#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y8b s ALA 2 N 0.00 -2.88 0.00 3.17 0.00 -1.26 -4.89 121.76 115.90 1y8b s ALA 2 Ca 0.00 0.91 0.00 0.00 0.00 0.00 0.00 51.96 52.87 1y8b s ALA 2 Cb 0.00 -2.69 0.00 0.00 0.00 0.00 0.00 23.12 20.43 1y8b s ALA 2 CO 0.00 -2.05 0.00 1.04 0.00 0.00 0.00 175.76 174.75 1y8b n GLN 3 N 4.93 -1.57 -3.64 0.00 6.02 -1.26 -4.74 117.38 117.13 1y8b n GLN 3 Ca 0.07 0.24 -0.02 0.00 -0.01 0.00 0.00 57.00 57.28 1y8b n GLN 3 Cb 0.56 -3.84 -0.03 0.00 1.02 0.00 0.00 30.24 27.95 1y8b n GLN 3 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1y8b s THR 4 N -0.61 0.00 0.12 5.09 -4.23 -1.26 -4.71 115.64 110.04 1y8b s THR 4 Ca 0.00 0.00 0.09 0.00 -1.18 0.00 0.00 61.69 60.60 1y8b s THR 4 Cb 0.00 -1.00 -0.04 0.00 1.34 0.00 0.00 72.50 72.80 1y8b s THR 4 CO 0.00 0.00 -0.19 -0.51 -0.54 0.00 0.00 174.62 173.38 1y8b s ILE 5 N -1.44 2.80 -0.41 2.99 2.07 -1.10 -0.37 121.20 125.73 1y8b s ILE 5 Ca 0.10 -1.55 -0.08 0.00 -1.41 0.00 0.00 60.65 57.70 1y8b s ILE 5 Cb -0.01 -2.29 0.08 0.00 0.13 0.00 0.00 42.46 40.37 1y8b s ILE 5 CO -0.06 0.08 0.23 0.42 -1.91 0.00 0.00 174.94 173.70 1y8b s THR 6 N -1.19 4.05 0.08 4.00 -4.23 -1.26 -2.54 115.64 114.56 1y8b s THR 6 Ca 0.18 -1.43 -0.27 0.00 -1.18 0.00 0.00 61.69 58.99 1y8b s THR 6 Cb -0.10 -3.48 -0.06 0.00 1.34 0.00 0.00 72.50 70.19 1y8b s THR 6 CO 0.10 -0.48 0.84 0.00 -0.54 0.00 0.00 174.62 174.54 1y8b s GLN 7 N 1.39 4.58 0.23 3.99 -2.07 0.13 -4.78 119.66 123.13 1y8b s GLN 7 Ca 0.03 1.22 0.00 0.00 -1.82 0.00 0.00 55.36 54.79 1y8b s GLN 7 Cb -0.22 -3.36 0.00 0.00 -1.09 0.00 0.00 33.01 28.34 1y8b s GLN 7 CO 0.01 0.29 0.00 0.45 -1.32 0.00 0.00 175.29 174.72 1y8b n SER 8 N 2.67 0.00 0.00 12.60 2.88 -1.26 0.02 113.62 130.53 1y8b n SER 8 Ca -0.01 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.53 1y8b n SER 8 Cb 0.50 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.96 1y8b n SER 8 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 1y8b n ARG 9 N 0.00 4.15 -3.20 -1.46 0.63 -1.26 -5.05 116.66 110.47 1y8b n ARG 9 Ca 0.00 0.00 -0.28 0.00 -0.92 0.00 0.00 57.85 56.65 1y8b n ARG 9 Cb 0.00 -0.48 -0.03 0.00 0.45 0.00 0.00 32.46 32.41 1y8b n ARG 9 CO 0.00 0.00 0.00 -1.17 -2.51 0.00 0.00 177.63 173.95 1y8b s LEU 10 N -1.58 3.98 0.25 6.15 2.96 0.10 -4.16 118.68 126.38 1y8b s LEU 10 Ca 0.00 0.76 0.07 0.00 -0.22 0.00 0.00 54.13 54.75 1y8b s LEU 10 Cb 0.00 -3.61 -0.04 0.00 0.50 0.00 0.00 46.19 43.04 1y8b s LEU 10 CO 0.00 -0.27 0.19 -0.60 -1.32 0.00 0.00 176.35 174.35 1y8b s ARG 11 N -3.80 2.91 -0.02 1.98 3.52 -1.10 -0.69 118.95 121.75 1y8b s ARG 11 Ca 0.45 -1.06 -0.29 0.00 -0.13 0.00 0.00 55.73 54.70 1y8b s ARG 11 Cb -0.10 -2.56 0.08 0.00 -1.56 0.00 0.00 34.95 30.80 1y8b s ARG 11 CO 0.32 0.40 0.70 0.96 -0.81 0.00 0.00 175.30 176.87 1y8b s ILE 12 N -2.13 0.00 -0.19 4.11 -4.36 -1.05 -4.56 121.20 113.01 1y8b s ILE 12 Ca 0.33 0.00 -0.29 0.00 -0.26 0.00 0.00 60.65 60.43 1y8b s ILE 12 Cb -0.08 -1.00 0.00 0.00 1.25 0.00 0.00 42.46 42.63 1y8b s ILE 12 CO 0.25 0.00 1.08 -0.62 0.24 0.00 0.00 174.94 175.88 1y8b s ASP 13 N -1.51 7.10 0.07 4.36 2.15 -1.26 -2.72 116.67 124.85 1y8b s ASP 13 Ca -0.08 1.47 -0.34 0.00 0.43 0.00 0.00 52.55 54.04 1y8b s ASP 13 Cb -0.00 -2.54 -0.17 0.00 -0.30 0.00 0.00 42.92 39.90 1y8b s ASP 13 CO 0.04 -0.65 1.51 0.00 -0.17 0.00 0.00 175.17 175.91 1y8b h ALA 14 N 7.52 -1.23 -0.48 3.66 0.00 -1.90 -1.80 119.26 125.03 1y8b h ALA 14 Ca -0.23 -0.22 0.07 0.00 0.00 0.00 0.00 54.91 54.53 1y8b h ALA 14 Cb 1.08 0.59 -0.10 0.00 0.00 0.00 0.00 17.79 19.36 1y8b h ALA 14 CO 0.96 -1.20 -0.46 -0.91 0.00 0.00 0.00 179.25 177.64 1y8b h ASN 15 N -1.08 -1.54 -0.85 0.00 4.21 -1.93 0.22 115.58 114.60 1y8b h ASN 15 Ca -0.09 0.24 0.21 0.00 1.21 0.00 0.00 56.30 57.86 1y8b h ASN 15 Cb 0.88 0.68 -0.13 0.00 -1.12 0.00 0.00 38.32 38.62 1y8b h ASN 15 CO 0.08 -0.36 0.28 0.15 -1.29 0.00 0.00 177.43 176.29 1y8b h PHE 16 N -0.30 0.45 0.00 1.19 3.04 -1.80 0.79 116.94 120.31 1y8b h PHE 16 Ca 0.14 0.04 -0.05 0.00 3.98 0.00 0.00 57.97 62.08 1y8b h PHE 16 Cb 0.58 -0.06 -0.01 0.00 2.56 0.00 0.00 35.95 39.01 1y8b h PHE 16 CO -0.68 -0.12 -0.25 -0.22 -2.02 0.00 0.00 178.31 175.02 1y8b h LYS 17 N 0.30 0.00 0.53 1.11 3.11 0.26 -2.79 116.57 119.10 1y8b h LYS 17 Ca 0.52 0.00 -0.03 0.00 -2.81 0.00 0.00 60.65 58.33 1y8b h LYS 17 Cb 0.99 0.00 0.01 0.00 -1.00 0.00 0.00 32.23 32.23 1y8b h LYS 17 CO -0.57 0.25 -0.26 -0.09 -2.81 0.00 0.00 179.45 175.98 1y8b h ARG 18 N 0.00 -0.69 -1.20 1.90 1.12 0.20 0.59 114.38 116.29 1y8b h ARG 18 Ca -0.00 0.05 0.35 0.00 -1.11 0.00 0.00 59.98 59.26 1y8b h ARG 18 Cb 0.47 0.16 -0.09 0.00 -0.01 0.00 0.00 29.97 30.49 1y8b h ARG 18 CO 0.03 -0.46 0.80 0.74 -3.11 0.00 0.00 179.97 177.97 1y8b h PHE 19 N -1.03 0.45 0.18 2.20 -1.00 -1.36 0.65 116.94 117.03 1y8b h PHE 19 Ca -0.07 0.02 -0.33 0.00 2.81 0.00 0.00 57.97 60.40 1y8b h PHE 19 Cb 0.55 -0.12 0.01 0.00 3.61 0.00 0.00 35.95 40.00 1y8b h PHE 19 CO 0.02 -0.04 -1.61 0.28 -1.61 0.00 0.00 178.31 175.36 1y8b h VAL 20 N 0.20 1.03 0.00 -0.55 2.07 -1.36 -3.19 116.25 114.45 1y8b h VAL 20 Ca 0.67 -2.52 -0.04 0.00 0.82 0.00 0.00 66.70 65.64 1y8b h VAL 20 Cb 2.10 2.82 -0.01 0.00 -1.52 0.00 0.00 31.29 34.69 1y8b h VAL 20 CO -0.26 0.82 -0.17 -0.78 0.02 0.00 0.00 177.57 177.20 1y8b h ASP 21 N 0.02 0.00 0.03 0.57 1.82 0.27 0.59 116.42 119.70 1y8b h ASP 21 Ca -0.32 0.00 -0.16 0.00 -0.39 0.00 0.00 57.03 56.17 1y8b h ASP 21 Cb 2.03 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 42.02 1y8b h ASP 21 CO 0.17 0.17 -0.82 1.05 -1.61 0.00 0.00 179.24 178.20 1y8b h GLU 22 N 0.00 0.06 0.00 0.28 -0.00 0.05 -3.39 114.58 111.58 1y8b h GLU 22 Ca -0.00 -0.10 -0.14 0.00 -0.00 0.00 0.00 59.36 59.13 1y8b h GLU 22 Cb 0.91 0.04 -0.03 0.00 -0.00 0.00 0.00 28.75 29.67 1y8b h GLU 22 CO 0.02 1.05 -1.63 0.39 -0.00 0.00 0.00 179.01 178.84 1y8b n GLU 23 N -4.39 1.89 -0.04 1.06 -0.58 -1.20 -4.58 120.64 112.79 1y8b n GLU 23 Ca -0.22 -0.03 -0.01 0.00 -0.42 0.00 0.00 57.16 56.48 1y8b n GLU 23 Cb 0.66 -1.25 -0.00 0.00 -0.57 0.00 0.00 31.44 30.27 1y8b n GLU 23 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1y8b h VAL 24 N 0.00 0.00 -0.71 2.62 2.07 -1.40 -2.18 116.25 116.64 1y8b h VAL 24 Ca -0.20 -0.74 0.14 0.00 0.82 0.00 0.00 66.70 66.72 1y8b h VAL 24 Cb 1.34 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 