00 61.00 62.67 1yaa s PRO 200 Cb -0.10 -2.00 0.20 0.00 0.02 0.00 0.00 34.50 32.62 1yaa s PRO 200 CO 0.24 -0.90 1.18 0.95 -0.33 0.00 0.00 177.00 178.13 1yaa s THR 201 N -2.00 1.89 0.28 0.99 -4.23 -1.26 -4.74 115.64 106.56 1yaa s THR 201 Ca 0.70 0.00 -0.00 0.00 -1.18 0.00 0.00 61.69 61.21 1yaa s THR 201 Cb -0.21 -2.73 0.28 0.00 1.34 0.00 0.00 72.50 71.17 1yaa s THR 201 CO 0.31 0.00 1.88 0.28 -0.54 0.00 0.00 174.62 176.55 1yaa h SER 202 N -1.85 0.96 -0.31 3.99 0.02 -2.00 -0.94 113.55 113.43 1yaa h SER 202 Ca -0.47 0.02 -0.07 0.00 -0.84 0.00 0.00 61.79 60.42 1yaa h SER 202 Cb 1.30 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 63.64 1yaa h SER 202 CO 0.48 0.59 -0.08 -0.08 -1.14 0.00 0.00 176.83 176.60 1yaa h GLU 203 N 1.08 0.61 -0.25 3.45 4.81 -2.01 -3.06 114.58 119.20 1yaa h GLU 203 Ca 0.44 -0.23 -0.07 0.00 -0.13 0.00 0.00 59.36 59.36 1yaa h GLU 203 Cb 0.28 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.61 1yaa h GLU 203 CO -0.19 0.79 -0.17 1.96 -0.73 0.00 0.00 179.01 180.67 1yaa h GLN 204 N 0.38 0.42 -0.16 1.92 4.20 -1.74 -2.53 115.11 117.61 1yaa h GLN 204 Ca 0.08 -0.13 -0.05 0.00 0.06 0.00 0.00 58.65 58.62 1yaa h GLN 204 Cb 0.57 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.30 1yaa h GLN 204 CO 0.03 0.58 -0.11 -1.49 -0.67 0.00 0.00 178.83 177.18 1yaa h TRP 205 N 0.39 0.25 -0.32 2.96 4.06 -1.13 -0.64 115.95 121.53 1yaa h TRP 205 Ca 0.07 -0.02 -0.03 0.00 2.06 0.00 0.00 58.89 60.97 1yaa h TRP 205 Cb 0.52 -0.07 -0.01 0.00 -1.00 0.00 0.00 29.16 28.60 1yaa h TRP 205 CO 0.01 0.35 0.09 0.28 -3.56 0.00 0.00 178.44 175.62 1yaa h VAL 206 N 0.23 1.21 -0.24 1.49 2.07 -1.36 0.23 116.25 119.88 1yaa h VAL 206 Ca 0.05 -0.70 -0.02 0.00 0.82 0.00 0.00 66.70 66.85 1yaa h VAL 206 Cb 0.34 1.07 -0.01 0.00 -1.52 0.00 0.00 31.29 31.17 1yaa h VAL 206 CO 0.02 0.23 0.08 1.56 0.02 0.00 0.00 177.57 179.48 1yaa h GLN 207 N 0.35 0.38 -0.82 1.57 4.20 -1.41 -0.17 115.11 119.21 1yaa h GLN 207 Ca 0.10 -0.08 0.06 0.00 0.06 0.00 0.00 58.65 58.79 1yaa h GLN 207 Cb 0.27 -0.05 -0.06 0.00 0.30 0.00 0.00 27.48 27.94 1yaa h GLN 207 CO -0.00 0.45 0.50 0.82 -0.67 0.00 0.00 178.83 179.94 1yaa h ILE 208 N 0.23 1.04 0.02 2.54 2.04 -0.93 -1.11 117.51 121.34 1yaa h ILE 208 Ca 0.08 -0.32 -0.21 0.00 1.00 0.00 0.00 64.86 65.41 1yaa h ILE 208 Cb 0.23 0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.33 1yaa h ILE 208 CO -0.00 0.17 -0.95 0.58 0.00 0.00 0.00 178.15 177.95 1yaa h VAL 209 N 0.93 1.53 0.00 1.67 2.07 -0.78 -2.66 116.25 119.02 1yaa h VAL 209 Ca 0.35 -2.82 -0.09 0.00 0.82 0.00 0.00 66.70 64.96 1yaa h VAL 209 Cb 0.15 2.60 -0.01 0.00 -1.52 0.00 0.00 31.29 32.51 1yaa h VAL 209 CO -0.17 0.82 -0.42 0.44 0.02 0.00 0.00 177.57 178.26 1yaa h ASP 210 N 0.08 0.00 -0.02 0.57 3.32 -0.67 -0.73 116.42 118.97 1yaa h ASP 210 Ca -0.05 0.00 -0.23 0.00 0.02 0.00 0.00 57.03 56.77 1yaa h ASP 210 Cb 1.62 0.00 0.01 0.00 0.22 0.00 0.00 39.33 41.18 1yaa h ASP 210 CO 0.14 0.42 -0.86 0.00 -1.72 0.00 0.00 179.24 177.22 1yaa h ALA 211 N 1.58 0.30 -0.16 3.45 0.00 -1.17 -2.50 119.26 120.75 1yaa h ALA 211 Ca -0.00 -0.64 -0.11 0.00 0.00 0.00 0.00 54.91 54.16 1yaa h ALA 211 Cb 0.83 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 1yaa h ALA 211 CO 0.06 0.70 -0.36 0.82 0.00 0.00 0.00 179.25 180.47 1yaa h ILE 212 N 0.45 1.29 0.00 0.00 2.04 -1.14 -3.04 117.51 117.11 1yaa h ILE 212 Ca -0.07 -1.44 -0.14 0.00 1.00 0.00 0.00 64.86 64.21 1yaa h ILE 212 Cb 1.49 1.57 -0.02 0.00 -0.74 0.00 0.00 36.82 39.13 1yaa h ILE 212 CO 0.17 0.44 -0.69 0.00 0.00 0.00 0.00 178.15 178.07 1yaa h ALA 213 N 1.34 0.84 0.00 1.87 0.00 -1.10 -2.14 119.26 120.07 1yaa h ALA 213 Ca 0.03 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.32 1yaa h ALA 213 Cb 0.77 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1yaa h ALA 213 CO 0.06 0.86 -0.14 0.66 0.00 0.00 0.00 179.25 180.69 1yaa h SER 214 N 0.00 0.00 -0.24 0.00 4.64 -1.34 -3.25 113.55 113.36 1yaa h SER 214 Ca -0.01 -0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 1yaa h SER 214 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1yaa h SER 214 CO 0.09 0.02 0.00 0.29 -0.87 0.00 0.00 176.83 176.36 1yaa n LYS 215 N -2.41 2.16 -3.93 4.77 4.76 -1.16 -4.99 118.16 117.35 1yaa n LYS 215 Ca 0.05 -1.76 -0.29 0.00 -2.87 0.00 0.00 58.31 53.44 1yaa n LYS 215 Cb 0.46 -1.24 0.01 0.00 -1.84 0.00 0.00 35.03 32.42 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 0.50 -3.13 -4.89 4.39 3.02 -1.11 -2.95 115.26 111.10 1yaa n ASN 216 Ca 0.10 -0.86 -0.30 0.00 -0.03 0.00 0.00 54.58 53.48 1yaa n ASN 216 Cb 0.37 -3.59 -0.04 0.00 -0.61 0.00 0.00 39.78 35.92 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 -3.47 3.46 -0.26 3.10 3.76 -0.82 -2.20 115.29 118.85 1yaa s HIS 217 Ca 0.45 0.85 -0.15 0.00 -0.15 0.00 0.00 55.06 56.06 1yaa s HIS 217 Cb -0.23 -2.28 -0.04 0.00 1.11 0.00 0.00 32.58 31.15 1yaa s HIS 217 CO 0.85 0.07 0.37 0.42 -0.85 0.00 0.00 174.74 175.60 1yaa s ILE 218 N -2.16 5.18 -0.10 0.60 1.01 0.30 -4.75 121.20 121.28 1yaa s ILE 218 Ca 0.48 0.57 -0.19 0.00 0.00 0.00 0.00 60.65 61.51 1yaa s ILE 218 Cb -0.11 -3.70 -0.04 0.00 0.01 0.00 0.00 42.46 38.63 1yaa s ILE 218 CO 0.29 0.17 0.51 0.00 0.00 0.00 0.00 174.94 175.91 1yaa s ALA 219 N 1.97 3.46 -0.23 9.38 0.00 -1.26 -0.53 121.76 134.54 1yaa s ALA 219 Ca 0.15 -0.13 0.01 0.00 0.00 0.00 0.00 51.96 51.99 1yaa s ALA 219 Cb -0.16 -2.69 0.06 0.00 0.00 0.00 0.00 23.12 20.33 1yaa s ALA 219 CO 0.10 0.01 -0.08 -1.17 0.00 0.00 0.00 175.76 174.62 1yaa s LEU 220 N 0.55 2.72 -0.50 0.00 0.20 -0.49 -1.91 118.68 119.24 1yaa s LEU 220 Ca 0.28 -1.17 -0.21 0.00 0.69 0.00 0.00 54.13 53.72 1yaa s LEU 220 Cb -0.16 -1.28 0.05 0.00 -0.43 0.00 0.00 46.19 44.37 1yaa s LEU 220 CO 0.12 -0.21 0.70 -0.36 -0.29 0.00 0.00 176.35 176.32 1yaa s PHE 221 N 1.32 2.99 -0.70 5.38 0.08 0.15 -0.82 117.98 126.39 1yaa s PHE 221 Ca -0.06 -0.33 -0.27 0.00 0.12 0.00 0.00 56.93 56.39 1yaa s PHE 221 Cb -0.19 -3.63 0.02 0.00 -0.57 0.00 0.00 43.02 38.66 1yaa s PHE 221 CO -0.06 -1.08 1.35 0.34 -0.10 0.00 0.00 175.22 175.67 1yaa s ASP 222 N 2.60 6.07 -0.57 1.36 -1.08 0.08 -1.73 116.67 123.40 1yaa s ASP 222 Ca 0.20 -0.25 -0.14 0.00 -0.52 0.00 0.00 52.55 51.84 1yaa s ASP 222 Cb -0.17 -2.55 0.14 0.00 -1.46 0.00 0.00 42.92 38.88 1yaa s ASP 222 CO 0.15 -1.87 0.51 -0.89 0.52 0.00 0.00 175.17 173.59 1yaa s THR 223 N 6.10 5.02 -0.07 1.71 2.01 -0.04 -2.90 115.64 127.46 1yaa s THR 223 Ca 0.41 -1.75 0.02 0.00 0.31 0.00 0.00 61.69 60.68 1yaa s THR 223 Cb -0.09 -4.21 -0.02 0.00 0.01 0.00 0.00 72.50 68.19 1yaa s THR 223 CO 0.17 -0.87 0.07 0.00 -0.69 0.00 0.00 174.62 173.30 1yaa n ALA 224 N 4.93 2.21 -2.16 7.40 0.00 -1.26 -1.17 120.51 130.46 1yaa n ALA 224 Ca -0.08 -0.05 0.02 0.00 0.00 0.00 0.00 53.44 53.33 1yaa n ALA 224 Cb 0.41 -0.07 0.09 0.00 0.00 0.00 0.00 19.45 19.89 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 -1.13 0.40 -1.82 0.00 4.01 -1.26 -4.44 117.16 112.91 1yaa n TYR 225 Ca 0.00 -1.21 -0.43 0.00 -0.16 0.00 0.00 57.90 56.10 1yaa n TYR 225 Cb 0.03 -0.21 -0.03 0.00 -0.31 0.00 0.00 39.34 38.82 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 -1.95 3.39 0.00 -0.72 0.74 -1.26 -1.13 119.66 118.73 1yaa s GLN 226 Ca 0.36 1.82 0.00 0.00 0.05 0.00 0.00 55.36 57.59 1yaa s GLN 226 Cb 0.38 -4.24 0.00 0.00 1.10 0.00 0.00 33.01 30.24 1yaa s GLN 226 CO -0.10 -1.80 0.00 0.41 -0.55 0.00 0.00 175.29 173.25 1yaa n GLY 227 N 5.38 