31.01 1y8b h VAL 24 CO 0.01 0.00 0.24 -0.07 0.02 0.00 0.00 177.57 177.77 1y8b h LEU 25 N -0.74 0.17 0.00 2.57 3.38 -0.08 0.20 115.31 120.81 1y8b h LEU 25 Ca 0.00 0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 1y8b h LEU 25 Cb 0.16 0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 1y8b h LEU 25 CO 0.00 0.06 -0.04 1.55 0.09 0.00 0.00 178.44 180.09 1y8b h PRO 26 N 0.37 0.00 0.00 1.13 0.13 -1.75 -1.11 132.00 130.77 1y8b h PRO 26 Ca 0.39 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.52 1y8b h PRO 26 Cb 0.61 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.74 1y8b h PRO 26 CO -0.42 0.92 0.00 0.41 -0.23 0.00 0.00 178.00 178.68 1y8b n GLY 27 N 1.62 -0.54 0.01 1.56 0.00 -0.82 -2.00 105.19 105.02 1y8b n GLY 27 Ca -0.10 -0.02 0.01 0.00 0.00 0.00 0.00 46.02 45.91 1y8b n GLY 27 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1y8b n THR 28 N -1.37 0.10 0.00 2.61 -2.24 0.05 -4.99 114.28 108.44 1y8b n THR 28 Ca 0.02 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 1y8b n THR 28 Cb 0.05 0.04 0.00 0.00 -2.10 0.00 0.00 70.33 68.32 1y8b n THR 28 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1y8b n GLY 29 N 2.29 3.43 3.23 3.38 0.00 -0.48 -5.05 105.19 111.99 1y8b n GLY 29 Ca -0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.65 1y8b n GLY 29 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1y8b n LEU 30 N 0.00 -2.41 -4.67 0.99 4.77 -0.83 -4.91 117.00 109.93 1y8b n LEU 30 Ca 0.00 0.13 -0.29 0.00 -0.03 0.00 0.00 56.01 55.82 1y8b n LEU 30 Cb 0.00 -0.95 -0.08 0.00 -2.33 0.00 0.00 43.42 40.06 1y8b n LEU 30 CO 0.00 -3.84 -0.34 -1.81 -1.33 0.00 0.00 177.39 170.07 1y8b s ASP 31 N -1.61 4.89 -0.02 -1.43 1.01 -1.26 -4.57 116.67 113.67 1y8b s ASP 31 Ca 0.50 -0.28 -0.23 0.00 0.71 0.00 0.00 52.55 53.25 1y8b s ASP 31 Cb -0.13 -1.10 -0.21 0.00 1.01 0.00 0.00 42.92 42.48 1y8b s ASP 31 CO 0.70 0.14 1.13 0.00 0.21 0.00 0.00 175.17 177.35 1y8b h ALA 32 N 3.14 0.08 0.00 5.23 0.00 -1.93 -2.66 119.26 123.11 1y8b h ALA 32 Ca -0.48 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.01 1y8b h ALA 32 Cb 1.18 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1y8b h ALA 32 CO 0.58 0.08 0.00 0.00 0.00 0.00 0.00 179.25 179.92 1y8b h ALA 33 N 0.37 1.00 0.19 0.00 0.00 -1.99 0.02 119.26 118.84 1y8b h ALA 33 Ca -0.02 0.00 -0.32 0.00 0.00 0.00 0.00 54.91 54.57 1y8b h ALA 33 Cb 0.91 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.72 1y8b h ALA 33 CO 0.05 0.00 -1.55 0.00 0.00 0.00 0.00 179.25 177.74 1y8b h ALA 34 N 2.04 0.06 0.00 0.00 0.00 -1.95 -3.26 119.26 116.15 1y8b h ALA 34 Ca 0.00 -1.03 -0.10 0.00 0.00 0.00 0.00 54.91 53.78 1y8b h ALA 34 Cb 0.17 0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1y8b h ALA 34 CO 0.00 0.86 -0.49 0.35 0.00 0.00 0.00 179.25 179.97 1y8b h PHE 35 N 0.00 0.00 0.02 0.00 3.04 -1.09 -2.44 116.94 116.48 1y8b h PHE 35 Ca -0.30 0.00 -0.00 0.00 3.98 0.00 0.00 57.97 61.65 1y8b h PHE 35 Cb 2.02 0.00 0.00 0.00 2.56 0.00 0.00 35.95 40.53 1y8b h PHE 35 CO 0.12 0.46 -0.01 2.35 -2.02 0.00 0.00 178.31 179.21 1y8b h TRP 36 N 0.00 -0.03 0.07 0.41 7.01 -1.12 -2.02 115.95 120.28 1y8b h TRP 36 Ca -0.01 -0.00 -0.00 0.00 2.11 0.00 0.00 58.89 60.99 1y8b h TRP 36 Cb 1.36 0.01 0.00 0.00 -2.10 0.00 0.00 29.16 28.43 1y8b h TRP 36 CO 0.00 0.27 -0.04 -0.09 -2.79 0.00 0.00 178.44 175.79 1y8b h ARG 37 N -0.32 -0.10 -1.02 2.65 2.43 -1.65 -2.07 114.38 114.30 1y8b h ARG 37 Ca -0.00 0.01 0.31 0.00 -0.81 0.00 0.00 59.98 59.48 1y8b h ARG 37 Cb 0.31 0.02 -0.14 0.00 -0.42 0.00 0.00 29.97 29.74 1y8b h ARG 37 CO 0.00 0.43 0.59 -0.97 -1.51 0.00 0.00 179.97 178.52 1y8b h ASN 38 N -0.92 0.54 0.07 -3.80 -0.73 -1.54 0.51 115.58 109.71 1y8b h ASN 38 Ca -0.01 0.17 -0.00 0.00 1.87 0.00 0.00 56.30 58.33 1y8b h ASN 38 Cb 0.57 0.11 0.00 0.00 0.27 0.00 0.00 38.32 39.27 1y8b h ASN 38 CO 0.02 -0.08 -0.04 0.15 -0.37 0.00 0.00 177.43 177.11 1y8b h PHE 39 N 0.37 -0.09 -0.17 0.67 3.57 -1.41 -2.57 116.94 117.31 1y8b h PHE 39 Ca 0.71 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 62.26 1y8b h PHE 39 Cb 1.62 0.03 -0.06 0.00 2.79 0.00 0.00 35.95 40.32 1y8b h PHE 39 CO -0.01 0.46 -0.25 0.22 -2.23 0.00 0.00 178.31 176.51 1y8b h ASP 40 N -0.76 -0.78 0.38 0.41 3.58 -0.25 0.13 116.42 119.14 1y8b h ASP 40 Ca -0.01 0.13 -0.02 0.00 0.42 0.00 0.00 57.03 57.55 1y8b h ASP 40 Cb 0.60 0.35 0.00 0.00 1.72 0.00 0.00 39.33 42.00 1y8b h ASP 40 CO 0.02 -0.29 -0.18 1.05 -2.88 0.00 0.00 179.24 176.95 1y8b h GLU 41 N -0.29 -0.50 -0.67 0.28 4.11 -1.11 0.11 114.58 116.51 1y8b h GLU 41 Ca 0.11 0.03 0.13 0.00 0.07 0.00 0.00 59.36 59.71 1y8b h GLU 41 Cb 0.47 0.11 -0.13 0.00 0.50 0.00 0.00 28.75 29.70 1y8b h GLU 41 CO -0.34 -0.33 -0.23 0.82 0.07 0.00 0.00 179.01 179.00 1y8b h ILE 42 N -0.67 0.25 0.78 -1.06 2.04 -1.46 2.07 117.51 119.46 1y8b h ILE 42 Ca -0.05 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.77 1y8b h ILE 42 Cb 0.40 0.25 0.01 0.00 -0.74 0.00 0.00 36.82 36.74 1y8b h ILE 42 CO 0.09 0.00 -0.37 0.58 0.00 0.00 0.00 178.15 178.44 1y8b h VAL 43 N -0.05 0.22 -0.29 1.67 2.07 -0.77 2.53 116.25 121.63 1y8b h VAL 43 Ca 0.30 -0.03 -0.05 0.00 0.82 0.00 0.00 66.70 67.74 1y8b h VAL 43 Cb 0.53 0.23 -0.02 0.00 -1.52 0.00 0.00 31.29 30.51 1y8b h VAL 43 CO -0.71 0.00 -0.03 -0.74 0.02 0.00 0.00 177.57 176.11 1y8b h HIS 44 N -1.07 0.47 0.12 1.57 -0.00 0.10 1.05 115.15 117.39 1y8b h HIS 44 Ca -0.11 -0.05 -0.32 0.00 -0.00 0.00 0.00 60.37 59.89 1y8b h HIS 44 Cb 0.81 -0.14 -0.01 0.00 -0.00 0.00 0.00 27.41 28.07 1y8b h HIS 44 CO -0.02 0.49 -1.66 0.22 -0.00 0.00 0.00 177.93 176.97 1y8b h ASP 45 N 0.44 0.41 0.72 3.26 3.58 0.35 -3.37 116.42 121.81 1y8b h ASP 45 Ca 0.09 -0.64 -0.20 0.00 0.42 0.00 0.00 57.03 56.71 1y8b h ASP 45 Cb 0.34 -0.13 -0.03 0.00 1.72 0.00 0.00 39.33 41.22 1y8b h ASP 45 CO 0.01 1.54 -1.40 0.25 -2.88 0.00 0.00 179.24 176.77 1y8b h LEU 46 N 0.07 0.00 0.06 2.28 6.46 0.45 -3.38 115.31 121.24 1y8b h LEU 46 Ca -0.29 0.00 0.03 0.00 -0.12 0.00 0.00 57.88 57.49 1y8b h LEU 46 Cb 2.04 0.00 -0.04 0.00 -0.73 0.00 0.00 40.66 41.92 1y8b h LEU 46 CO 0.15 0.71 -0.31 0.00 -0.62 0.00 0.00 178.44 178.37 1y8b h ALA 47 N 1.29 -0.48 -0.28 1.25 0.00 0.11 -1.68 119.26 119.48 1y8b h ALA 47 Ca -0.18 -0.03 0.08 0.00 0.00 0.00 0.00 54.91 54.79 1y8b h ALA 47 Cb 1.69 0.52 -0.01 0.00 0.00 0.00 0.00 