2.00 0.01 2.59 0.00 -1.26 -4.76 105.19 109.14 1yaa n GLY 227 Ca 0.25 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.38 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 0.00 0.04 -0.05 1.61 3.72 -0.28 -2.37 117.46 120.13 1yaa n PHE 228 Ca 0.00 0.01 -0.11 0.00 -0.05 0.00 0.00 57.45 57.30 1yaa n PHE 228 Cb 0.00 -0.16 -0.10 0.00 -0.94 0.00 0.00 39.48 38.28 1yaa n PHE 228 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1yaa h ALA 229 N 2.88 -0.02 0.00 4.37 0.00 -1.92 -3.22 119.26 121.35 1yaa h ALA 229 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1yaa h ALA 229 Cb 0.56 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1yaa h ALA 229 CO 0.00 -0.05 -0.13 0.25 0.00 0.00 0.00 179.25 179.31 1yaa n THR 230 N -4.69 0.00 -0.37 0.00 -2.24 -1.26 -4.55 114.28 101.16 1yaa n THR 230 Ca -0.08 -0.43 0.00 0.00 -2.27 0.00 0.00 64.05 61.27 1yaa n THR 230 Cb 0.35 0.93 0.00 0.00 -2.10 0.00 0.00 70.33 69.52 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 1.19 0.80 3.34 3.38 0.00 -1.00 -5.04 105.19 107.86 1yaa n GLY 231 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1yaa n GLY 231 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1yaa s ASP 232 N -2.98 3.61 0.18 1.61 2.15 -1.26 -4.62 116.67 115.36 1yaa s ASP 232 Ca 0.00 -0.39 -0.09 0.00 0.43 0.00 0.00 52.55 52.50 1yaa s ASP 232 Cb 0.00 -1.22 0.07 0.00 -0.30 0.00 0.00 42.92 41.47 1yaa s ASP 232 CO 0.00 0.22 1.63 -0.07 -0.17 0.00 0.00 175.17 176.78 1yaa h LEU 233 N 6.27 1.04 -0.36 -1.34 3.38 -1.91 -2.59 115.31 119.81 1yaa h LEU 233 Ca -0.30 -0.31 -0.19 0.00 0.09 0.00 0.00 57.88 57.16 1yaa h LEU 233 Cb 1.20 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.66 1yaa h LEU 233 CO 0.51 1.11 -0.75 0.44 0.09 0.00 0.00 178.44 179.84 1yaa h ASP 234 N 0.96 0.54 -0.18 -0.43 3.32 -1.96 -3.04 116.42 115.63 1yaa h ASP 234 Ca 0.16 -0.36 -0.14 0.00 0.02 0.00 0.00 57.03 56.71 1yaa h ASP 234 Cb 0.60 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.98 1yaa h ASP 234 CO 0.04 1.11 -0.39 0.11 -1.72 0.00 0.00 179.24 178.39 1yaa h LYS 235 N 0.30 0.71 0.00 3.56 1.57 -1.99 -2.83 116.57 117.89 1yaa h LYS 235 Ca -0.04 -0.36 0.00 0.00 -1.87 0.00 0.00 60.65 58.38 1yaa h LYS 235 Cb 1.34 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.66 1yaa h LYS 235 CO 0.13 0.97 0.00 -0.25 -0.57 0.00 0.00 179.45 179.74 1yaa n ASP 236 N -4.04 0.00 -0.38 0.86 8.00 -0.98 -2.74 116.55 117.28 1yaa n ASP 236 Ca -0.02 -1.09 0.05 0.00 0.71 0.00 0.00 54.79 54.44 1yaa n ASP 236 Cb 0.52 0.00 0.12 0.00 -0.02 0.00 0.00 41.12 41.75 1yaa n ASP 236 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1yaa n ALA 237 N -0.91 2.30 -0.18 2.24 0.00 -1.07 -4.64 120.51 118.25 1yaa n ALA 237 Ca 0.19 -1.63 -0.08 0.00 0.00 0.00 0.00 53.44 51.91 1yaa n ALA 237 Cb 0.09 -0.35 0.02 0.00 0.00 0.00 0.00 19.45 19.21 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 0.95 0.77 -0.49 0.00 3.20 -1.55 -1.92 116.97 117.93 1yaa h TYR 238 Ca 0.00 -0.04 -0.02 0.00 3.14 0.00 0.00 58.73 61.81 1yaa h TYR 238 Cb 0.86 -0.24 -0.02 0.00 1.54 0.00 0.00 36.73 38.87 1yaa h TYR 238 CO 0.17 0.61 0.24 0.00 -1.64 0.00 0.00 178.16 177.54 1yaa h ALA 239 N 1.08 0.63 -0.21 1.82 0.00 -1.84 -1.00 119.26 119.74 1yaa h ALA 239 Ca 0.18 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1yaa h ALA 239 Cb 0.14 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1yaa h ALA 239 CO -0.02 0.18 0.00 0.28 0.00 0.00 0.00 179.25 179.69 1yaa h VAL 240 N 0.64 1.25 -0.26 0.00 2.07 -1.85 -2.29 116.25 115.82 1yaa h VAL 240 Ca 0.17 -0.87 -0.08 0.00 0.82 0.00 0.00 66.70 66.73 1yaa h VAL 240 Cb 0.10 1.41 -0.01 0.00 -1.52 0.00 0.00 31.29 31.27 1yaa h VAL 240 CO -0.02 0.27 -0.19 0.03 0.02 0.00 0.00 177.57 177.67 1yaa h ARG 241 N 0.14 0.46 -0.57 1.57 3.08 -1.31 -1.18 114.38 116.57 1yaa h ARG 241 Ca 0.06 -0.15 -0.06 0.00 0.07 0.00 0.00 59.98 59.89 1yaa h ARG 241 Cb 0.40 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.38 1yaa h ARG 241 CO 0.01 0.64 0.10 1.25 -1.07 0.00 0.00 179.97 180.90 1yaa h LEU 242 N 0.42 0.90 -0.78 3.04 7.12 -1.09 -2.64 115.31 122.28 1yaa h LEU 242 Ca 0.07 -0.25 -0.13 0.00 0.13 0.00 0.00 57.88 57.70 1yaa h LEU 242 Cb 0.58 -0.24 -0.01 0.00 -0.53 0.00 0.00 40.66 40.46 1yaa h LEU 242 CO 0.04 0.92 -0.54 1.23 -0.13 0.00 0.00 178.44 179.97 1yaa h GLY 242 N 0.84 0.22 2.00 3.75 0.00 -1.03 -2.91 103.07 105.93 1yaa h GLY 242 Ca 0.18 -0.25 -0.05 0.00 0.00 0.00 0.00 47.33 47.21 1yaa h GLY 242 CO 0.01 0.23 -0.22 -2.08 0.00 0.00 0.00 176.54 174.47 1yaa h VAL 242 N 0.16 0.81 0.11 4.60 2.07 -0.87 -0.45 116.25 122.68 1yaa h VAL 242 Ca 0.00 -0.88 -0.33 0.00 0.82 0.00 0.00 66.70 66.31 1yaa h VAL 242 Cb 1.00 1.53 -0.01 0.00 -1.52 0.00 0.00 31.29 32.28 1yaa h VAL 242 CO 0.08 0.22 -1.76 -0.33 0.02 0.00 0.00 177.57 175.80 1yaa h GLU 242 N 0.00 0.24 0.00 1.57 5.08 -1.43 -3.33 114.58 116.71 1yaa h GLU 242 Ca -0.00 -0.41 -0.23 0.00 -1.00 0.00 0.00 59.36 57.71 1yaa h GLU 242 Cb 0.51 0.15 -0.04 0.00 0.50 0.00 0.00 28.75 29.88 1yaa h GLU 242 CO 0.03 1.08 -1.32 0.87 -1.00 0.00 0.00 179.01 178.68 1yaa h LYS 243 N 0.07 0.00 -0.46 2.33 1.57 -1.45 -3.33 116.57 115.30 1yaa h LYS 243 Ca -0.33 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.45 1yaa h LYS 243 Cb 2.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.35 1yaa h LYS 243 CO 0.13 0.66 0.00 1.28 -0.57 0.00 0.00 179.45 180.94 1yaa n LEU 244 N -3.15 2.92 0.01 2.94 7.99 -0.19 -4.43 117.00 123.09 1yaa n LEU 244 Ca -0.08 -1.38 0.06 0.00 -0.01 0.00 0.00 56.01 54.60 1yaa n LEU 244 Cb 0.96 -0.30 0.45 0.00 -0.11 0.00 0.00 43.42 44.42 1yaa n LEU 244 CO 0.45 0.69 1.16 -1.28 -1.51 0.00 0.00 177.39 176.90 1yaa h SER 245 N 3.43 0.42 -0.14 -1.43 0.87 -1.67 -0.27 113.55 114.76 1yaa h SER 245 Ca 0.00 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 1yaa h SER 245 Cb 0.77 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 62.63 1yaa h SER 245 CO 0.00 0.30 0.00 1.07 -0.53 0.00 0.00 176.83 177.67 1yaa n THR 246 N -4.48 0.86 -0.04 2.23 5.66 -1.26 -1.33 114.28 115.92 1yaa n THR 246 Ca 0.04 -0.93 -0.06 0.00 -3.05 0.00 0.00 64.05 60.04 1yaa n THR 246 Cb 0.11 0.58 -0.02 0.00 -1.55 0.00 0.00 70.33 69.45 1yaa n THR 246 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 175.07 172.54 1yaa n VAL 247 N 0.03 1.39 -3.75 1.08 0.31 -0.82 -4.99 118.33 111.57 1yaa n VAL 247 Ca 0.05 0.22 -0.09 0.00 -0.01 0.00 0.00 64.34 64.51 1yaa n VAL 247 Cb 0.31 -2.06 -0.03 0.00 -0.91 0.00 0.00 33.84 31.14 1yaa n VAL 247 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1yaa s SER 248 N -5.97 -0.27 0.21 4.52 1.04 -0.17 -4.96 113.70 108.09 1yaa s SER 248 Ca -0.19 -0.50 -0.30 0.00 0.48 0.00 0.00 55.95 55.44 1yaa s SER 248 Cb 0.03 0.61 -0.09 0.00 0.10 0.00 0.00 66.02 66.67 1yaa s SER 248 CO 0.28 -1.11 1.29 -2.84 0.98 0.00 0.00 173.24 171.84 1yaa s PRO 249 N -3.88 4.41 -0.18 4.02 0.02 -1.26 -4.48 135.00 133.65 1yaa s PRO 249 Ca 0.10 2.04 -0.11 0.00 0.02 0.00 0.00 61.00 63.05 1yaa s PRO 249 Cb -0.02 -3.19 -0.05 0.00 0.02 0.00 0.00 34.50 31.27 1yaa s PRO 249 CO -0.01 -0.20 0.18 0.08 -0.33 0.00 0.00 177.00 176.72 1yaa s VAL 250 N -0.10 5.38 -0.16 3.83 1.01 -0.74 -4.25 120.40 125.37 1yaa s VAL 250 Ca 0.55 0.31 -0.03 0.00 0.00 0.00 0.00 61.98 62.80 1yaa s VAL 250 Cb -0.36 -3.51 -0.02 0.00 0.00 0.00 0.00 36.38 32.48 1yaa s VAL 250 CO 0.40 0.45 -0.04 -0.36 0.00 0.00 0.00 175.10 175.54 1yaa s PHE 251 N 0.22 2.99 -0.15 5.22 0.40 -0.80 -0.85 117.98 125.01 1yaa s PHE 251 Ca 0.11 -0.41 0.00 0.00 -0.60 0.00 0.00 56.93 56.03 1yaa s PHE 251 Cb -0.12 -1.97 0.03 0.00 0.51 0.00 0.00 43.02 41.47 1yaa s PHE 251 CO 0.01 -0.13 -0.11 0.08 0.70 0.00 0.00 175.22 175.77 1yaa s VAL 252 N 0.54 1.39 -0.56 -0.44 1.01 -0.51 -0.67 120.40 121.16 1yaa s VAL 252 Ca -0.03 -0.62 -0.10 0.00 0.00 0.00 0.00 61.98 61.22 1yaa s VAL 252 Cb -0.14 -1.39 0.14 0.00 0.00 0.00 0.00 36.38 34.99 1yaa s VAL 252 CO 0.03 0.33 0.45 0.00 0.00 0.00 0.00 175.10 175.91 1yaa s GLN 254 N 1.01 4.22 -0.01 0.00 0.74 -0.24 -0.86 119.66 124.52 1yaa s GLN 254 Ca 0.09 0.36 0.07 0.00 0.05 0.00 0.00 55.36 55.93 1yaa s GLN 254 Cb -0.23 -3.38 -0.02 0.00 1.10 0.00 0.00 33.01 30.48 1yaa s GLN 254 CO -0.02 0.30 -0.22 0.45 -0.55 0.00 0.00 175.29 175.25 1yaa s SER 255 N 0.18 2.62 -0.05 6.67 0.15 -0.31 -1.02 113.70 121.94 1yaa s SER 255 Ca 0.23 -0.43 0.12 0.00 0.70 0.00 0.00 55.95 56.58 1yaa s SER 255 Cb -0.15 -0.28 0.36 0.00 -1.71 0.00 0.00 66.02 64.25 1yaa s SER 255 CO 0.09 0.26 1.30 0.49 1.20 0.00 0.00 173.24 176.58 1yaa n PHE 256 N 2.40 0.59 -0.28 3.44 3.72 -0.54 -4.67 117.46 122.12 1yaa n PHE 256 Ca -0.16 -0.60 0.02 0.00 -0.05 0.00 0.00 57.45 56.67 1yaa n PHE 256 Cb 0.52 -0.10 0.23 0.00 -0.94 0.00 0.00 39.48 39.19 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 1.96 1.48 0.00 4.37 0.00 -1.88 -2.89 119.26 122.30 1yaa h ALA 257 Ca 0.00 -0.04 -0.20 0.00 0.00 0.00 0.00 54.91 54.67 1yaa h ALA 257 Cb 0.92 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.38 1yaa h ALA 257 CO 0.06 0.43 -1.65 1.63 0.00 0.00 0.00 179.25 179.72 1yaa n LYS 258 N -4.45 0.53 -0.02 0.00 4.01 -1.26 -1.97 118.16 115.00 1yaa n LYS 258 Ca 0.12 0.22 0.03 0.00 -0.51 0.00 0.00 58.31 58.17 1yaa n LYS 258 Cb 0.12 -1.42 0.38 0.00 -0.51 0.00 0.00 35.03 33.61 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 -0.96 0.51 -0.02 4.39 7.08 -1.80 -2.21 115.58 122.57 1yaa h ASN 259 Ca -0.31 -0.03 0.00 0.00 -3.08 0.00 0.00 56.30 52.88 1yaa h ASN 259 Cb 1.25 -0.13 0.00 0.00 -2.08 0.00 0.00 38.32 37.36 1yaa h ASN 259 CO -0.19 0.41 -0.22 0.00 -2.08 0.00 0.00 177.43 175.35 1yaa n ALA 260 N -2.47 2.95 -1.52 4.14 0.00 -1.12 -4.84 120.51 117.64 1yaa n ALA 260 Ca 0.03 -0.62 -0.16 0.00 0.00 0.00 0.00 53.44 52.69 1yaa n ALA 260 Cb 0.09 -0.68 -0.06 0.00 0.00 0.00 0.00 19.45 18.80 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 1.22 1.42 0.26 0.00 0.00 -0.83 -4.79 105.19 102.46 1yaa n GLY 261 Ca 0.10 -0.28 0.15 0.00 0.00 0.00 0.00 46.02 45.99 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 0.00 0.00 0.00 1.61 2.86 -1.32 -3.46 114.93 114.62 1yaa h MET 262 Ca -0.32 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.32 1yaa h MET 262 Cb 1.03 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.69 1yaa h MET 262 CO 0.46 0.05 0.00 0.66 1.06 0.00 0.00 176.91 179.15 1yaa n TYR 263 N -3.17 0.00 0.53 -0.22 4.01 -0.83 -0.59 117.16 116.89 1yaa n TYR 263 Ca 0.01 0.00 0.06 0.00 -0.16 0.00 0.00 57.90 57.81 1yaa n TYR 263 Cb 0.34 0.00 0.29 0.00 -0.31 0.00 0.00 39.34 39.67 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 -0.79 0.05 2.72 0.00 -1.26 -2.79 105.19 103.12 1yaa n GLY 264 Ca 0.00 -0.05 0.13 0.00 0.00 0.00 0.00 46.02 46.10 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 -1.37 0.12 -3.42 1.61 -0.58 0.25 -4.97 120.64 112.28 1yaa n GLU 265 Ca 0.05 0.11 -0.18 0.00 -0.42 0.00 0.00 57.16 56.71 1yaa n GLU 265 Cb 0.12 -1.64 0.07 0.00 -0.57 0.00 0.00 31.44 29.41 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 -1.86 -3.89 -3.70 3.49 5.12 -1.12 -4.69 116.66 110.01 1yaa n ARG 266 Ca 0.06 0.78 -0.37 0.00 -1.93 0.00 0.00 57.85 56.39 1yaa n ARG 266 Cb 0.37 -5.55 -0.12 0.00 -1.16 0.00 0.00 32.46 26.00 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 -3.43 4.54 0.22 1.55 1.01 -1.26 -2.44 120.40 120.58 1yaa s VAL 267 Ca 0.25 -0.18 -0.23 0.00 0.00 0.00 0.00 61.98 61.82 1yaa s VAL 267 Cb -0.04 -3.18 0.04 0.00 0.00 0.00 0.00 36.38 33.20 1yaa s VAL 267 CO 0.76 0.26 0.85 -0.83 0.00 0.00 0.00 175.10 176.14 1yaa s GLY 268 N 1.64 -0.14 0.05 4.51 0.00 -1.15 -1.47 107.32 110.76 1yaa s GLY 268 Ca 0.06 -0.12 0.03 0.00 0.00 0.00 0.00 44.72 44.69 1yaa s GLY 268 CO 0.05 0.00 -0.10 0.00 0.00 0.00 0.00 173.10 173.06 1yaa s PHE 269 N -1.19 3.00 0.21 0.00 5.36 0.87 -1.08 117.98 125.16 1yaa s PHE 269 Ca -0.06 -0.60 0.11 0.00 -0.96 0.00 0.00 56.93 55.42 1yaa s PHE 269 Cb -0.09 -2.08 -0.04 0.00 -0.34 0.00 0.00 43.02 40.47 1yaa s PHE 269 CO 0.01 -0.32 -0.18 -1.01 -1.46 0.00 0.00 175.22 172.26 1yaa s HIS 269 N 1.10 2.41 -0.26 10.12 3.76 0.50 -1.02 115.29 131.90 1yaa s HIS 269 Ca 0.02 -0.31 -0.01 0.00 -0.15 0.00 0.00 55.06 54.61 1yaa s HIS 269 Cb -0.14 -1.15 0.14 0.00 1.11 0.00 0.00 32.58 32.53 1yaa s HIS 269 CO 0.01 0.55 0.37 -1.17 -0.85 0.00 0.00 174.74 173.66 1yaa s LEU 269 N -2.94 -0.63 -0.64 0.89 2.96 -0.64 -1.42 118.68 116.26 1yaa s LEU 269 Ca 0.24 -0.01 -0.22 0.00 -0.22 0.00 0.00 54.13 53.92 1yaa s LEU 269 Cb -0.07 1.05 0.07 0.00 0.50 0.00 0.00 46.19 47.73 1yaa s LEU 269 CO 0.13 -0.32 0.94 0.00 -1.32 0.00 0.00 176.35 175.77 1yaa s ALA 269 N 2.52 3.15 0.89 5.97 0.00 -0.03 -0.89 121.76 133.37 1yaa s ALA 269 Ca 0.12 -1.81 -0.10 0.00 0.00 0.00 0.00 51.96 50.17 1yaa s ALA 269 Cb -0.15 -3.81 0.13 0.00 0.00 0.00 0.00 23.12 19.29 1yaa s ALA 269 CO -0.20 -2.69 1.12 -0.51 0.00 0.00 0.00 175.76 173.48 1yaa s LEU 270 N 3.92 2.77 0.50 0.00 1.43 0.70 -1.78 118.68 126.22 1yaa s LEU 270 Ca 0.22 2.04 -0.09 0.00 -1.03 0.00 0.00 54.13 55.27 1yaa s LEU 270 Cb -0.17 -4.47 -0.05 0.00 0.03 0.00 0.00 46.19 41.53 1yaa s LEU 270 CO 0.11 -2.88 0.86 0.42 0.23 0.00 0.00 176.35 175.09 1yaa s THR 271 N -2.72 4.81 -0.52 5.49 -4.23 -1.26 -4.88 115.64 112.32 1yaa s THR 271 Ca 0.65 0.53 -0.27 0.00 -1.18 0.00 0.00 61.69 61.42 1yaa s THR 271 Cb -0.21 -3.83 -0.02 0.00 1.34 0.00 0.00 72.50 69.78 1yaa s THR 271 CO 0.58 -0.84 1.79 -0.54 -0.54 0.00 0.00 174.62 175.07 1yaa s LYS 272 N -4.61 2.91 0.08 3.99 1.02 -0.44 -4.95 119.74 117.74 1yaa s LYS 272 Ca 0.51 0.84 0.04 0.00 0.02 0.00 0.00 55.97 57.38 1yaa s LYS 272 Cb -0.10 -4.30 -0.03 0.00 -0.52 0.00 0.00 37.83 32.87 1yaa s LYS 272 CO 0.43 -2.38 -0.12 -0.65 -0.92 0.00 0.00 175.35 171.71 1yaa s GLN 273 N 6.46 0.79 0.20 1.68 -1.52 -1.26 -4.95 119.66 121.06 1yaa s GLN 273 Ca 0.69 -1.00 0.09 0.00 -1.95 0.00 0.00 55.36 53.19 1yaa s GLN 273 Cb -0.15 -0.65 0.07 0.00 -0.22 0.00 0.00 33.01 32.06 1yaa s GLN 273 CO 0.25 0.13 1.44 0.00 -0.25 0.00 0.00 175.29 176.86 1yaa h ALA 274 N 4.05 0.65 -0.29 6.09 0.00 -2.06 -3.13 119.26 124.56 1yaa h ALA 274 Ca -0.39 -0.72 0.00 0.00 0.00 0.00 0.00 54.91 53.80 1yaa h ALA 274 Cb 1.19 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1yaa h ALA 274 CO 0.45 0.99 0.00 0.94 0.00 0.00 0.00 179.25 181.63 1yaa n GLN 275 N -3.53 2.15 0.31 0.00 -0.06 -1.26 -4.27 117.38 110.72 1yaa n GLN 275 Ca -0.00 -1.23 0.21 0.00 -2.00 0.00 0.00 57.00 53.97 1yaa n GLN 275 Cb 0.78 -1.50 1.10 0.00 -4.06 0.00 0.00 30.24 26.56 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 1.79 0.00 -0.96 1.69 -0.26 -1.91 -2.24 115.58 113.68 1yaa h ASN 276 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 1yaa h ASN 276 Cb 0.74 0.00 -0.05 0.00 -1.06 0.00 0.00 38.32 37.95 1yaa h ASN 276 CO 0.09 0.00 0.61 0.50 -1.06 0.00 0.00 177.43 177.57 1yaa h LYS 277 N 0.00 1.29 0.11 0.81 3.64 -1.87 -1.48 116.57 119.06 1yaa h LYS 