17.79 20.00 1y8b h ALA 47 CO 0.06 -0.83 0.77 -1.00 0.00 0.00 0.00 179.25 178.25 1y8b h PRO 48 N -0.49 0.00 0.18 0.00 0.13 -1.74 0.27 132.00 130.34 1y8b h PRO 48 Ca 0.05 0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 64.85 1y8b h PRO 48 Cb 0.55 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.69 1y8b h PRO 48 CO -0.22 0.00 -1.60 1.05 -0.23 0.00 0.00 178.00 177.00 1y8b h GLU 49 N 0.00 0.37 -0.41 0.86 4.11 -1.54 -3.26 114.58 114.71 1y8b h GLU 49 Ca 0.13 -0.64 0.03 0.00 0.07 0.00 0.00 59.36 58.95 1y8b h GLU 49 Cb 1.67 0.24 -0.03 0.00 0.50 0.00 0.00 28.75 31.13 1y8b h GLU 49 CO -0.00 1.27 0.22 -0.91 0.07 0.00 0.00 179.01 179.66 1y8b h ASN 50 N 0.10 0.33 0.04 3.06 -0.26 -0.43 0.45 115.58 118.87 1y8b h ASN 50 Ca -0.28 0.01 -0.00 0.00 -0.56 0.00 0.00 56.30 55.47 1y8b h ASN 50 Cb 2.08 -0.05 -0.00 0.00 -1.06 0.00 0.00 38.32 39.29 1y8b h ASN 50 CO 0.20 0.24 -0.01 -0.09 -1.06 0.00 0.00 177.43 176.71 1y8b h ARG 51 N 0.44 0.00 0.06 0.81 2.43 -1.64 -2.13 114.38 114.35 1y8b h ARG 51 Ca 0.17 0.00 -0.13 0.00 -0.81 0.00 0.00 59.98 59.22 1y8b h ARG 51 Cb 0.06 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.62 1y8b h ARG 51 CO -0.11 0.01 -0.53 0.37 -1.51 0.00 0.00 179.97 178.20 1y8b h GLN 52 N 0.00 0.25 -0.46 0.20 4.15 -0.98 -2.54 115.11 115.72 1y8b h GLN 52 Ca -0.00 -0.35 0.07 0.00 0.77 0.00 0.00 58.65 59.14 1y8b h GLN 52 Cb 0.03 0.12 -0.06 0.00 0.21 0.00 0.00 27.48 27.78 1y8b h GLN 52 CO 0.00 1.11 0.12 1.25 -1.93 0.00 0.00 178.83 179.38 1y8b h LEU 53 N -0.45 0.06 -0.74 -2.39 6.46 -0.69 0.36 115.31 117.92 1y8b h LEU 53 Ca -0.08 0.07 -0.04 0.00 -0.12 0.00 0.00 57.88 57.71 1y8b h LEU 53 Cb 1.35 0.09 -0.03 0.00 -0.73 0.00 0.00 40.66 41.33 1y8b h LEU 53 CO 0.10 0.06 0.32 -0.07 -0.62 0.00 0.00 178.44 178.23 1y8b h LEU 54 N 0.26 1.00 -1.57 2.25 -0.00 -1.55 -1.08 115.31 114.62 1y8b h LEU 54 Ca 0.23 -0.16 -0.03 0.00 -0.00 0.00 0.00 57.88 57.92 1y8b h LEU 54 Cb 0.27 -0.26 -0.00 0.00 -0.00 0.00 0.00 40.66 40.67 1y8b h LEU 54 CO -0.28 0.88 -0.14 0.00 -0.00 0.00 0.00 178.44 178.91 1y8b h ALA 55 N 1.16 1.11 -0.09 1.53 0.00 -0.74 -2.47 119.26 119.75 1y8b h ALA 55 Ca 0.25 -0.13 -0.21 0.00 0.00 0.00 0.00 54.91 54.82 1y8b h ALA 55 Cb 0.18 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1y8b h ALA 55 CO -0.02 0.18 -0.80 0.93 0.00 0.00 0.00 179.25 179.53 1y8b h GLU 56 N 0.00 0.58 -0.46 0.00 3.07 0.91 -2.99 114.58 115.69 1y8b h GLU 56 Ca -0.00 -0.50 -0.09 0.00 -0.50 0.00 0.00 59.36 58.26 1y8b h GLU 56 Cb 0.52 0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 28.52 1y8b h GLU 56 CO 0.02 1.13 -0.09 0.00 -1.40 0.00 0.00 179.01 178.66 1y8b h ARG 57 N 0.38 0.82 -0.56 2.33 2.47 -0.91 -1.97 114.38 116.95 1y8b h ARG 57 Ca -0.05 -0.27 -0.11 0.00 -1.26 0.00 0.00 59.98 58.28 1y8b h ARG 57 Cb 1.41 -0.07 -0.02 0.00 -1.65 0.00 0.00 29.97 29.64 1y8b h ARG 57 CO 0.15 0.89 -0.09 0.22 0.56 0.00 0.00 179.97 181.70 1y8b h ASP 58 N 0.74 1.04 -0.05 7.04 1.82 -1.48 -0.68 116.42 124.86 1y8b h ASP 58 Ca 0.13 -0.34 -0.14 0.00 -0.39 0.00 0.00 57.03 56.29 1y8b h ASP 58 Cb 0.59 -0.28 0.01 0.00 0.68 0.00 0.00 39.33 40.32 1y8b h ASP 58 CO 0.04 1.14 -0.51 0.08 -1.61 0.00 0.00 179.24 178.37 1y8b h ARG 59 N 0.93 0.43 0.00 0.28 0.11 -1.42 -1.32 114.38 113.39 1y8b h ARG 59 Ca 0.15 -0.40 -0.04 0.00 0.10 0.00 0.00 59.98 59.78 1y8b h ARG 59 Cb 0.66 0.10 -0.01 0.00 1.11 0.00 0.00 29.97 31.83 1y8b h ARG 59 CO 0.05 1.05 -0.21 -0.84 0.10 0.00 0.00 179.97 180.12 1y8b h ILE 60 N -0.04 0.57 0.13 0.08 -0.00 -1.38 -2.95 117.51 113.93 1y8b h ILE 60 Ca -0.05 -0.99 -0.21 0.00 -0.00 0.00 0.00 64.86 63.61 1y8b h ILE 60 Cb 1.19 1.66 0.01 0.00 -0.00 0.00 0.00 36.82 39.68 1y8b h ILE 60 CO 0.10 0.20 -0.98 1.56 -0.00 0.00 0.00 178.15 179.03 1y8b h GLN 61 N 0.00 0.27 -0.96 0.16 4.20 -1.09 -2.87 115.11 114.82 1y8b h GLN 61 Ca -0.00 -0.47 0.16 0.00 0.06 0.00 0.00 58.65 58.40 1y8b h GLN 61 Cb 0.65 0.17 -0.08 0.00 0.30 0.00 0.00 27.48 28.51 1y8b h GLN 61 CO 0.03 1.22 0.61 0.00 -0.67 0.00 0.00 178.83 180.02 1y8b h ALA 62 N 0.03 1.75 -0.01 3.87 0.00 -1.16 0.47 119.26 124.22 1y8b h ALA 62 Ca -0.19 0.04 -0.19 0.00 0.00 0.00 0.00 54.91 54.57 1y8b h ALA 62 Cb 1.66 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.32 1y8b h ALA 62 CO 0.11 -0.04 -0.83 0.00 0.00 0.00 0.00 179.25 178.49 1y8b h ALA 63 N 1.60 0.56 0.00 0.00 0.00 -1.60 -3.15 119.26 116.67 1y8b h ALA 63 Ca 0.51 -0.68 -0.14 0.00 0.00 0.00 0.00 54.91 54.59 1y8b h ALA 63 Cb 0.78 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 1y8b h ALA 63 CO -0.27 0.86 -0.66 -0.07 0.00 0.00 0.00 179.25 179.11 1y8b h LEU 64 N 0.14 0.00 -1.67 0.00 3.38 -0.64 -3.00 115.31 113.52 1y8b h LEU 64 Ca -0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1y8b h LEU 64 Cb 1.43 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.18 1y8b h LEU 64 CO 0.13 0.66 0.00 0.44 0.09 0.00 0.00 178.44 179.76 1y8b h ASP 65 N 0.00 0.00 0.23 -0.43 3.32 -0.14 0.10 116.42 119.51 1y8b h ASP 65 Ca -0.01 0.00 -0.33 0.00 0.02 0.00 0.00 57.03 56.71 1y8b h ASP 65 Cb 1.33 0.00 0.03 0.00 0.22 0.00 0.00 39.33 40.91 1y8b h ASP 65 CO 0.09 0.00 -1.51 -0.08 -1.72 0.00 0.00 179.24 176.01 1y8b h GLU 66 N 0.00 0.49 0.14 3.56 4.81 -1.54 -2.87 114.58 119.17 1y8b h GLU 66 Ca 0.00 -0.84 -0.26 0.00 -0.13 0.00 0.00 59.36 58.13 1y8b h GLU 66 Cb 0.42 0.31 0.01 0.00 0.63 0.00 0.00 28.75 30.12 1y8b h GLU 66 CO 0.00 1.40 -1.27 -1.49 -0.73 0.00 0.00 179.01 176.93 1y8b h TRP 67 N 0.10 0.54 -0.79 0.92 4.06 -1.54 -2.83 115.95 116.41 1y8b h TRP 67 Ca -0.27 -0.40 -0.05 0.00 2.06 0.00 0.00 58.89 60.23 1y8b h TRP 67 Cb 2.12 -0.02 -0.03 0.00 -1.00 0.00 0.00 29.16 30.22 1y8b h TRP 67 CO 0.13 1.49 0.30 0.45 -3.56 0.00 0.00 178.44 177.25 1y8b h HIS 68 N -0.26 1.22 -0.17 0.49 3.86 -0.97 0.52 115.15 119.84 1y8b h HIS 68 Ca -0.26 -0.10 -0.08 0.00 -1.16 0.00 0.00 60.37 58.78 1y8b h HIS 68 Cb 1.79 -0.36 -0.00 0.00 1.06 0.00 0.00 27.41 29.89 1y8b h HIS 68 CO 0.15 0.92 -0.20 -0.09 0.86 0.00 0.00 177.93 179.57 1y8b h ARG 69 N 1.16 0.43 0.00 2.45 2.43 -1.63 -1.85 114.38 117.37 1y8b h ARG 69 Ca 0.26 -0.24 -0.02 0.00 -0.81 0.00 0.00 59.98 59.18 1y8b h ARG 69 Cb 0.23 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 29.79 1y8b h ARG 69 CO -0.02 0.81 -0.09 1.03 -1.51 0.00 0.00 179.97 180.20 1y8b h SER 70 N 0.08 0.00 -2.14 -3.80 0.87 -1.34 -3.34 113.55 