277 Ca 0.00 -0.10 -0.34 0.00 -1.27 0.00 0.00 60.65 58.94 1yaa h LYS 277 Cb 0.01 -0.28 -0.02 0.00 -0.41 0.00 0.00 32.23 31.53 1yaa h LYS 277 CO 0.00 0.87 -1.84 1.79 -2.27 0.00 0.00 179.45 178.01 1yaa h THR 278 N 1.32 0.79 -0.59 1.00 1.35 -1.77 -3.38 112.91 111.62 1yaa h THR 278 Ca 0.35 -2.50 0.03 0.00 -0.55 0.00 0.00 66.41 63.74 1yaa h THR 278 Cb -0.11 2.56 -0.04 0.00 -1.73 0.00 0.00 68.15 68.83 1yaa h THR 278 CO -0.07 0.80 0.35 0.40 -0.25 0.00 0.00 175.52 176.75 1yaa h ILE 279 N 0.06 1.04 0.10 6.82 2.04 -1.42 -2.00 117.51 124.15 1yaa h ILE 279 Ca -0.36 -0.23 0.00 0.00 1.00 0.00 0.00 64.86 65.27 1yaa h ILE 279 Cb 2.04 0.30 -0.02 0.00 -0.74 0.00 0.00 36.82 38.39 1yaa h ILE 279 CO 0.11 0.12 -0.30 0.50 0.00 0.00 0.00 178.15 178.59 1yaa h LYS 280 N 0.68 -0.43 0.00 2.37 1.63 -1.45 -0.52 116.57 118.85 1yaa h LYS 280 Ca 0.24 0.03 0.00 0.00 -0.85 0.00 0.00 60.65 60.07 1yaa h LYS 280 Cb 0.05 0.10 0.00 0.00 -0.60 0.00 0.00 32.23 31.78 1yaa h LYS 280 CO -0.12 -0.29 0.00 -1.00 -3.45 0.00 0.00 179.45 174.59 1yaa h PRO 281 N -0.45 0.00 0.12 1.90 0.13 -1.74 -2.11 132.00 129.85 1yaa h PRO 281 Ca -0.01 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.12 1yaa h PRO 281 Cb 0.44 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.57 1yaa h PRO 281 CO -0.14 0.00 -0.06 0.00 -0.23 0.00 0.00 178.00 177.57 1yaa h ALA 282 N 2.10 -0.16 -0.35 -0.56 0.00 -0.68 -2.51 119.26 117.09 1yaa h ALA 282 Ca 0.00 -0.23 -0.09 0.00 0.00 0.00 0.00 54.91 54.58 1yaa h ALA 282 Cb 0.37 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1yaa h ALA 282 CO 0.00 -0.33 -0.15 0.28 0.00 0.00 0.00 179.25 179.05 1yaa h VAL 283 N -0.68 1.29 -0.88 0.00 2.07 -1.02 -2.90 116.25 114.13 1yaa h VAL 283 Ca -0.02 -1.26 0.13 0.00 0.82 0.00 0.00 66.70 66.38 1yaa h VAL 283 Cb 0.52 1.36 -0.09 0.00 -1.52 0.00 0.00 31.29 31.56 1yaa h VAL 283 CO 0.03 0.41 0.49 0.74 0.02 0.00 0.00 177.57 179.26 1yaa h THR 284 N 0.50 0.80 -0.33 2.57 2.02 -1.47 0.23 112.91 117.23 1yaa h THR 284 Ca 0.08 -0.25 -0.06 0.00 0.77 0.00 0.00 66.41 66.95 1yaa h THR 284 Cb 0.68 -0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 67.08 1yaa h THR 284 CO 0.05 0.13 -0.04 0.77 0.37 0.00 0.00 175.52 176.80 1yaa h SER 285 N 0.74 0.51 -0.49 4.18 4.64 -1.26 -0.96 113.55 120.90 1yaa h SER 285 Ca 0.46 -0.11 -0.07 0.00 -0.47 0.00 0.00 61.79 61.60 1yaa h SER 285 Cb 0.58 -0.13 -0.02 0.00 -0.31 0.00 0.00 62.40 62.52 1yaa h SER 285 CO -0.32 0.60 0.02 1.56 -0.87 0.00 0.00 176.83 177.82 1yaa h GLN 286 N 0.51 0.86 -0.16 4.77 1.08 -0.80 -2.51 115.11 118.85 1yaa h GLN 286 Ca 0.10 -0.26 -0.01 0.00 -1.45 0.00 0.00 58.65 57.03 1yaa h GLN 286 Cb 0.39 -0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 27.73 1yaa h GLN 286 CO 0.02 0.89 0.05 -0.07 -0.95 0.00 0.00 178.83 178.76 1yaa h LEU 287 N 0.72 0.23 -1.35 1.46 3.38 -0.74 -2.52 115.31 116.49 1yaa h LEU 287 Ca 0.14 -0.20 0.12 0.00 0.09 0.00 0.00 57.88 58.03 1yaa h LEU 287 Cb 0.49 -0.06 -0.06 0.00 0.09 0.00 0.00 40.66 41.12 1yaa h LEU 287 CO 0.02 0.37 0.54 0.00 0.09 0.00 0.00 178.44 179.46 1yaa h ALA 288 N 0.87 1.83 -0.25 1.53 0.00 -1.14 -1.73 119.26 120.38 1yaa h ALA 288 Ca 0.05 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 1yaa h ALA 288 Cb 0.22 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1yaa h ALA 288 CO -0.00 -0.03 -0.05 -0.22 0.00 0.00 0.00 179.25 178.94 1yaa h LYS 289 N 0.68 0.47 -0.46 0.00 1.63 -1.17 -0.76 116.57 116.96 1yaa h LYS 289 Ca 0.40 -0.18 0.01 0.00 -0.85 0.00 0.00 60.65 60.03 1yaa h LYS 289 Cb 0.60 -0.03 -0.03 0.00 -0.60 0.00 0.00 32.23 32.18 1yaa h LYS 289 CO -0.16 0.69 0.29 0.82 -3.45 0.00 0.00 179.45 177.64 1yaa h ILE 290 N 0.21 1.09 -0.44 2.00 2.04 -0.94 -0.37 117.51 121.10 1yaa h ILE 290 Ca 0.06 -0.20 -0.04 0.00 1.00 0.00 0.00 64.86 65.68 1yaa h ILE 290 Cb 0.51 0.45 -0.02 0.00 -0.74 0.00 0.00 36.82 37.02 1yaa h ILE 290 CO 0.02 0.11 0.13 0.40 0.00 0.00 0.00 178.15 178.81 1yaa h ILE 291 N 0.59 1.22 -0.67 -0.67 2.04 -1.29 -2.58 117.51 116.15 1yaa h ILE 291 Ca 0.17 -0.75 -0.08 0.00 1.00 0.00 0.00 64.86 65.21 1yaa h ILE 291 Cb -0.04 0.88 -0.03 0.00 -0.74 0.00 0.00 36.82 36.90 1yaa h ILE 291 CO -0.05 0.27 0.12 -0.09 0.00 0.00 0.00 178.15 178.40 1yaa h ARG 292 N 0.57 1.10 0.00 2.37 9.65 -0.86 0.32 114.38 127.53 1yaa h ARG 292 Ca 0.14 -0.28 -0.04 0.00 -1.10 0.00 0.00 59.98 58.70 1yaa h ARG 292 Cb 0.28 -0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 28.72 1yaa h ARG 292 CO -0.00 1.00 -0.17 0.77 2.80 0.00 0.00 179.97 184.36 1yaa h SER 293 N 1.03 0.00 0.00 -3.80 0.02 -0.94 -3.06 113.55 106.80 1yaa h SER 293 Ca 0.21 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 61.02 1yaa h SER 293 Cb 0.42 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.93 1yaa h SER 293 CO 0.01 0.17 -1.52 -0.62 -1.14 0.00 0.00 176.83 173.73 1yaa n GLU 294 N -3.36 0.71 0.00 3.45 1.02 -0.99 -4.88 120.64 116.60 1yaa n GLU 294 Ca 0.00 0.04 0.00 0.00 -0.02 0.00 0.00 57.16 57.18 1yaa n GLU 294 Cb 0.39 -1.18 0.00 0.00 -0.02 0.00 0.00 31.44 30.62 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 -2.68 0.00 0.00 2.62 0.31 -0.03 -5.04 118.33 113.51 1yaa n VAL 295 Ca -0.15 -0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.14 1yaa n VAL 295 Cb 0.69 0.47 0.00 0.00 -0.91 0.00 0.00 33.84 34.08 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 -3.54 4.52 2.88 0.92 -4.75 113.62 112.45 1yaa n SER 296 Ca 0.00 0.00 -0.16 0.00 -1.33 0.00 0.00 58.87 57.38 1yaa n SER 296 Cb 0.00 0.00 -0.06 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 -0.58 0.54 -3.46 2.20 -1.26 -4.32 114.94 108.06 1yaa s ASN 297 Ca 0.00 0.66 -0.16 0.00 -0.94 0.00 0.00 52.86 52.42 1yaa s ASN 297 Cb 0.00 0.51 -0.07 0.00 -2.00 0.00 0.00 41.25 39.70 1yaa s ASN 297 CO 0.00 -0.52 1.00 -2.16 -2.94 0.00 0.00 177.10 172.49 1yaa s PRO 298 N -1.09 3.78 0.13 3.55 0.04 -1.26 -5.01 135.00 135.13 1yaa s PRO 298 Ca -0.08 1.00 -0.33 0.00 0.04 0.00 0.00 61.00 61.63 1yaa s PRO 298 Cb -0.00 -2.11 -0.13 0.00 0.04 0.00 0.00 34.50 32.30 1yaa s PRO 298 CO 0.07 -0.42 1.69 -0.35 0.04 0.00 0.00 177.00 178.03 1yaa n PRO 299 N -1.77 2.37 -0.05 0.56 -0.04 -1.26 -4.72 135.00 130.09 1yaa n PRO 299 Ca 0.07 0.86 -0.12 0.00 -0.04 0.00 0.00 63.50 64.27 1yaa n PRO 299 Cb 0.54 -2.67 -0.11 0.00 -0.04 0.00 0.00 33.50 31.22 1yaa n PRO 299 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1yaa h ALA 300 N 6.92 -0.02 -0.50 0.55 0.00 -1.94 -3.34 119.26 120.94 1yaa h ALA 300 Ca -0.45 -0.39 0.10 0.00 0.00 0.00 0.00 54.91 54.17 1yaa h ALA 300 Cb 1.24 0.01 -0.10 0.00 0.00 0.00 0.00 17.79 18.94 1yaa h ALA 300 CO 0.92 -0.05 -0.24 -0.92 0.00 0.00 0.00 179.25 178.96 1yaa h TYR 301 N -0.93 -0.61 -0.54 0.00 3.20 -1.94 -0.12 116.97 116.03 1yaa h TYR 301 Ca -0.00 0.06 -0.04 0.00 3.14 0.00 0.00 58.73 61.88 1yaa h TYR 301 Cb 0.78 0.34 -0.03 0.00 1.54 0.00 0.00 36.73 39.37 1yaa h TYR 301 CO 0.21 -0.32 0.16 0.78 -1.64 0.00 0.00 178.16 177.35 1yaa h GLY 302 N -0.12 0.88 1.83 1.82 0.00 -1.84 -2.42 103.07 103.21 1yaa h GLY 302 Ca 0.23 -0.48 -0.11 0.00 0.00 0.00 0.00 47.33 46.97 1yaa h GLY 302 CO -0.58 0.45 -0.43 0.00 0.00 0.00 0.00 176.54 175.99 1yaa h ALA 303 N 1.38 1.13 0.00 3.60 0.00 -1.44 -2.84 119.26 121.08 1yaa h ALA 303 Ca 0.18 -0.42 -0.13 0.00 0.00 0.00 0.00 54.91 54.54 1yaa h ALA 303 Cb 0.25 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1yaa h ALA 303 CO -0.01 0.59 -0.62 0.87 0.00 0.00 0.00 179.25 180.09 1yaa h LYS 304 N 0.16 0.00 -0.07 0.00 1.57 -0.62 -2.41 116.57 115.19 1yaa h LYS 304 Ca 0.01 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.75 1yaa h LYS 304 Cb 0.83 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.14 1yaa h LYS 304 CO 0.06 0.62 -0.11 0.82 -0.57 0.00 0.00 179.45 180.28 1yaa h ILE 305 N 0.00 1.40 -0.19 1.86 2.04 -1.26 -3.00 117.51 118.36 1yaa h ILE 305 Ca -0.01 -1.35 -0.12 0.00 1.00 0.00 0.00 64.86 64.38 1yaa h ILE 305 Cb 1.12 2.13 -0.01 0.00 -0.74 0.00 0.00 36.82 39.32 1yaa h ILE 305 CO 0.08 0.38 -0.39 0.58 0.00 0.00 0.00 178.15 178.80 1yaa h VAL 306 N -0.27 1.30 -0.14 1.67 2.07 -1.54 -2.37 116.25 116.98 1yaa h VAL 306 Ca 0.01 -1.52 -0.01 0.00 0.82 0.00 0.00 66.70 66.00 1yaa h VAL 306 Cb 0.66 1.59 -0.01 0.00 -1.52 0.00 0.00 31.29 32.01 1yaa h VAL 306 CO 0.02 0.47 0.06 0.00 0.02 0.00 0.00 177.57 178.15 1yaa h ALA 307 N 1.23 0.19 -0.06 1.67 0.00 -1.50 -0.09 119.26 120.70 1yaa h ALA 307 Ca 0.03 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 1yaa h ALA 307 Cb 0.84 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 1yaa h ALA 307 CO 0.07 -0.24 -0.21 -0.22 0.00 0.00 0.00 179.25 178.65 1yaa h LYS 308 N 0.09 0.10 -0.49 0.00 3.64 -1.51 0.21 116.57 118.61 1yaa h LYS 308 Ca 0.05 -0.03 -0.13 0.00 -1.27 0.00 0.00 60.65 59.28 1yaa h LYS 308 Cb 0.15 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 1yaa h LYS 308 CO -0.00 0.32 -0.19 1.25 -2.27 0.00 0.00 179.45 178.55 1yaa h LEU 309 N 0.10 0.99 0.00 5.20 5.85 -0.86 -1.19 115.31 125.40 1yaa h LEU 309 Ca 0.02 -0.36 -0.17 0.00 0.84 0.00 0.00 57.88 58.20 1yaa h LEU 309 Cb 0.43 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.17 1yaa h LEU 309 CO 0.03 1.15 -0.89 -0.07 -0.34 0.00 0.00 178.44 178.32 1yaa h LEU 310 N 0.85 0.00 0.02 2.25 3.38 -0.49 -2.77 115.31 118.55 1yaa h LEU 310 Ca 0.12 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.04 1yaa h LEU 310 Cb 0.76 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.51 1yaa h LEU 310 CO 0.06 0.80 -0.19 -0.33 0.09 0.00 0.00 178.44 178.87 1yaa h GLU 311 N 0.00 0.09 -6.59 1.13 5.08 -0.51 -3.45 114.58 110.34 1yaa h GLU 311 Ca -0.03 -0.13 -0.56 0.00 -1.00 0.00 0.00 59.36 57.64 1yaa h GLU 311 Cb 1.64 0.04 -0.07 0.00 0.50 0.00 0.00 28.75 30.86 1yaa h GLU 311 CO 0.10 1.00 0.92 0.99 -1.00 0.00 0.00 179.01 181.02 1yaa s THR 312 N -2.55 4.25 0.57 1.13 2.01 -0.46 -4.95 115.64 115.64 1yaa s THR 312 Ca -0.17 1.33 0.30 0.00 0.31 0.00 0.00 61.69 63.45 1yaa s THR 312 Cb -0.01 -4.51 0.42 0.00 0.01 0.00 0.00 72.50 68.41 1yaa s THR 312 CO 0.72 -0.84 1.89 -0.65 -0.69 0.00 0.00 174.62 175.05 1yaa h PRO 313 N 9.07 0.00 0.00 4.92 0.11 -1.87 -0.11 132.00 144.12 1yaa h PRO 313 Ca -0.23 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 65.74 1yaa h PRO 313 Cb 1.07 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.15 1yaa h PRO 313 CO 1.10 0.00 -1.01 0.93 -0.21 0.00 0.00 178.00 178.81 1yaa h GLU 314 N 0.00 0.00 0.00 1.05 4.39 -1.93 -2.76 114.58 115.33 1yaa h GLU 314 Ca 0.31 0.00 -0.23 0.00 0.34 0.00 0.00 59.36 59.78 1yaa h GLU 314 Cb 1.42 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 30.03 1yaa h GLU 314 CO -0.00 0.42 -1.25 -0.07 -1.16 0.00 0.00 179.01 176.95 1yaa h LEU 315 N 0.00 0.00 -0.55 1.33 3.38 -1.54 -2.10 115.31 115.83 1yaa h LEU 315 Ca -0.09 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.74 1yaa h LEU 315 Cb 1.51 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.25 1yaa h LEU 315 CO 0.06 0.92 -0.42 0.74 0.09 0.00 0.00 178.44 179.83 1yaa h THR 316 N 0.00 1.29 -0.00 0.22 2.02 -0.75 -0.74 112.91 114.95 1yaa h THR 316 Ca -0.12 -1.60 -0.00 0.00 0.77 0.00 0.00 66.41 65.46 1yaa h THR 316 Cb 1.81 1.53 -0.00 0.00 -1.74 0.00 0.00 68.15 69.75 1yaa h THR 316 CO 0.10 0.51 -0.00 -0.08 0.37 0.00 0.00 175.52 176.42 1yaa h GLU 317 N 0.56 0.00 -0.38 6.66 4.57 -1.53 -2.55 114.58 121.92 1yaa h GLU 317 Ca 0.04 -0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.22 1yaa h GLU 317 Cb 0.96 -0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.53 1yaa h GLU 317 CO 0.09 0.42 0.24 0.37 -1.18 0.00 0.00 179.01 178.95 1yaa h GLN 318 N -0.41 0.50 -0.57 1.92 5.75 -1.34 -2.08 115.11 118.87 1yaa h GLN 318 Ca 0.00 -0.03 -0.08 0.00 -0.15 0.00 0.00 58.65 58.39 1yaa h GLN 318 Cb 0.42 -0.11 -0.02 0.00 1.07 0.00 0.00 27.48 28.83 1yaa h GLN 318 CO 0.00 0.34 0.03 2.35 -2.65 0.00 0.00 178.83 178.90 1yaa h TRP 319 N 0.51 1.06 -0.79 3.99 7.01 -1.04 -0.46 115.95 126.24 1yaa h TRP 319 Ca 0.14 -0.17 0.03 0.00 2.11 0.00 0.00 58.89 61.00 1yaa h TRP 319 Cb -0.05 -0.28 -0.05 0.00 -2.10 0.00 0.00 29.16 26.69 1yaa h TRP 319 CO 0.00 0.95 0.50 0.45 -2.79 0.00 0.00 178.44 177.55 1yaa h HIS 320 N 0.87 0.95 -0.31 2.65 3.86 -0.96 -1.54 115.15 120.66 1yaa h HIS 320 Ca 0.16 0.02 -0.12 0.00 -1.16 0.00 0.00 60.37 59.28 1yaa h HIS 320 Cb 0.50 -0.31 -0.01 0.00 1.06 0.00 0.00 27.41 28.65 1yaa h HIS 320 CO 0.04 0.55 -0.30 0.87 0.86 0.00 0.00 177.93 179.94 1yaa h LYS 321 N 0.99 0.66 0.00 2.45 1.57 -1.04 -2.59 116.57 118.60 1yaa h LYS 321 Ca 0.31 -0.29 -0.06 0.00 -1.87 0.00 0.00 60.65 58.75 1yaa h LYS 321 Cb 0.00 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 1yaa h LYS 321 CO -0.11 0.88 -0.27 -0.44 -0.57 0.00 0.00 179.45 178.94 1yaa h ASP 322 N 0.56 0.00 0.75 0.86 3.32 -0.44 -1.00 116.42 120.48 1yaa h ASP 322 Ca 0.07 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 56.90 1yaa h ASP 322 Cb 0.80 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.33 1yaa h ASP 322 CO 0.07 0.27 -1.00 0.24 -1.72 0.00 0.00 179.24 177.10 1yaa h MET 323 N 0.00 0.13 -0.04 3.56 2.86 -1.01 -2.25 114.93 118.18 1yaa h MET 323 Ca -0.00 -0.18 -0.15 0.00 -2.06 0.00 0.00 59.70 57.30 1yaa h MET 323 Cb 0.50 0.06 -0.01 0.00 0.06 0.00 0.00 31.60 32.20 1yaa h MET 323 CO 0.03 1.02 -0.67 0.28 1.06 0.00 0.00 176.91 178.64 1yaa h VAL 324 N 0.05 1.42 -0.27 -2.22 2.07 -1.12 -0.66 116.25 115.53 1yaa h VAL 324 Ca -0.05 -2.15 -0.01 0.00 0.82 0.00 0.00 66.70 65.31 1yaa h VAL 324 Cb 1.70 2.12 -0.01 0.00 -1.52 0.00 0.00 31.29 33.58 1yaa h VAL 324 CO 0.15 0.63 0.12 0.74 0.02 0.00 0.00 177.57 179.22 1yaa h THR 325 N 0.14 1.16 0.12 2.57 2.02 -1.12 -0.55 112.91 117.26 1yaa h THR 325 Ca -0.01 -0.48 -0.01 0.00 0.77 0.00 0.00 66.41 66.68 1yaa h THR 325 Cb 1.19 0.99 0.00 0.00 -1.74 0.00 0.00 68.15 68.59 1yaa h THR 325 CO 0.10 0.17 -0.06 0.24 0.37 0.00 0.00 175.52 176.34 1yaa h MET 326 N 0.29 -0.16 0.00 6.66 2.86 -1.30 -2.78 114.93 120.49 1yaa h MET 326 Ca 0.09 0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 57.74 1yaa h MET 326 Cb 0.15 0.04 -0.00 0.00 0.06 0.00 0.00 31.60 31.85 1yaa h MET 326 CO -0.01 0.28 -0.01 0.66 1.06 0.00 0.00 176.91 178.89 1yaa h SER 327 N -0.68 0.00 0.44 1.22 4.64 -1.13 -2.43 113.55 115.61 1yaa h SER 327 Ca -0.02 0.00 -0.31 0.00 -0.47 0.00 0.00 61.79 61.00 1yaa h SER 327 Cb 0.51 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.59 1yaa h SER 327 CO 0.03 0.01 -1.58 0.77 -0.87 0.00 0.00 176.83 175.19 1yaa h SER 328 N 0.00 0.34 0.23 4.97 4.64 -1.10 -3.12 113.55 119.50 1yaa h SER 328 Ca -0.00 -0.50 -0.11 0.00 -0.47 0.00 0.00 61.79 60.70 1yaa h SER 328 Cb 0.15 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 62.12 1yaa h SER 328 CO 0.00 1.42 -0.44 -0.09 -0.87 0.00 0.00 176.83 176.86 1yaa h ARG 329 N 0.06 0.26 -0.34 4.77 2.43 -1.16 -1.80 114.38 118.61 1yaa h ARG 329 Ca -0.26 -0.13 -0.11 0.00 -0.81 0.00 0.00 59.98 58.67 1yaa