103.88 1y8b h SER 70 Ca 0.02 0.00 -0.58 0.00 -1.23 0.00 0.00 61.79 60.01 1y8b h SER 70 Cb 0.74 0.00 -0.40 0.00 -0.44 0.00 0.00 62.40 62.30 1y8b h SER 70 CO 0.05 0.09 -0.90 0.59 -0.53 0.00 0.00 176.83 176.12 1y8b n ASN 71 N -3.18 1.44 -2.43 6.23 5.03 0.18 -5.07 115.26 117.47 1y8b n ASN 71 Ca 0.01 -2.94 -0.06 0.00 0.87 0.00 0.00 54.58 52.47 1y8b n ASN 71 Cb 0.42 -0.65 0.04 0.00 -1.02 0.00 0.00 39.78 38.57 1y8b n ASN 71 CO 0.00 0.00 0.00 -0.81 -1.83 0.00 0.00 177.26 174.62 1y8b n PRO 72 N 1.36 -0.44 0.00 3.52 -0.04 -0.71 -4.55 135.00 134.14 1y8b n PRO 72 Ca 0.25 -0.40 0.00 0.00 -0.04 0.00 0.00 63.50 63.31 1y8b n PRO 72 Cb 0.48 -0.28 0.00 0.00 -0.04 0.00 0.00 33.50 33.66 1y8b n PRO 72 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1y8b n GLY 73 N 2.92 0.76 3.51 0.55 0.00 -1.26 -4.23 105.19 107.45 1y8b n GLY 73 Ca 0.03 -0.78 -0.42 0.00 0.00 0.00 0.00 46.02 44.85 1y8b n GLY 73 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1y8b s PRO 74 N 0.00 3.41 -0.75 1.61 0.04 -1.26 -4.66 135.00 133.39 1y8b s PRO 74 Ca 0.00 -1.02 -0.26 0.00 0.04 0.00 0.00 61.00 59.76 1y8b s PRO 74 Cb 0.00 -4.78 -0.00 0.00 0.04 0.00 0.00 34.50 29.75 1y8b s PRO 74 CO 0.00 -2.02 1.66 0.08 0.04 0.00 0.00 177.00 176.76 1y8b s VAL 75 N 4.43 3.54 0.00 -0.36 1.01 -1.26 -4.97 120.40 122.79 1y8b s VAL 75 Ca 0.36 0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.37 1y8b s VAL 75 Cb -0.06 -4.36 0.00 0.00 0.00 0.00 0.00 36.38 31.96 1y8b s VAL 75 CO -0.01 -1.31 0.00 0.29 0.00 0.00 0.00 175.10 174.08 1y8b n LYS 76 N 9.14 1.65 -3.35 2.72 4.01 -1.26 -4.62 118.16 126.45 1y8b n LYS 76 Ca 0.21 0.00 -0.15 0.00 -0.51 0.00 0.00 58.31 57.86 1y8b n LYS 76 Cb 0.50 0.00 0.01 0.00 -0.51 0.00 0.00 35.03 35.03 1y8b n LYS 76 CO 0.00 0.00 0.00 -0.25 -1.11 0.00 0.00 177.40 176.04 1y8b n ASP 77 N 0.00 -6.48 0.11 4.39 9.92 -1.26 -4.78 116.55 118.44 1y8b n ASP 77 Ca 0.00 -0.31 -0.03 0.00 -0.53 0.00 0.00 54.79 53.92 1y8b n ASP 77 Cb 0.00 -3.56 0.03 0.00 -0.64 0.00 0.00 41.12 36.95 1y8b n ASP 77 CO 0.00 0.00 0.00 0.07 0.13 0.00 0.00 177.20 177.40 1y8b h LYS 78 N 0.65 0.00 -0.70 -1.24 -0.00 -1.95 -2.46 116.57 110.86 1y8b h LYS 78 Ca -0.30 0.00 0.05 0.00 -0.00 0.00 0.00 60.65 60.40 1y8b h LYS 78 Cb 1.20 0.00 -0.05 0.00 -0.00 0.00 0.00 32.23 33.37 1y8b h LYS 78 CO 0.30 0.76 0.41 0.00 -0.00 0.00 0.00 179.45 180.92 1y8b h ALA 79 N 1.24 0.94 0.07 0.07 0.00 -1.97 2.21 119.26 121.83 1y8b h ALA 79 Ca -0.01 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.64 1y8b h ALA 79 Cb 1.44 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.04 1y8b h ALA 79 CO 0.10 0.13 -1.28 0.00 0.00 0.00 0.00 179.25 178.20 1y8b h ALA 80 N 1.34 0.28 0.00 0.00 0.00 -1.92 -3.08 119.26 115.89 1y8b h ALA 80 Ca 0.30 -1.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.19 1y8b h ALA 80 Cb 0.14 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 1y8b h ALA 80 CO -0.16 1.16 -0.25 -0.92 0.00 0.00 0.00 179.25 179.09 1y8b h TYR 81 N 0.04 0.00 -1.01 0.00 5.03 -0.96 -2.98 116.97 117.09 1y8b h TYR 81 Ca -0.13 0.00 0.24 0.00 2.58 0.00 0.00 58.73 61.42 1y8b h TYR 81 Cb 1.92 0.00 -0.10 0.00 1.55 0.00 0.00 36.73 40.10 1y8b h TYR 81 CO 0.04 0.25 0.64 -0.22 -1.32 0.00 0.00 178.16 177.54 1y8b h LYS 82 N -1.00 0.49 0.00 1.82 3.11 0.35 0.56 116.57 121.90 1y8b h LYS 82 Ca -0.03 -0.03 -0.11 0.00 -2.81 0.00 0.00 60.65 57.68 1y8b h LYS 82 Cb 0.38 -0.11 -0.02 0.00 -1.00 0.00 0.00 32.23 31.48 1y8b h LYS 82 CO -0.02 0.33 -0.51 0.66 -2.81 0.00 0.00 179.45 177.10 1y8b h SER 83 N 0.51 0.00 -0.27 4.20 4.64 -1.54 -2.85 113.55 118.24 1y8b h SER 83 Ca 0.59 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.90 1y8b h SER 83 Cb 1.30 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.37 1y8b h SER 83 CO -0.34 0.51 0.15 0.15 -0.87 0.00 0.00 176.83 176.43 1y8b h PHE 84 N 0.00 0.39 0.58 4.77 3.57 0.29 -2.10 116.94 124.44 1y8b h PHE 84 Ca -0.01 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.47 1y8b h PHE 84 Cb 1.01 -0.13 0.01 0.00 2.79 0.00 0.00 35.95 39.62 1y8b h PHE 84 CO 0.00 0.29 -0.28 -0.07 -2.23 0.00 0.00 178.31 176.02 1y8b h LEU 85 N 0.41 -0.66 -0.90 0.59 3.38 -1.31 0.83 115.31 117.63 1y8b h LEU 85 Ca 0.11 -0.03 0.23 0.00 0.09 0.00 0.00 57.88 58.27 1y8b h LEU 85 Cb 0.03 0.17 -0.13 0.00 0.09 0.00 0.00 40.66 40.83 1y8b h LEU 85 CO -0.02 -0.34 0.40 0.03 0.09 0.00 0.00 178.44 178.60 1y8b h ARG 86 N -0.99 0.39 -0.05 1.13 3.08 -1.50 0.92 114.38 117.36 1y8b h ARG 86 Ca -0.08 -0.02 -0.10 0.00 0.07 0.00 0.00 59.98 59.84 1y8b h ARG 86 Cb 0.66 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.61 1y8b h ARG 86 CO 0.13 0.25 -0.45 0.93 -1.07 0.00 0.00 179.97 179.77 1y8b h GLU 87 N 0.40 0.11 0.00 0.04 4.39 -1.11 -2.36 114.58 116.04 1y8b h GLU 87 Ca 0.57 -0.05 -0.05 0.00 0.34 0.00 0.00 59.36 60.17 1y8b h GLU 87 Cb 1.10 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.74 1y8b h GLU 87 CO -0.53 0.54 -0.22 1.25 -1.16 0.00 0.00 179.01 178.89 1y8b h LEU 88 N 0.09 0.00 0.00 1.33 6.46 0.33 -3.46 115.31 120.06 1y8b h LEU 88 Ca 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 1y8b h LEU 88 Cb 0.83 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.76 1y8b h LEU 88 CO 0.06 0.22 0.00 0.61 -0.62 0.00 0.00 178.44 178.71 1y8b n GLY 89 N 0.13 0.82 0.07 3.75 0.00 -0.10 -4.98 105.19 104.88 1y8b n GLY 89 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 1y8b n GLY 89 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1y8b h TYR 90 N 0.00 0.00 -4.26 1.61 5.03 -1.76 -3.46 116.97 114.12 1y8b h TYR 90 Ca 0.00 0.00 -0.52 0.00 2.58 0.00 0.00 58.73 60.79 1y8b h TYR 90 Cb 0.00 0.00 0.20 0.00 1.55 0.00 0.00 36.73 38.48 1y8b h TYR 90 CO 0.00 0.50 0.23 1.28 -1.32 0.00 0.00 178.16 178.86 1y8b n LEU 91 N -4.65 3.45 -3.73 2.82 4.77 -1.25 -4.99 117.00 113.41 1y8b n LEU 91 Ca -0.09 0.44 -0.13 0.00 -0.03 0.00 0.00 56.01 56.20 1y8b n LEU 91 Cb 0.28 -1.48 -0.08 0.00 -2.33 0.00 0.00 43.42 39.81 1y8b n LEU 91 CO 0.15 -2.11 0.06 0.68 -1.33 0.00 0.00 177.39 174.84 1y8b s VAL 92 N -2.59 0.06 0.23 4.08 -7.23 -1.26 -4.80 120.40 108.89 1y8b s VAL 92 Ca 0.68 -0.50 -0.31 0.00 -1.81 0.00 0.00 61.98 60.05 1y8b s VAL 92 Cb -0.24 -0.75 -0.10 0.00 0.56 0.00 0.00 36.38 35.85 1y8b s VAL 92 CO 0.57 -0.27 1.52 -2.16 -0.31 0.00 0.00 175.10 174.45 1y8b s PRO 93 N -1.73 4.22 0.15 4.82 0.04 -1.26 -4.96 135.00 136.27 1y8b s PRO 93 Ca -0.10 2.39 -0.19 0.00 0.04 0.00 0.00 61.00 63.13 1y8b s PRO 93 Cb -0.03 -3.10 -0.07 0.00 0.04 0.00 0.00 34.50 31.33 1y8b s PRO 93 CO 0.02 -0.53 0.64 1.14 0.04 0.00 0.00 177.00 178.31 1y8b s GLN 94 N 0.10 4.22 0.52 4.56 -2.07 -1.26 -4.76 119.66 120.97 1y8b s GLN 94 Ca 0.64 0.79 -0.19 0.00 -1.82 0.00 0.00 55.36 54.78 1y8b s GLN 94 Cb -0.44 -3.07 -0.07 0.00 -1.09 0.00 0.00 33.01 28.34 1y8b s GLN 94 CO 0.40 0.52 1.04 -1.25 -1.32 0.00 0.00 175.29 174.68 1y8b s PRO 95 N -1.55 3.68 0.12 9.60 0.04 -1.26 -4.96 135.00 140.67 1y8b s PRO 95 Ca 0.36 1.28 -0.33 0.00 0.04 0.00 0.00 61.00 62.35 1y8b s PRO 95 Cb -0.18 -2.08 -0.12 0.00 0.04 0.00 0.00 34.50 32.16 1y8b s PRO 95 CO 0.21 -0.52 1.54 0.93 0.04 0.00 0.00 177.00 179.20 1y8b h GLU 96 N 1.20 -0.45 -3.08 4.56 4.39 -1.97 -3.46 114.58 115.78 1y8b h GLU 96 Ca -0.49 0.03 0.05 0.00 0.34 0.00 0.00 59.36 59.30 1y8b h GLU 96 Cb 1.22 0.10 -0.05 0.00 -0.10 0.00 0.00 28.75 29.91 1y8b h GLU 96 CO 0.59 -0.30 0.19 1.03 -1.16 0.00 0.00 179.01 179.36 1y8b s ARG 97 N -5.61 1.77 0.02 2.33 0.52 -1.26 -5.18 118.95 111.54 1y8b s ARG 97 Ca -0.14 -1.03 -0.03 0.00 -0.52 0.00 0.00 55.73 54.01 1y8b s ARG 97 Cb 0.08 0.59 -0.01 0.00 0.52 0.00 0.00 34.95 36.13 1y8b s ARG 97 CO 0.60 -0.80 0.04 0.08 0.02 0.00 0.00 175.30 175.24 1y8b s VAL 98 N -3.91 0.11 -0.37 3.52 1.01 -1.26 -5.12 120.40 114.37 1y8b s VAL 98 Ca 0.12 -0.91 -0.10 0.00 0.00 0.00 0.00 61.98 61.10 1y8b s VAL 98 Cb -0.05 -0.47 0.04 0.00 0.00 0.00 0.00 36.38 35.89 1y8b s VAL 98 CO 0.07 -0.50 0.19 0.28 0.00 0.00 0.00 175.10 175.15 1y8b s THR 99 N -1.72 4.35 -0.23 3.92 -1.32 -1.26 -4.90 115.64 114.48 1y8b s THR 99 Ca -0.13 -1.00 -0.24 0.00 -1.21 0.00 0.00 61.69 59.11 1y8b s THR 99 Cb -0.07 -3.47 -0.01 0.00 -1.51 0.00 0.00 72.50 67.44 1y8b s THR 99 CO -0.01 -0.26 0.80 -0.69 -2.21 0.00 0.00 174.62 172.25 1y8b s VAL 100 N 1.50 4.86 -0.12 5.08 1.01 -1.23 -4.40 120.40 127.11 1y8b s VAL 100 Ca 0.01 1.51 -0.00 0.00 0.00 0.00 0.00 61.98 63.50 1y8b s VAL 100 Cb -0.20 -4.09 0.02 0.00 0.00 0.00 0.00 36.38 32.11 1y8b s VAL 100 CO 0.05 -0.04 -0.09 -1.61 0.00 0.00 0.00 175.10 173.41 1y8b s GLU 101 N 2.69 1.71 -0.00 2.72 8.01 -1.26 -4.37 118.70 128.19 1y8b s GLU 101 Ca 0.34 -0.33 -0.06 0.00 0.01 0.00 0.00 54.97 54.94 1y8b s GLU 101 Cb -0.15 -1.71 0.00 0.00 -4.31 0.00 0.00 34.13 27.96 1y8b s GLU 101 CO 0.08 -0.26 0.12 -0.08 0.01 0.00 0.00 175.26 175.13 1y8b s THR 102 N 1.65 0.07 -0.08 3.63 -1.32 -1.26 -4.14 115.64 114.19 1y8b s THR 102 Ca 0.05 -0.62 -0.15 0.00 -1.21 0.00 0.00 61.69 59.76 1y8b s THR 102 Cb -0.13 -0.38 0.03 0.00 -1.51 0.00 0.00 72.50 70.52 1y8b s THR 102 CO -0.09 -0.34 0.37 0.42 -2.21 0.00 0.00 174.62 172.77 1y8b s THR 103 N -1.18 0.03 0.00 5.08 -4.23 -1.26 -4.96 115.64 109.12 1y8b s THR 103 Ca -0.13 -0.23 0.00 0.00 -1.18 0.00 0.00 61.69 60.16 1y8b s THR 103 Cb -0.07 -0.61 0.00 0.00 1.34 0.00 0.00 72.50 73.16 1y8b s THR 103 CO 0.01 -0.12 0.00 0.61 -0.54 0.00 0.00 174.62 174.58 1y8b n GLY 104 N 1.98 -0.94 3.25 3.99 0.00 -1.26 -4.93 105.19 107.28 1y8b n GLY 104 Ca -0.18 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.60 1y8b n GLY 104 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1y8b n ILE 105 N 0.00 0.00 -0.76 -0.61 -0.00 -1.26 -3.79 119.36 112.94 1y8b n ILE 105 Ca 0.00 -2.31 0.00 0.00 -0.00 0.00 0.00 62.75 60.44 1y8b n ILE 105 Cb 0.00 0.85 0.00 0.00 -0.00 0.00 0.00 39.64 40.49 1y8b n ILE 105 CO 0.00 0.00 0.00 -0.67 -0.00 0.00 0.00 176.55 175.88 1y8b n ASP 106 N -1.55 0.00 0.00 4.38 2.03 -1.26 -4.93 116.55 115.22 1y8b n ASP 106 Ca -0.05 -0.25 0.00 0.00 0.52 0.00 0.00 54.79 55.01 1y8b n ASP 106 Cb 0.59 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.99 1y8b n ASP 106 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 1y8b n SER 107 N 0.00 0.00 -0.03 1.67 2.88 -1.26 -4.64 113.62 112.24 1y8b n SER 107 Ca 0.00 0.00 -0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1y8b n SER 107 Cb 0.06 -0.25 -0.00 0.00 -0.75 0.00 0.00 64.21 63.27 1y8b n SER 107 CO 0.00 0.00 0.00 1.05 -1.23 0.00 0.00 175.04 174.86 1y8b h GLU 108 N 0.00 0.00 0.00 -1.46 -0.00 -1.91 -2.35 114.58 108.85 1y8b h GLU 108 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.36 1y8b h GLU 108 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 28.75 1y8b h GLU 108 CO 0.00 0.00 0.20 1.51 -0.00 0.00 0.00 179.01 180.72 1y8b n ILE 109 N -3.70 0.95 -0.03 -1.06 3.06 -1.26 -0.84 119.36 116.47 1y8b n ILE 109 Ca -0.01 0.66 -0.19 0.00 -2.50 0.00 0.00 62.75 60.71 1y8b n ILE 109 Cb 0.02 -1.66 -0.14 0.00 0.54 0.00 0.00 39.64 38.41 1y8b n ILE 109 CO 0.00 0.00 0.00 0.41 -2.50 0.00 0.00 176.55 174.46 1y8b n THR 110 N -1.83 1.69 -2.55 9.51 -1.04 -1.24 -4.79 114.28 114.04 1y8b n THR 110 Ca -0.01 -0.65 -0.01 0.00 -2.04 0.00 0.00 64.05 61.34 1y8b n THR 110 Cb 0.22 -1.57 0.01 0.00 -1.82 0.00 0.00 70.33 67.16 1y8b n THR 110 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 1y8b n SER 111 N -3.38 -0.34 -3.49 8.00 2.88 -0.02 -5.02 113.62 112.25 1y8b n SER 111 Ca -0.34 -1.23 -0.11 0.00 -1.33 0.00 0.00 58.87 55.86 1y8b n SER 111 Cb 1.04 0.26 -0.03 0.00 -0.75 0.00 0.00 64.21 64.72 1y8b n SER 111 CO 0.00 0.00 0.00 -1.58 -1.23 0.00 0.00 175.04 172.23 1y8b s GLN 112 N 0.02 0.97 0.00 -1.46 0.74 -0.26 -4.66 119.66 115.00 1y8b s GLN 112 Ca 0.01 -0.20 0.00 0.00 0.05 0.00 0.00 55.36 55.22 1y8b s GLN 112 Cb 0.05 0.45 0.00 0.00 1.10 0.00 0.00 33.01 34.61 1y8b s GLN 112 CO -0.01 -0.39 0.00 0.00 -0.55 0.00 0.00 175.29 174.33 1y8b n ALA 113 N 0.03 0.00 -3.00 1.58 0.00 -1.26 -4.12 120.51 113.74 1y8b n ALA 113 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.31 1y8b n ALA 113 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.06 1y8b n ALA 113 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1y8b n GLY 114 N -0.03 1.37 3.76 0.00 0.00 -1.26 -4.30 105.19 104.73 1y8b n GLY 114 Ca 0.00 -0.69 -0.38 0.00 0.00 0.00 0.00 46.02 44.95 1y8b n GLY 114 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1y8b s PRO 115 N 0.43 3.51 -0.14 1.61 0.04 -1.26 -4.00 135.00 135.19 1y8b s PRO 115 Ca 0.00 2.12 -0.05 0.00 0.04 0.00 0.00 61.00 63.11 1y8b s PRO 115 Cb 0.00 -2.43 -0.04 0.00 0.04 0.00 0.00 34.50 32.07 1y8b s PRO 115 CO 0.00 -0.86 0.06 -0.65 0.04 0.00 0.00 177.00 175.59 1y8b s GLN 116 N -2.68 3.53 -0.04 4.56 -0.21 