h ARG 329 Cb 2.01 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 31.55 1yaa h ARG 329 CO 0.14 0.66 -0.26 0.82 -1.51 0.00 0.00 179.97 179.82 1yaa h ILE 330 N 0.22 1.27 -0.36 1.20 2.04 -1.56 -2.55 117.51 117.77 1yaa h ILE 330 Ca 0.02 -1.36 -0.13 0.00 1.00 0.00 0.00 64.86 64.39 1yaa h ILE 330 Cb 0.86 1.29 -0.01 0.00 -0.74 0.00 0.00 36.82 38.22 1yaa h ILE 330 CO 0.07 0.45 -0.27 0.74 0.00 0.00 0.00 178.15 179.14 1yaa h THR 331 N 0.59 1.28 -0.52 -0.27 2.02 -1.43 -2.00 112.91 112.59 1yaa h THR 331 Ca 0.08 -1.42 -0.02 0.00 0.77 0.00 0.00 66.41 65.82 1yaa h THR 331 Cb 0.75 1.40 -0.03 0.00 -1.74 0.00 0.00 68.15 68.53 1yaa h THR 331 CO 0.06 0.47 0.24 0.50 0.37 0.00 0.00 175.52 177.16 1yaa h LYS 332 N 0.61 0.72 0.00 6.66 3.64 -1.22 -2.23 116.57 124.76 1yaa h LYS 332 Ca 0.07 -0.09 -0.12 0.00 -1.27 0.00 0.00 60.65 59.25 1yaa h LYS 332 Cb 0.84 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.50 1yaa h LYS 332 CO 0.07 0.57 -0.55 0.52 -2.27 0.00 0.00 179.45 177.79 1yaa h MET 333 N 0.73 0.00 -0.54 1.90 2.86 -1.32 -0.71 114.93 117.85 1yaa h MET 333 Ca 0.18 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.73 1yaa h MET 333 Cb 0.09 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.73 1yaa h MET 333 CO -0.02 0.55 -0.01 0.00 1.06 0.00 0.00 176.91 178.49 1yaa h ARG 334 N 0.00 0.95 -0.09 1.72 3.08 -0.79 -0.97 114.38 118.28 1yaa h ARG 334 Ca -0.01 -0.31 -0.06 0.00 0.07 0.00 0.00 59.98 59.68 1yaa h ARG 334 Cb 1.33 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 31.30 1yaa h ARG 334 CO 0.07 0.97 -0.16 0.45 -1.07 0.00 0.00 179.97 180.23 1yaa h HIS 335 N 0.83 0.34 -0.86 3.04 3.86 -1.38 -2.46 115.15 118.51 1yaa h HIS 335 Ca 0.15 -0.12 0.05 0.00 -1.16 0.00 0.00 60.37 59.29 1yaa h HIS 335 Cb 0.55 -0.06 -0.05 0.00 1.06 0.00 0.00 27.41 28.90 1yaa h HIS 335 CO 0.04 0.76 0.57 0.00 0.86 0.00 0.00 177.93 180.15 1yaa h ALA 336 N 0.52 1.50 -0.06 2.45 0.00 -1.03 -0.22 119.26 122.40 1yaa h ALA 336 Ca 0.01 -0.03 -0.23 0.00 0.00 0.00 0.00 54.91 54.65 1yaa h ALA 336 Cb 0.73 -0.28 0.01 0.00 0.00 0.00 0.00 17.79 18.25 1yaa h ALA 336 CO 0.04 0.40 -0.88 1.25 0.00 0.00 0.00 179.25 180.06 1yaa h LEU 337 N 1.03 0.77 -0.22 0.00 5.85 -1.22 -2.64 115.31 118.89 1yaa h LEU 337 Ca 0.35 -0.56 -0.06 0.00 0.84 0.00 0.00 57.88 58.46 1yaa h LEU 337 Cb 0.10 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.89 1yaa h LEU 337 CO -0.12 1.35 -0.09 -0.09 -0.34 0.00 0.00 178.44 179.15 1yaa h ARG 338 N 0.39 0.44 -0.23 1.25 1.12 -0.98 -2.82 114.38 113.55 1yaa h ARG 338 Ca -0.08 -0.19 -0.07 0.00 -1.11 0.00 0.00 59.98 58.54 1yaa h ARG 338 Cb 1.51 -0.02 -0.01 0.00 -0.01 0.00 0.00 29.97 31.44 1yaa h ARG 338 CO 0.17 0.71 -0.15 -0.44 -3.11 0.00 0.00 179.97 177.15 1yaa h ASP 339 N 0.15 0.37 -0.48 -3.80 3.32 -1.13 -1.04 116.42 113.81 1yaa h ASP 339 Ca 0.05 -0.09 -0.13 0.00 0.02 0.00 0.00 57.03 56.88 1yaa h ASP 339 Cb 0.57 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 40.01 1yaa h ASP 339 CO 0.03 0.55 -0.21 0.45 -1.72 0.00 0.00 179.24 178.34 1yaa h HIS 340 N 0.36 1.15 -0.30 4.55 3.86 -1.46 -0.48 115.15 122.83 1yaa h HIS 340 Ca 0.07 -0.27 -0.13 0.00 -1.16 0.00 0.00 60.37 58.87 1yaa h HIS 340 Cb 0.48 -0.27 -0.01 0.00 1.06 0.00 0.00 27.41 28.67 1yaa h HIS 340 CO 0.01 1.10 -0.36 -0.07 0.86 0.00 0.00 177.93 179.48 1yaa h LEU 341 N 0.87 0.71 -0.72 2.43 3.38 -1.23 0.10 115.31 120.86 1yaa h LEU 341 Ca 0.11 -0.31 -0.11 0.00 0.09 0.00 0.00 57.88 57.67 1yaa h LEU 341 Cb 0.79 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 1yaa h LEU 341 CO 0.07 1.01 -0.16 0.58 0.09 0.00 0.00 178.44 180.02 1yaa h VAL 342 N 0.57 1.27 -0.05 1.22 2.07 -1.04 -0.51 116.25 119.77 1yaa h VAL 342 Ca 0.06 -1.26 -0.18 0.00 0.82 0.00 0.00 66.70 66.14 1yaa h VAL 342 Cb 0.88 1.10 -0.01 0.00 -1.52 0.00 0.00 31.29 31.74 1yaa h VAL 342 CO 0.08 0.43 -0.73 0.50 0.02 0.00 0.00 177.57 177.86 1yaa h LYS 343 N 0.73 0.28 0.00 1.57 1.63 -0.86 -2.46 116.57 117.46 1yaa h LYS 343 Ca 0.11 -0.24 -0.01 0.00 -0.85 0.00 0.00 60.65 59.67 1yaa h LYS 343 Cb 0.67 0.05 -0.00 0.00 -0.60 0.00 0.00 32.23 32.35 1yaa h LYS 343 CO 0.05 0.90 -0.03 -0.07 -3.45 0.00 0.00 179.45 176.85 1yaa h LEU 344 N 0.19 0.00 0.44 5.20 3.38 -0.61 -3.47 115.31 120.43 1yaa h LEU 344 Ca -0.03 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.87 1yaa h LEU 344 Cb 1.30 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.04 1yaa h LEU 344 CO 0.12 0.03 -0.08 0.61 0.09 0.00 0.00 178.44 179.20 1yaa n GLY 345 N 0.35 0.30 3.67 0.83 0.00 -0.34 -4.98 105.19 105.02 1yaa n GLY 345 Ca 0.01 -0.77 -0.46 0.00 0.00 0.00 0.00 46.02 44.80 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 -3.82 0.09 -1.65 2.61 -1.04 -0.39 -4.90 114.28 105.17 1yaa n THR 346 Ca -0.04 -0.02 -0.42 0.00 -2.04 0.00 0.00 64.05 61.54 1yaa n THR 346 Cb 0.46 -1.59 0.01 0.00 -1.82 0.00 0.00 70.33 67.39 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 3.90 1.61 0.00 -2.82 -0.02 -1.26 -4.79 135.00 131.63 1yaa n PRO 347 Ca 0.18 0.57 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 1yaa n PRO 347 Cb 0.29 -2.16 0.00 0.00 -0.02 0.00 0.00 33.50 31.61 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 1.03 -0.27 3.77 -1.23 0.00 -1.26 -4.97 105.19 102.26 1yaa n GLY 348 Ca 0.08 -1.87 -0.36 0.00 0.00 0.00 0.00 46.02 43.87 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 -0.90 5.78 -0.06 1.61 3.84 -1.26 -5.02 114.94 118.93 1yaa s ASN 349 Ca 0.00 0.29 0.08 0.00 0.21 0.00 0.00 52.86 53.45 1yaa s ASN 349 Cb 0.00 -1.76 0.13 0.00 -0.55 0.00 0.00 41.25 39.07 1yaa s ASN 349 CO 0.00 0.39 1.01 0.79 -2.79 0.00 0.00 177.10 176.50 1yaa n TRP 350 N 2.10 0.00 0.30 0.43 7.02 -1.26 -4.77 117.44 121.25 1yaa n TRP 350 Ca -0.19 -0.59 0.17 0.00 -1.02 0.00 0.00 57.50 55.87 1yaa n TRP 350 Cb 0.54 -0.09 0.82 0.00 -2.42 0.00 0.00 31.31 30.16 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 0.28 -0.99 3.32 -1.95 -2.36 116.42 114.72 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 0.92 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.47 1yaa h ASP 351 CO 0.00 0.00 -0.07 1.12 -1.72 0.00 0.00 179.24 178.57 1yaa h HIS 352 N 0.00 0.00 -0.49 4.55 2.07 -1.98 -1.16 115.15 118.14 1yaa h HIS 352 Ca 0.00 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.50 1yaa h HIS 352 Cb 0.21 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 30.16 1yaa h HIS 352 CO 0.00 0.07 0.22 0.82 -3.07 0.00 0.00 177.93 175.97 1yaa h ILE 353 N 0.00 1.20 0.00 6.12 2.04 -1.78 -1.62 117.51 123.47 1yaa h ILE 353 Ca -0.00 -0.58 -0.13 0.00 1.00 0.00 0.00 64.86 65.15 1yaa h ILE 353 Cb 0.23 0.67 -0.02 0.00 -0.74 0.00 0.00 36.82 36.96 1yaa h ILE 353 CO 0.01 0.22 -0.79 -0.37 0.00 0.00 0.00 178.15 177.22 1yaa h VAL 354 N 0.65 0.82 0.00 1.67 -1.51 -1.60 -3.33 116.25 112.94 1yaa h VAL 354 Ca 0.17 -2.24 -0.14 0.00 -1.23 0.00 0.00 66.70 63.26 1yaa h VAL 354 Cb 0.14 2.34 -0.02 0.00 -2.13 0.00 0.00 31.29 31.62 1yaa h VAL 354 CO -0.02 0.47 -0.69 0.78 -1.23 0.00 0.00 177.57 176.88 1yaa h ASN 355 N 0.00 0.00 -4.16 4.19 2.35 -1.01 -3.45 115.58 113.50 1yaa h ASN 355 Ca -0.05 0.00 -0.48 0.00 -0.55 0.00 0.00 56.30 55.22 1yaa h ASN 355 Cb 1.47 0.00 0.03 0.00 0.05 0.00 0.00 38.32 39.87 1yaa h ASN 355 CO 0.06 0.69 0.38 -1.10 -1.65 0.00 0.00 177.43 175.81 1yaa s GLN 356 N -3.35 3.70 0.48 0.81 -0.21 -0.63 -5.01 119.66 115.45 1yaa s GLN 356 Ca -0.00 1.14 0.03 0.00 0.02 0.00 0.00 55.36 56.55 1yaa s GLN 356 Cb 0.12 -2.09 -0.03 0.00 1.00 0.00 0.00 33.01 32.00 1yaa s GLN 356 CO 0.77 -0.49 0.01 0.00 -2.12 0.00 0.00 175.29 173.46 1yaa n GLY 358 N -1.17 1.03 0.00 0.00 0.00 -1.22 -4.40 105.19 99.45 1yaa n GLY 358 Ca -0.15 -1.56 0.07 0.00 0.00 0.00 0.00 46.02 44.38 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 1.09 1.17 -3.95 1.61 0.00 -1.26 -4.91 117.12 110.86 1yaa n MET 359 Ca 0.00 -0.08 -0.25 0.00 -0.00 0.00 0.00 57.70 57.37 1yaa n MET 359 Cb 0.00 -1.25 -0.04 0.00 0.00 0.00 0.00 33.22 31.93 1yaa n MET 359 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 175.97 177.16 1yaa n PHE 360 N -1.75 0.50 -3.52 1.12 3.72 -1.26 -1.24 117.46 115.04 1yaa n PHE 360 Ca -0.01 -1.98 -0.09 0.00 -0.05 0.00 0.00 57.45 55.32 1yaa n PHE 360 Cb 0.30 -0.29 -0.09 0.00 -0.94 0.00 0.00 39.48 38.46 1yaa n PHE 360 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1yaa s SER 361 N -3.34 0.01 -1.00 4.37 0.15 -0.88 -4.65 113.70 108.36 1yaa s SER 361 Ca 0.06 0.62 -0.22 0.00 0.70 0.00 0.00 55.95 57.12 1yaa s SER 361 Cb -0.01 1.20 0.07 0.00 -1.71 0.00 0.00 66.02 65.57 1yaa s SER 361 CO 0.04 -0.26 1.36 0.12 1.20 0.00 0.00 173.24 175.70 1yaa s PHE 362 N 2.57 2.70 0.31 3.44 5.36 -1.25 -2.23 117.98 128.87 1yaa s PHE 362 Ca 0.05 -1.00 0.02 0.00 -0.96 0.00 0.00 56.93 55.04 1yaa s PHE 362 Cb -0.14 -4.58 0.57 0.00 -0.34 0.00 0.00 43.02 38.53 1yaa s PHE 362 CO -0.14 -1.81 1.92 1.79 -1.46 0.00 0.00 175.22 175.52 1yaa h THR 363 N 6.52 1.06 0.00 0.12 1.35 -1.89 -3.47 112.91 116.59 1yaa h THR 363 Ca 0.19 -0.34 0.00 0.00 -0.55 0.00 0.00 66.41 65.71 1yaa h THR 363 Cb 1.01 -0.01 0.00 0.00 -1.73 0.00 0.00 68.15 67.42 1yaa h THR 363 CO 1.34 0.18 0.00 0.61 -0.25 0.00 0.00 175.52 177.40 1yaa n GLY 364 N -1.40 0.78 3.77 5.82 0.00 -1.26 -5.04 105.19 107.86 1yaa n GLY 364 Ca 0.13 -0.37 -0.39 0.00 0.00 0.00 0.00 46.02 45.39 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 4.51 0.63 0.99 1.02 -1.26 -5.05 118.68 119.51 1yaa s LEU 365 Ca 0.00 1.43 -0.14 0.00 0.02 0.00 0.00 54.13 55.44 1yaa s LEU 365 Cb 0.00 -3.14 -0.02 0.00 0.02 0.00 0.00 46.19 43.05 1yaa s LEU 365 CO 0.00 0.14 1.07 0.42 0.02 0.00 0.00 176.35 178.00 1yaa s THR 366 N -0.62 3.74 0.51 5.49 -4.23 -1.26 -4.36 115.64 114.92 1yaa s THR 366 Ca 0.35 0.76 0.28 0.00 -1.18 0.00 0.00 61.69 61.90 1yaa s THR 366 Cb -0.21 -3.32 0.45 0.00 1.34 0.00 0.00 72.50 70.77 1yaa s THR 366 CO 0.22 -0.55 1.90 1.55 -0.54 0.00 0.00 174.62 177.20 1yaa h PRO 367 N 0.10 0.07 -0.42 3.99 0.13 -1.92 0.77 132.00 134.71 1yaa h PRO 367 Ca -0.46 -0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.59 1yaa h PRO 367 Cb 1.22 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 1yaa h PRO 367 CO 0.56 0.05 -0.04 0.37 -0.23 0.00 0.00 178.00 178.71 1yaa h GLN 368 N 0.08 0.78 -0.28 0.86 4.15 -1.91 -0.65 115.11 118.13 1yaa h GLN 368 Ca 0.41 -0.27 -0.12 0.00 0.77 0.00 0.00 58.65 59.44 1yaa h GLN 368 Cb 1.52 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 29.14 1yaa h GLN 368 CO -0.04 0.87 -0.33 0.52 -1.93 0.00 0.00 178.83 177.92 1yaa h MET 369 N 0.61 0.61 -0.48 1.69 2.86 -1.25 -2.56 114.93 116.42 1yaa h MET 369 Ca 0.12 -0.28 -0.13 0.00 -2.06 0.00 0.00 59.70 57.35 1yaa h MET 369 Cb 0.55 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.18 1yaa h MET 369 CO 0.03 0.86 -0.21 0.28 1.06 0.00 0.00 176.91 178.93 1yaa h VAL 370 N 0.52 1.27 -0.61 -2.22 2.07 -1.02 -2.25 116.25 114.01 1yaa h VAL 370 Ca 0.06 -1.37 -0.06 0.00 0.82 0.00 0.00 66.70 66.15 1yaa h VAL 370 Cb 0.82 1.12 -0.02 0.00 -1.52 0.00 0.00 31.29 31.68 1yaa h VAL 370 CO 0.07 0.47 0.14 0.50 0.02 0.00 0.00 177.57 178.77 1yaa h LYS 371 N 0.84 0.97 -0.05 1.57 3.64 -1.05 -2.84 116.57 119.65 1yaa h LYS 371 Ca 0.11 -0.24 -0.12 0.00 -1.27 0.00 0.00 60.65 59.14 1yaa h LYS 371 Cb 0.78 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.46 1yaa h LYS 371 CO 0.06 0.89 -0.50 -0.09 -2.27 0.00 0.00 179.45 177.55 1yaa h ARG 372 N 0.88 0.14 -0.85 1.90 2.43 -1.38 -1.28 114.38 116.22 1yaa h ARG 372 Ca 0.19 -0.08 -0.03 0.00 -0.81 0.00 0.00 59.98 59.25 1yaa h ARG 372 Cb 0.36 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.87 1yaa h ARG 372 CO 0.00 0.61 0.40 -0.07 -1.51 0.00 0.00 179.97 179.40 1yaa h LEU 373 N 0.11 1.12 0.18 3.80 3.38 -1.18 0.85 115.31 123.57 1yaa h LEU 373 Ca 0.00 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 1yaa h LEU 373 Cb 0.92 -0.29 0.00 0.00 0.09 0.00 0.00 40.66 41.39 1yaa h LEU 373 CO 0.07 0.94 -0.09 -0.08 0.09 0.00 0.00 178.44 179.38 1yaa h GLU 374 N 1.21 -0.23 -0.21 1.13 4.81 -1.27 0.19 114.58 120.22 1yaa h GLU 374 Ca 0.29 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.53 1yaa h GLU 374 Cb 0.13 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 1yaa h GLU 374 CO -0.04 -0.16 0.08 0.93 -0.73 0.00 0.00 179.01 179.10 1yaa h GLU 375 N -0.84 0.29 0.00 1.92 5.08 -1.30 -0.71 114.58 119.01 1yaa h GLU 375 Ca -0.02 -0.03 -0.28 0.00 -1.00 0.00 0.00 59.36 58.03 1yaa h GLU 375 Cb 0.19 -0.06 -0.05 0.00 0.50 0.00 0.00 28.75 29.32 1yaa h GLU 375 CO 0.04 0.24 -2.06 2.41 -1.00 0.00 0.00 179.01 178.64 1yaa n THR 376 N -4.45 1.06 0.39 1.13 -1.04 0.27 -4.71 114.28 106.93 1yaa n THR 376 Ca 0.00 -0.55 0.04 0.00 -2.04 0.00 0.00 64.05 61.51 1yaa n THR 376 Cb 0.12 -0.84 0.02 0.00 -1.82 0.00 0.00 70.33 67.81 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 -2.77 0.00 -1.48 -1.42 8.25 -0.53 -4.99 115.22 112.29 1yaa n HIS 377 Ca -0.29 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.01 1yaa n HIS 377 Cb 0.94 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.98 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 0.16 -0.25 -2.71 -1.41 0.00 0.45 -4.70 120.51 112.05 1yaa n ALA 378 Ca 0.05 0.27 -0.38 0.00 0.00 0.00 0.00 53.44 53.38 1yaa n ALA 378 Cb 0.21 -1.85 -0.06 0.00 0.00 0.00 0.00 19.45 17.75 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 -2.49 5.20 -0.31 0.00 1.01 0.09 -1.00 120.40 122.90 1yaa s VAL 379 Ca 0.00 0.85 -0.08 0.00 0.00 0.00 0.00 61.98 62.74 1yaa s VAL 379 Cb 0.00 -3.77 0.01 0.00 0.00 0.00 0.00 36.38 32.61 1yaa s VAL 379 CO 0.00 0.31 0.13 -0.31 0.00 0.00 0.00 175.10 175.22 1yaa s TYR 380 N 0.81 3.18 0.32 5.22 1.51 0.59 -2.31 117.35 126.66 1yaa s TYR 380 Ca 0.23 -0.86 0.05 0.00 -1.01 0.00 0.00 57.07 55.48 1yaa s TYR 380 Cb -0.15 -2.32 -0.06 0.00 -0.11 0.00 0.00 41.96 39.32 1yaa s TYR 380 CO 0.09 -0.55 0.00 -0.51 -1.11 0.00 0.00 175.55 173.47 1yaa s LEU 381 N 1.54 2.40 0.26 -1.29 1.02 -1.26 -0.62 118.68 120.73 1yaa s LEU 381 Ca 0.03 -1.30 -0.30 0.00 0.02 0.00 0.00 54.13 52.59 1yaa s LEU 381 Cb -0.18 -0.55 -0.09 0.00 0.02 0.00 0.00 46.19 45.39 1yaa s LEU 381 CO 0.04 -0.48 1.03 -0.69 0.02 0.00 0.00 176.35 176.28 1yaa s VAL 382 N -3.10 3.73 0.63 -1.59 1.01 -0.78 -4.89 120.40 115.41 1yaa s VAL 382 Ca 0.33 1.74 0.25 0.00 0.00 0.00 0.00 61.98 64.30 1yaa s VAL 382 Cb 0.07 -4.11 0.30 0.00 0.00 0.00 0.00 36.38 32.64 1yaa s VAL 382 CO 0.14 0.42 1.68 0.00 0.00 0.00 0.00 175.10 177.34 1yaa h ALA 383 N 3.95 1.98 0.00 5.51 0.00 -1.90 0.29 119.26 129.08 1yaa h ALA 383 Ca -0.46 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1yaa h ALA 383 Cb 1.21 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1yaa h ALA 383 CO 0.67 -0.78 0.00 0.66 0.00 0.00 0.00 179.25 179.80 1yaa h SER 384 N 0.00 0.00 0.00 0.00 4.64 -1.91 -3.37 113.55 112.91 1yaa h SER 384 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 1yaa h SER 384 Cb 1.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.48 1yaa h SER 384 CO -0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 1yaa n GLY 385 N 0.98 0.83 3.73 -0.77 0.00 0.10 -4.73 105.19 105.33 1yaa n GLY 385 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.43 4.34 -0.03 1.61 3.52 -1.24 -3.06 118.95 123.68 1yaa s ARG 386 Ca 0.00 2.09 0.03 0.00 -0.13 0.00 0.00 55.73 57.73 1yaa s ARG 386 Cb 0.00 -3.21 -0.00 0.00 -1.56 0.00 0.00 34.95 30.18 1yaa s ARG 386 CO 0.00 -0.36 -0.13 0.00 -0.81 0.00 0.00 175.30 174.01 1yaa s ALA 387 N 0.56 1.14 -0.47 6.12 0.00 -0.95 -1.86 121.76 126.29 1yaa s ALA 387 Ca 0.61 -0.51 -0.26 0.00 0.00 0.00 0.00 51.96 51.80 1yaa s ALA 387 Cb -0.37 -0.37 0.03 0.00 0.00 0.00 0.00 23.12 22.41 1yaa s ALA 387 CO 0.35 0.22 0.97 0.45 0.00 0.00 0.00 175.76 177.75 1yaa s SER 388 N 0.00 6.51 0.47 0.00 0.15 -0.28 -2.08 113.70 118.47 1yaa s SER 388 Ca -0.01 0.14 0.13 0.00 0.70 0.00 0.00 55.95 56.91 1yaa s SER 388 Cb -0.08 -2.47 1.09 0.00 -1.71 0.00 0.00 66.02 62.85 1yaa s SER 388 CO 0.01 -1.11 2.09 0.40 1.20 0.00 0.00 173.24 175.83 1yaa h ILE 389 N 6.11 1.02 0.00 6.45 1.08 -1.49 -2.21 117.51 128.47 1yaa h ILE 389 Ca -0.24 -0.09 0.00 0.00 -0.39 0.00 0.00 64.86 64.14 1yaa h ILE 389 Cb 1.07 0.74 0.00 0.00 -3.07 0.00 0.00 36.82 35.56 1yaa h ILE 389 CO 1.05 0.05 0.00 0.00 -0.69 0.00 0.00 178.15 178.56 1yaa h ALA 390 N 1.86 1.00 0.00 1.87 0.00 -1.87 -0.06 119.26 122.06 1yaa h ALA 390 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1yaa h ALA 390 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1yaa h ALA 390 CO -0.02 0.00 0.00 0.78 0.00 0.00 0.00 179.25 180.01 1yaa h GLY 391 N 0.65 0.00 -3.73 0.00 0.00 -1.61 -3.32 103.07 95.06 1yaa h GLY 391 Ca 0.00 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 46.82 1yaa h GLY 391 CO 0.00 0.00 0.22 1.08 0.00 0.00 0.00 176.54 177.84 1yaa s LEU 392 N -5.86 4.49 0.18 3.11 1.43 -0.04 -4.83 118.68 117.15 1yaa s LEU 392 Ca 0.04 1.67 -0.12 0.00 -1.03 0.00 0.00 54.13 54.69 1yaa s LEU 392 Cb 0.08 -3.56 0.00 0.00 0.03 0.00 0.00 46.19 42.74 1yaa s LEU 392 CO 0.57 0.10 0.36 0.54 0.23 0.00 0.00 176.35 178.15 1yaa s ASN 393 N -1.38 -0.05 0.62 2.29 4.22 -1.26 -4.96 114.94 114.42 1yaa s ASN 393 Ca 0.41 -0.76 0.30 0.00 -2.14 0.00 0.00 52.86 50.67 1yaa s ASN 393 Cb -0.21 0.48 1.60 0.00 1.28 0.00 0.00 41.25 44.40 1yaa s ASN 393 CO 0.25 -0.95 1.96 -0.61 -2.04 0.00 0.00 177.10 175.71 1yaa h GLN 394 N 2.43 0.00 -0.01 3.55 5.75 -1.95 -0.52 115.11 124.37 1yaa h GLN 394 Ca -0.31 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.19 1yaa h GLN 394 Cb 1.24 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.79 1yaa h GLN 394 CO 0.44 0.00 -0.10 0.41 -2.65 0.00 0.00 178.83 176.93 1yaa n GLY 395 N -1.36 -0.70 0.00 2.39 0.00 -1.26 -4.35 105.19 99.91 1yaa n GLY 395 Ca 0.03 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.68 0.00 -0.36 1.61 0.23 -0.31 -4.91 115.26 110.84 1yaa n ASN 396 Ca 0.16 -0.34 0.06 0.00 -0.53 0.00 0.00 54.58 53.93 1yaa n ASN 396 Cb 0.29 0.00 0.23 0.00 -2.08 0.00 0.00 39.78 38.21 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 0.34 0.98 -0.16 3.53 2.07 -1.48 -1.77 116.25 119.76 1yaa h VAL 397 Ca 0.00 -0.36 -0.19 0.00 0.82 0.00 0.00 66.70 66.97 1yaa h VAL 397 Cb 0.17 -0.15 0.00 0.00 -1.52 0.00 0.00 31.29 29.79 1yaa h VAL 397 CO 0.00 0.19 -0.67 -0.08 0.02 0.00 0.00 177.57 177.03 1yaa h GLU 398 N 1.04 0.64 -0.65 1.57 4.81 -1.87 -0.07 114.58 120.05 1yaa h GLU 398 Ca 0.47 -0.47 -0.06 0.00 -0.13 0.00 0.00 59.36 59.18 1yaa h GLU 398 Cb 0.38 0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.82 1yaa h GLU 398 CO -0.23 1.09 0.18 -0.92 -0.73 0.00 0.00 179.01 178.40 1yaa h TYR 399 N 0.46 1.04 -0.07 0.92 5.03 -1.79 0.14 116.97 122.70 1yaa h TYR 399 Ca -0.02 -0.10 -0.20 0.00 2.58 0.00 0.00 58.73 60.99 1yaa h TYR 399 Cb 1.25 -0.30 -0.00 0.00 1.55 0.00 0.00 36.73 39.23 1yaa h TYR 399 CO 0.06 0.84 -0.78 0.28 -1.32 0.00 0.00 178.16 177.24 1yaa h VAL 400 N 0.96 1.37 -0.26 1.81 2.07 -1.28 -2.12 116.25 118.81 1yaa h VAL 400 Ca 0.21 -2.19 -0.10 0.00 0.82 0.00 0.00 66.70 65.44 1yaa h VAL 400 Cb 0.31 2.16 -0.01 0.00 -1.52 0.00 0.00 31.29 32.23 1yaa h VAL 400 CO -0.00 0.66 -0.27 0.00 0.02 0.00 0.00 177.57 177.98 1yaa h ALA 401 N 0.86 1.06 0.00 1.67 0.00 -0.55 -1.52 119.26 120.78 1yaa h ALA 401 Ca -0.04 -0.36 -0.17 0.00 0.00 0.00 0.00 54.91 54.34 1yaa h ALA 401 Cb 1.37 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 19.02 1yaa h ALA 401 CO 0.14 0.57 -0.81 0.87 0.00 0.00 0.00 179.25 180.02 1yaa h LYS 402 N 0.45 0.03 -0.19 0.00 1.57 -0.94 -2.44 116.57 115.05 1yaa h LYS 402 Ca 0.06 -0.04 -0.12 0.00 -1.87 0.00 0.00 60.65 58.68 1yaa h LYS 402 Cb 0.70 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.02 1yaa h LYS 402 CO 0.05 0.82 -0.37 0.00 -0.57 0.00 0.00 179.45 179.39 1yaa h ALA 403 N 1.16 0.30 -0.66 3.86 0.00 -1.08 -2.09 119.26 120.74 1yaa h ALA 403 Ca -0.01 -0.44 -0.03 0.00 0.00 0.00 0.00 54.91 54.43 1yaa h ALA 403 Cb 1.43 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 19.14 1yaa h ALA 403 CO 0.11 0.37 0.30 0.82 0.00 0.00 0.00 179.25 180.85 1yaa h ILE 404 N 0.25 1.23 -0.12 0.00 2.04 -1.31 -1.96 117.51 117.64 1yaa h ILE 404 Ca 0.01 -0.67 0.01 0.00 1.00 0.00 0.00 64.86 65.21 1yaa h ILE 404 Cb 0.96 0.44 -0.02 0.00 -0.74 0.00 0.00 36.82 37.47 1yaa h ILE 404 CO 0.08 0.27 0.02 -0.78 0.00 0.00 0.00 178.15 177.75 1yaa h ASP 405 N 0.92 0.00 -0.39 1.72 3.58 -1.42 -1.58 116.42 119.27 1yaa h ASP 405 Ca 0.23 0.02 0.01 0.00 0.42 0.00 0.00 57.03 57.71 1yaa h ASP 405 Cb 0.15 0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.20 1yaa h ASP 405 CO -0.03 0.02 0.23 -0.08 -2.88 0.00 0.00 179.24 176.51 1yaa h GLU 406 N 0.07 0.46 0.00 0.28 4.22 -1.10 -1.98 114.58 116.53 1yaa h GLU 406 Ca 0.05 -0.03 -0.09 0.00 0.08 0.00 0.00 59.36 59.37 1yaa h GLU 406 Cb 0.05 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 1yaa h GLU 406 CO -0.07 0.30 -0.43 0.28 -2.18 0.00 0.00 179.01 176.91 1yaa h VAL 407 N 0.47 1.11 -0.18 0.32 2.07 -1.22 0.12 116.25 118.95 1yaa h VAL 407 Ca 0.15 -1.59 -0.20 0.00 0.82 0.00 0.00 66.70 65.89 1yaa h VAL 407 Cb -0.00 1.90 0.00 0.00 -1.52 0.00 0.00 31.29 31.67 1yaa h VAL 407 CO -0.07 0.42 -0.68 0.58 0.02 0.00 0.00 177.57 177.85 1yaa h VAL 408 N 0.00 1.30 0.00 2.57 2.07 -0.98 -3.10 116.25 118.11 1yaa h VAL 408 Ca -0.00 -1.92 -0.18 0.00 0.82 0.00 0.00 66.70 65.41 1yaa h VAL 408 Cb 0.87 1.89 -0.03 0.00 -1.52 0.00 0.00 31.29 32.50 1yaa h VAL 408 CO 0.06 0.60 -0.86 0.03 0.02 0.00 0.00 177.57 177.42 1yaa h ARG 409 N 0.50 0.00 -0.40 1.57 3.08 -1.15 -3.02 114.38 114.96 1yaa h ARG 409 Ca -0.02 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 59.96 1yaa h ARG 409 Cb 1.28 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.31 1yaa h ARG 409 CO 0.14 0.86 -0.03 0.35 -1.07 0.00 0.00 179.97 180.22 1yaa h PHE 410 N 0.00 0.69 -0.27 3.04 3.57 -0.75 -3.01 116.94 120.21 1yaa h PHE 410 Ca -0.01 -0.09 0.00 0.00 3.53 0.00 0.00 57.97 61.40 1yaa h PHE 410 Cb 1.56 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 40.11 1yaa h PHE 410 CO 0.00 0.67 0.00 0.66 -2.23 0.00 0.00 178.31 177.41 1yaa n TYR 411 N -4.23 0.34 0.61 0.41 4.01 -1.18 -5.09 117.16 112.03 1yaa n TYR 411 Ca 0.02 -0.18 0.05 0.00 -0.16 0.00 0.00 57.90 57.62 1yaa n TYR 411 Cb 0.29 -0.00 0.29 0.00 -0.31 0.00 0.00 39.34 39.61 1yaa n TYR 411 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40