0.34 -3.68 119.66 121.47 1y8b s GLN 116 Ca 0.66 -0.32 0.02 0.00 0.02 0.00 0.00 55.36 55.74 1y8b s GLN 116 Cb -0.37 -3.06 0.01 0.00 1.00 0.00 0.00 33.01 30.58 1y8b s GLN 116 CO 0.45 0.53 -0.10 -1.17 -2.12 0.00 0.00 175.29 172.88 1y8b s LEU 117 N -0.35 1.70 0.17 2.90 0.20 -1.19 -0.57 118.68 121.53 1y8b s LEU 117 Ca 0.09 -0.21 -0.21 0.00 0.69 0.00 0.00 54.13 54.48 1y8b s LEU 117 Cb -0.12 -0.62 -0.08 0.00 -0.43 0.00 0.00 46.19 44.94 1y8b s LEU 117 CO 0.02 0.05 0.70 -0.69 -0.29 0.00 0.00 176.35 176.13 1y8b s VAL 118 N 0.38 4.55 0.09 1.68 1.01 -1.25 -3.44 120.40 123.42 1y8b s VAL 118 Ca -0.07 1.39 0.06 0.00 0.00 0.00 0.00 61.98 63.36 1y8b s VAL 118 Cb -0.11 -3.95 -0.04 0.00 0.00 0.00 0.00 36.38 32.28 1y8b s VAL 118 CO 0.01 0.39 -0.08 0.68 0.00 0.00 0.00 175.10 176.11 1y8b s VAL 119 N -1.30 3.52 0.97 2.92 -7.23 -1.14 -4.92 120.40 113.23 1y8b s VAL 119 Ca 0.37 -1.16 -0.18 0.00 -1.81 0.00 0.00 61.98 59.20 1y8b s VAL 119 Cb -0.19 -2.64 -0.15 0.00 0.56 0.00 0.00 36.38 33.95 1y8b s VAL 119 CO 0.22 0.15 -0.91 -2.65 -0.31 0.00 0.00 175.10 171.59 1y8b n PRO 120 N 0.77 0.00 0.00 4.82 -0.02 -1.26 -3.76 135.00 135.55 1y8b n PRO 120 Ca -0.13 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.35 1y8b n PRO 120 Cb 0.52 -0.97 0.00 0.00 -0.02 0.00 0.00 33.50 33.03 1y8b n PRO 120 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1y8b n ALA 121 N -2.60 1.68 -2.92 3.55 0.00 -1.24 -4.29 120.51 114.69 1y8b n ALA 121 Ca -0.02 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.32 1y8b n ALA 121 Cb 0.58 -1.00 0.04 0.00 0.00 0.00 0.00 19.45 19.07 1y8b n ALA 121 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1y8b n MET 122 N 0.79 -3.65 -4.45 0.00 2.81 -1.26 -4.81 117.12 106.55 1y8b n MET 122 Ca 0.00 0.40 -0.25 0.00 -1.81 0.00 0.00 57.70 56.04 1y8b n MET 122 Cb 0.11 -4.13 -0.10 0.00 -0.71 0.00 0.00 33.22 28.39 1y8b n MET 122 CO 0.00 0.00 0.00 1.21 1.51 0.00 0.00 175.97 178.69 1y8b s ASN 123 N -3.32 3.92 0.59 7.83 3.84 -1.26 -4.84 114.94 121.70 1y8b s ASN 123 Ca 0.19 -1.09 0.00 0.00 0.21 0.00 0.00 52.86 52.17 1y8b s ASN 123 Cb -0.08 -0.43 0.00 0.00 -0.55 0.00 0.00 41.25 40.18 1y8b s ASN 123 CO 0.35 -0.19 0.00 0.00 -2.79 0.00 0.00 177.10 174.47 1y8b n ALA 124 N -0.85 -3.46 0.12 1.71 0.00 -1.26 -3.92 120.51 112.86 1y8b n ALA 124 Ca -0.05 0.84 -0.24 0.00 0.00 0.00 0.00 53.44 54.00 1y8b n ALA 124 Cb 0.63 -1.53 -0.15 0.00 0.00 0.00 0.00 19.45 18.39 1y8b n ALA 124 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 1y8b h ARG 125 N -1.23 0.50 -0.61 0.00 -0.00 -1.98 -3.23 114.38 107.83 1y8b h ARG 125 Ca -0.17 -0.83 0.18 0.00 -0.00 0.00 0.00 59.98 59.16 1y8b h ARG 125 Cb 1.26 0.30 -0.02 0.00 -0.00 0.00 0.00 29.97 31.51 1y8b h ARG 125 CO 0.06 1.39 0.54 1.88 -0.00 0.00 0.00 179.97 183.85 1y8b h TYR 126 N 0.04 0.00 -0.69 4.08 0.05 -2.02 0.14 116.97 118.58 1y8b h TYR 126 Ca -0.22 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.54 1y8b h TYR 126 Cb 2.02 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 39.73 1y8b h TYR 126 CO 0.14 0.00 0.36 0.00 -1.05 0.00 0.00 178.16 177.61 1y8b h ALA 127 N 1.48 0.88 -0.21 3.88 0.00 -1.67 -0.98 119.26 122.64 1y8b h ALA 127 Ca 0.29 -0.12 0.06 0.00 0.00 0.00 0.00 54.91 55.14 1y8b h ALA 127 Cb 1.37 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 1y8b h ALA 127 CO -0.00 0.42 0.40 1.25 0.00 0.00 0.00 179.25 181.32 1y8b h LEU 128 N 0.95 0.00 -0.05 0.00 6.46 -0.88 0.95 115.31 122.74 1y8b h LEU 128 Ca 0.24 0.00 -0.03 0.00 -0.12 0.00 0.00 57.88 57.97 1y8b h LEU 128 Cb 0.07 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 40.00 1y8b h LEU 128 CO -0.04 0.00 -0.14 -1.13 -0.62 0.00 0.00 178.44 176.52 1y8b h ASN 129 N 0.00 0.00 0.51 1.25 -0.00 -1.26 -3.02 115.58 113.07 1y8b h ASN 129 Ca 0.10 0.00 -0.03 0.00 -0.00 0.00 0.00 56.30 56.37 1y8b h ASN 129 Cb 0.91 0.00 0.01 0.00 -0.00 0.00 0.00 38.32 39.23 1y8b h ASN 129 CO -0.00 0.14 -0.25 0.00 -0.00 0.00 0.00 177.43 177.32 1y8b h ALA 130 N 1.86 -0.76 -0.62 1.57 0.00 0.94 -2.28 119.26 119.97 1y8b h ALA 130 Ca -0.00 -0.15 0.10 0.00 0.00 0.00 0.00 54.91 54.85 1y8b h ALA 130 Cb 1.09 0.27 -0.04 0.00 0.00 0.00 0.00 17.79 19.11 1y8b h ALA 130 CO 0.02 -0.71 0.42 0.00 0.00 0.00 0.00 179.25 178.97 1y8b h ALA 131 N -1.31 1.98 -0.04 0.00 0.00 -1.68 0.62 119.26 118.84 1y8b h ALA 131 Ca -0.07 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1y8b h ALA 131 Cb 0.53 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1y8b h ALA 131 CO 0.12 -0.11 0.00 -1.71 0.00 0.00 0.00 179.25 177.54 1y8b n ASN 132 N -4.47 0.66 -0.08 0.00 5.15 -1.14 -1.73 115.26 113.65 1y8b n ASN 132 Ca 0.10 -2.02 0.00 0.00 -0.60 0.00 0.00 54.58 52.06 1y8b n ASN 132 Cb 0.36 -0.24 0.00 0.00 -0.53 0.00 0.00 39.78 39.37 1y8b n ASN 132 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1y8b n ALA 133 N -0.20 2.25 0.31 5.20 0.00 0.22 -3.62 120.51 124.67 1y8b n ALA 133 Ca 0.01 0.00 0.19 0.00 0.00 0.00 0.00 53.44 53.64 1y8b n ALA 133 Cb 0.15 -1.00 1.02 0.00 0.00 0.00 0.00 19.45 19.62 1y8b n ALA 133 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1y8b h ARG 134 N 0.04 0.00 0.00 0.00 2.43 -1.80 -3.32 114.38 111.73 1y8b h ARG 134 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1y8b h ARG 134 Cb 0.06 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.61 1y8b h ARG 134 CO 0.00 0.02 0.00 0.91 -1.51 0.00 0.00 179.97 179.39 1y8b n TRP 135 N -3.40 0.00 0.00 2.20 8.01 -1.24 -3.52 117.44 119.49 1y8b n TRP 135 Ca -0.03 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.16 1y8b n TRP 135 Cb 0.12 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.42 1y8b n TRP 135 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1y8b n GLY 136 N 0.00 1.75 3.52 6.99 0.00 -1.23 -2.42 105.19 113.80 1y8b n GLY 136 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 1y8b n GLY 136 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1y8b n SER 137 N 0.00 -0.01 -0.17 1.61 3.41 -1.24 -3.48 113.62 113.73 1y8b n SER 137 Ca 0.00 -0.51 -0.04 0.00 -0.26 0.00 0.00 58.87 58.06 1y8b n SER 137 Cb 0.00 -0.95 0.05 0.00 -0.26 0.00 0.00 64.21 63.06 1y8b n SER 137 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1y8b h LEU 138 N 14.25 0.40 -0.89 1.04 5.85 -0.05 0.13 115.31 136.04 1y8b h LEU 138 Ca -0.02 0.03 0.23 0.00 0.84 0.00 0.00 57.88 58.96 1y8b h LEU 138 Cb 1.17 -0.05 -0.13 0.00 0.37 0.00 0.00 40.66 42.02 1y8b h LEU 138 CO 1.40 0.28 0.34 0.22 -0.34 0.00 0.00 178.44 180.34 1y8b h TYR 139 N 0.53 0.54 0.00 1.25 5.03 -1.84 1.69 116.97 124.18 1y8b h TYR 139 Ca 0.23 0.04 -0.14 0.00 2.58 0.00 0.00 58.73 61.44 1y8b h TYR 139 Cb 0.13 -0.10 -0.02 0.00 1.55 0.00 0.00 36.73 38.29 1y8b h TYR 139 CO -0.10 -0.12 -0.88 -0.44 -1.32 0.00 0.00 178.16 175.30 1y8b h ASP 140 N 0.31 0.00 1.01 -2.11 5.19 -1.68 -2.68 116.42 116.47 1y8b h ASP 140 Ca 0.56 0.00 -0.19 0.00 -0.62 0.00 0.00 57.03 56.78 1y8b h ASP 140 Cb 1.12 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 40.60 1y8b h ASP 140 CO -0.58 0.58 -1.03 0.00 -3.12 0.00 0.00 179.24 175.09 1y8b h ALA 141 N 1.42 0.53 0.00 3.45 0.00 0.24 -3.12 119.26 121.77 1y8b h ALA 141 Ca -0.06 -0.88 -0.11 0.00 0.00 0.00 0.00 54.91 53.86 1y8b h ALA 141 Cb 1.50 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.28 1y8b h ALA 141 CO 0.07 1.12 -0.63 -0.07 0.00 0.00 0.00 179.25 179.74 1y8b h LEU 142 N 0.00 0.00 -2.10 0.00 3.38 0.22 -3.33 115.31 113.48 1y8b h LEU 142 Ca -0.07 -0.63 0.08 0.00 0.09 0.00 0.00 57.88 57.35 1y8b h LEU 142 Cb 1.69 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.43 1y8b h LEU 142 CO 0.10 1.18 0.22 0.22 0.09 0.00 0.00 178.44 180.25 1y8b h TYR 143 N -1.00 0.00 -0.74 1.13 3.20 -1.64 0.04 116.97 117.96 1y8b h TYR 143 Ca -0.16 0.00 -0.44 0.00 3.14 0.00 0.00 58.73 61.27 1y8b h TYR 143 Cb 1.04 0.00 -0.22 0.00 1.54 0.00 0.00 36.73 39.09 1y8b h TYR 143 CO 0.14 0.00 0.56 0.41 -1.64 0.00 0.00 178.16 177.63 1y8b n GLY 144 N -1.52 4.36 3.34 1.82 0.00 -1.18 -4.92 105.19 107.09 1y8b n GLY 144 Ca 0.03 -1.20 -0.17 0.00 0.00 0.00 0.00 46.02 44.68 1y8b n GLY 144 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1y8b s SER 145 N -0.77 1.37 -0.15 1.61 0.15 -0.00 -4.99 113.70 110.92 1y8b s SER 145 Ca 0.45 -1.40 0.15 0.00 0.70 0.00 0.00 55.95 55.85 1y8b s SER 145 Cb 0.37 0.15 0.70 0.00 -1.71 0.00 0.00 66.02 65.53 1y8b s SER 145 CO 0.04 -0.73 1.59 -0.67 1.20 0.00 0.00 173.24 174.68 1y8b n ASP 146 N -0.53 4.81 -0.13 5.45 2.03 -1.26 -4.35 116.55 122.57 1y8b n ASP 146 Ca -0.00 -2.60 -0.12 0.00 0.52 0.00 0.00 54.79 52.59 1y8b n ASP 146 Cb 0.66 -0.61 -0.02 0.00 -0.72 0.00 0.00 41.12 40.43 1y8b n ASP 146 CO 0.00 0.00 0.00 -0.29 -1.92 0.00 0.00 177.20 174.99 1y8b h ILE 147 N 3.71 1.28 -3.61 5.18 2.10 -1.89 -3.41 117.51 120.88 1y8b h ILE 147 Ca 0.00 -1.33 -0.66 0.00 1.08 0.00 0.00 64.86 63.96 1y8b h ILE 147 Cb 1.57 1.33 -0.16 0.00 -1.09 0.00 0.00 36.82 38.47 1y8b h ILE 147 CO 0.32 0.44 -0.11 -0.63 -1.08 0.00 0.00 178.15 177.09 1y8b s ILE 148 N -4.61 5.04 1.02 2.19 1.01 -1.26 -4.97 121.20 119.63 1y8b s ILE 148 Ca -0.12 0.16 -0.21 0.00 0.00 0.00 0.00 60.65 60.48 1y8b s ILE 148 Cb 0.10 -3.97 -0.07 0.00 0.01 0.00 0.00 42.46 38.53 1y8b s ILE 148 CO 0.83 -0.25 -0.70 -2.65 0.00 0.00 0.00 174.94 172.17 1y8b n PRO 149 N 5.69 -0.46 -3.99 2.79 -0.02 -1.26 -5.03 135.00 132.72 1y8b n PRO 149 Ca -0.06 -0.12 -0.10 0.00 -2.02 0.00 0.00 63.50 61.20 1y8b n PRO 149 Cb 0.49 -1.30 -0.07 0.00 -0.02 0.00 0.00 33.50 32.59 1y8b n PRO 149 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1y8b s GLN 150 N -2.61 1.18 0.00 -0.52 -0.21 -1.26 -4.99 119.66 111.25 1y8b s GLN 150 Ca 0.45 -1.23 0.07 0.00 0.02 0.00 0.00 55.36 54.67 1y8b s GLN 150 Cb -0.06 0.37 0.40 0.00 1.00 0.00 0.00 33.01 34.72 1y8b s GLN 150 CO 0.70 -0.43 0.83 -1.91 -2.12 0.00 0.00 175.29 172.36 1y8b n GLU 151 N -0.23 0.44 -2.64 2.91 4.07 -1.26 -4.81 120.64 119.13 1y8b n GLU 151 Ca -0.06 0.00 -0.09 0.00 -0.06 0.00 0.00 57.16 56.95 1y8b n GLU 151 Cb 0.63 -1.24 0.04 0.00 -0.06 0.00 0.00 31.44 30.82 1y8b n GLU 151 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1y8b n GLY 152 N -0.09 -0.17 0.00 8.31 0.00 -1.26 -5.04 105.19 106.94 1y8b n GLY 152 Ca 0.05 0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1y8b n GLY 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y8b n ALA 153 N -2.62 0.00 0.06 4.61 0.00 -1.26 -5.08 120.51 116.23 1y8b n ALA 153 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1y8b n ALA 153 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.03 1y8b n ALA 153 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1y8b n MET 154 N 0.00 0.00 -1.56 0.00 1.56 -1.26 -4.85 117.12 111.02 1y8b n MET 154 Ca 0.00 0.00 -0.30 0.00 -0.27 0.00 0.00 57.70 57.13 1y8b n MET 154 Cb 0.00 0.00 0.08 0.00 2.15 0.00 0.00 33.22 35.45 1y8b n MET 154 CO 0.00 0.00 0.00 0.14 -0.73 0.00 0.00 175.97 175.38 1y8b s VAL 155 N -1.27 3.33 0.33 1.12 -7.23 -1.26 -5.01 120.40 110.41 1y8b s VAL 155 Ca 0.00 0.43 -0.26 0.00 -1.81 0.00 0.00 61.98 60.34 1y8b s VAL 155 Cb 0.00 -3.18 -0.10 0.00 0.56 0.00 0.00 36.38 33.67 1y8b s VAL 155 CO 0.00 -0.57 0.99 -0.55 -0.31 0.00 0.00 175.10 174.66 1y8b s SER 156 N -3.88 7.20 -0.13 4.85 0.15 -1.26 -5.05 113.70 115.59 1y8b s SER 156 Ca 0.60 1.94 -0.30 0.00 0.70 0.00 0.00 55.95 58.89 1y8b s SER 156 Cb -0.14 -2.59 0.09 0.00 -1.71 0.00 0.00 66.02 61.67 1y8b s SER 156 CO 0.54 -0.17 0.81 -0.83 1.20 0.00 0.00 173.24 174.79 1y8b s GLY 157 N -1.51 -0.45 0.16 9.45 0.00 -1.26 -5.14 107.32 108.58 1y8b s GLY 157 Ca 0.51 1.72 -0.30 0.00 0.00 0.00 0.00 44.72 46.65 1y8b s GLY 157 CO 0.27 1.14 1.10 -0.19 0.00 0.00 0.00 173.10 175.42 1y8b s TYR 158 N -0.87 3.59 -0.38 1.90 1.51 -1.26 -5.00 117.35 116.83 1y8b s TYR 158 Ca -0.06 1.58 0.03 0.00 -1.01 0.00 0.00 57.07 57.62 1y8b s TYR 158 Cb -0.01 -3.28 0.16 0.00 -0.11 0.00 0.00 41.96 38.72 1y8b s TYR 158 CO 0.05 -0.62 0.38 -0.51 -1.11 0.00 0.00 175.55 173.74 1y8b s ASP 159 N 0.01 1.19 0.34 2.29 1.01 -1.26 -4.98 116.67 115.26 1y8b s ASP 159 Ca 0.50 -1.83 0.08 0.00 0.71 0.00 0.00 52.55 52.01 1y8b s ASP 159 Cb -0.29 0.44 0.44 0.00 1.01 0.00 0.00 42.92 44.53 1y8b s ASP 159 CO 0.34 -0.24 1.09 -0.65 0.21 0.00 0.00 175.17 175.92 1y8b h PRO 160 N 6.74 0.00 0.00 8.23 0.11 -2.01 0.80 132.00 145.88 1y8b h PRO 160 Ca 0.08 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.19 1y8b h PRO 160 Cb 1.03 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.14 1y8b h PRO 160 CO 0.21 0.00 0.00 -0.56 -0.21 0.00 0.00 178.00 177.44 1y8b h GLN 161 N 0.00 0.00 0.11 1.05 -0.00 -2.00 -3.02 115.11 111.25 1y8b h GLN 161 Ca 0.00 0.00 -0.20 0.00 -0.00 0.00 0.00 58.65 58.45 1y8b h GLN 161 Cb 0.97 0.00 0.01 0.00 -0.00 0.00 0.00 27.48 28.46 1y8b h GLN 161 CO 0.00 0.00 -0.93 0.00 -0.00 0.00 0.00 178.83 177.90 1y8b h ARG 162 N 0.00 0.24 0.00 0.06 2.47 0.22 -3.24 114.38 114.12 1y8b h ARG 162 Ca 0.00 -0.40 -0.03 0.00 -1.26 0.00 0.00 59.98 58.29 1y8b h ARG 162 Cb 0.70 0.15 -0.00 0.00 -1.65 0.00 0.00 29.97 29.17 1y8b h ARG 162 CO 0.00 1.19 -0.13 0.78 0.56 0.00 0.00 179.97 182.37 1y8b h GLY 163 N -0.34 0.00 0.83 0.04 0.00 -1.67 -2.60 103.07 99.34 1y8b h GLY 163 Ca -0.19 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.07 1y8b h GLY 163 CO 0.09 0.00 -0.14 0.83 0.00 0.00 0.00 176.54 177.32 1y8b h GLU 164 N 0.00 0.48 0.00 4.80 3.07 -1.60 -2.70 114.58 118.63 1y8b h GLU 164 Ca -0.00 -0.23 -0.00 0.00 -0.50 0.00 0.00 59.36 58.63 1y8b h GLU 164 Cb 0.46 -0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 28.37 1y8b h GLU 164 CO 0.02 0.78 -0.00 0.37 -1.40 0.00 0.00 179.01 178.77 1y8b h GLN 165 N 0.18 0.00 0.00 2.33 4.15 -1.53 -2.64 115.11 117.59 1y8b h GLN 165 Ca 0.04 0.00 -0.04 0.00 0.77 0.00 0.00 58.65 59.42 1y8b h GLN 165 Cb 0.66 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.34 1y8b h GLN 165 CO 0.04 0.00 -0.20 0.28 -1.93 0.00 0.00 178.83 177.02 1y8b h VAL 166 N 0.00 0.57 0.00 2.39 2.07 -1.13 -2.44 116.25 117.70 1y8b h VAL 166 Ca -0.00 -0.97 -0.04 0.00 0.82 0.00 0.00 66.70 66.51 1y8b h VAL 166 Cb 0.58 1.65 -0.01 0.00 -1.52 0.00 0.00 31.29 31.99 1y8b h VAL 166 CO 0.00 0.20 -0.18 0.40 0.02 0.00 0.00 177.57 178.01 1y8b h ILE 167 N 0.00 0.41 0.03 4.57 5.03 -1.39 -1.80 117.51 124.36 1y8b h ILE 167 Ca -0.00 -1.09 -0.00 0.00 -0.12 0.00 0.00 64.86 63.64 1y8b h ILE 167 Cb 0.64 1.81 0.00 0.00 -3.03 0.00 0.00 36.82 36.23 1y8b h ILE 167 CO 0.03 0.18 -0.01 0.00 -0.68 0.00 0.00 178.15 177.66 1y8b h ALA 168 N 1.82 -0.04 -0.47 1.87 0.00 -1.57 -2.81 119.26 118.06 1y8b h ALA 168 Ca -0.00 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 1y8b h ALA 168 Cb 0.79 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 1y8b h ALA 168 CO 0.02 -0.05 0.23 -1.49 0.00 0.00 0.00 179.25 177.97 1y8b h TRP 169 N -0.99 0.67 0.37 0.00 4.06 -1.60 0.21 115.95 118.66 1y8b h TRP 169 Ca -0.00 -0.03 -0.01 0.00 2.06 0.00 0.00 58.89 60.90 1y8b h TRP 169 Cb 0.47 -0.21 -0.01 0.00 -1.00 0.00 0.00 29.16 28.42 1y8b h TRP 169 CO 0.12 0.52 -0.27 0.28 -3.56 0.00 0.00 178.44 175.54 1y8b h VAL 170 N 0.61 0.00 -0.64 1.49 2.07 -1.46 -0.24 116.25 118.08 1y8b h VAL 170 Ca 0.16 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.75 1y8b h VAL 170 Cb 0.10 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 29.83 1y8b h VAL 170 CO -0.02 0.00 0.42 0.03 0.02 0.00 0.00 177.57 178.02 1y8b h ARG 171 N -0.61 0.58 -0.26 1.57 2.47 -1.49 -0.03 114.38 116.60 1y8b h ARG 171 Ca -0.05 -0.03 -0.00 0.00 -1.26 0.00 0.00 59.98 58.64 1y8b h ARG 171 Cb 0.51 -0.13 -0.01 0.00 -1.65 0.00 0.00 29.97 28.68 1y8b h ARG 171 CO 0.02 0.38 0.16 -0.09 0.56 0.00 0.00 179.97 181.00 1y8b h ARG 172 N 0.59 0.35 -0.31 0.04 2.43 -0.17 -1.33 114.38 115.98 1y8b h ARG 172 Ca 0.28 -0.03 -0.13 0.00 -0.81 0.00 0.00 59.98 59.29 1y8b h ARG 172 Cb 0.33 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.80 1y8b h ARG 172 CO -0.09 0.26 -0.32 0.74 -1.51 0.00 0.00 179.97 179.06 1y8b h PHE 173 N 0.33 0.92 -0.02 2.20 0.04 -0.25 -2.63 116.94 117.52 1y8b h PHE 173 Ca 0.09 -0.28 0.01 0.00 2.80 0.00 0.00 57.97 60.59 1y8b h PHE 173 Cb 0.00 -0.19 -0.00 0.00 2.20 0.00 0.00 35.95 37.96 1y8b h PHE 173 CO -0.05 1.05 0.08 1.25 -0.60 0.00 0.00 178.31 180.03 1y8b h LEU 174 N 0.53 0.00 -0.95 1.54 5.85 -0.77 -0.26 115.31 121.25 1y8b h LEU 174 Ca 0.05 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.68 1y8b h LEU 174 Cb 0.89 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.91 1y8b h LEU 174 CO 0.08 0.00 -0.22 -0.78 -0.34 0.00 0.00 178.44 177.18 1y8b h ASP 175 N 0.00 0.51 -0.05 1.25 1.82 -0.85 -1.99 116.42 117.10 1y8b h ASP 175 Ca 0.01 -0.16 -0.20 0.00 -0.39 0.00 0.00 57.03 56.28 1y8b h ASP 175 Cb 0.16 -0.14 0.01 0.00 0.68 0.00 0.00 39.33 40.05 1y8b h ASP 175 CO -0.00 0.73 -0.76 -0.33 -1.61 0.00 0.00 179.24 177.28 1y8b h GLU 176 N 0.46 0.61 0.41 0.28 5.08 -1.14 -2.92 114.58 117.35 1y8b h GLU 176 Ca 0.07 -0.58 -0.01 0.00 -1.00 0.00 0.00 59.36 57.83 1y8b h GLU 176 Cb 0.63 0.15 -0.01 0.00 0.50 0.00 0.00 28.75 30.02 1y8b h GLU 176 CO 0.05 1.20 -0.33 0.77 -1.00 0.00 0.00 179.01 179.69 1y8b h SER 177 N 0.24 -0.88 -4.15 1.42 0.02 -1.33 -3.36 113.55 105.52 1y8b h SER 177 Ca -0.08 0.06 -0.69 0.00 -0.84 0.00 0.00 61.79 60.24 1y8b h SER 177 Cb 1.42 0.28 -0.36 0.00 0.14 0.00 0.00 62.40 63.88 1y8b h SER 177 CO 0.15 -0.46 -0.40 -0.76 -1.14 0.00 0.00 176.83 174.22 1y8b s LEU 178 N -8.08 5.13 -0.95 5.07 1.02 -0.76 -4.94 118.68 115.18 1y8b s LEU 178 Ca -0.12 -2.85 -0.24 0.00 0.02 0.00 0.00 54.13 50.94 1y8b s LEU 178 Cb 0.02 -1.83 -0.04 0.00 0.02 0.00 0.00 46.19 44.37 1y8b s LEU 178 CO 0.39 -0.36 1.89 -2.16 0.02 0.00 0.00 176.35 176.13 1y8b s PRO 179 N -0.06 2.69 0.21 1.29 0.04 -1.10 -4.65 135.00 133.41 1y8b s PRO 179 Ca 0.17 -0.48 -0.29 0.00 0.04 0.00 0.00 61.00 60.43 1y8b s PRO 179 Cb -0.21 -5.12 -0.16 0.00 0.04 0.00 0.00 34.50 29.05 1y8b s PRO 179 CO -0.03 -3.28 0.80 1.28 0.04 0.00 0.00 177.00 175.80 1y8b n LEU 180 N 13.36 0.16 -0.35 -3.56 4.77 -1.26 -4.52 117.00 125.61 1y8b n LEU 180 Ca 0.40 1.15 0.14 0.00 -0.03 0.00 0.00 56.01 57.67 1y8b n LEU 180 Cb 0.47 -1.09 0.28 0.00 -2.33 0.00 0.00 43.42 40.75 1y8b n LEU 180 CO 0.61 -2.19 0.78 -0.62 -1.33 0.00 0.00 177.39 174.65 1y8b n GLU 181 N 1.04 -0.08 -3.76 3.23 1.02 -0.57 -4.45 120.64 117.07 1y8b n GLU 181 Ca 0.15 1.50 -0.13 0.00 -0.02 0.00 0.00 57.16 58.66 1y8b n GLU 181 Cb 0.26 -2.37 -0.11 0.00 -0.02 0.00 0.00 31.44 29.20 1y8b n GLU 181 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 1y8b s ASN 182 N -5.03 -0.34 0.00 1.62 2.47 -1.26 -5.07 114.94 107.33 1y8b s ASN 182 Ca -0.13 0.65 0.00 0.00 0.42 0.00 0.00 52.86 53.80 1y8b s ASN 182 Cb 0.29 0.66 0.00 0.00 -1.45 0.00 0.00 41.25 40.75 1y8b s ASN 182 CO 0.78 -0.12 0.00 0.61 -3.72 0.00 0.00 177.10 174.65 1y8b n GLY 183 N 2.87 -2.02 3.44 1.21 0.00 -1.26 -4.86 105.19 104.57 1y8b n GLY 183 Ca -0.13 -2.17 -0.22 0.00 0.00 0.00 0.00 46.02 43.50 1y8b n GLY 183 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1y8b s SER 184 N -1.69 3.01 0.40 1.61 1.04 -1.26 -4.74 113.70 112.07 1y8b s SER 184 Ca 0.00 -1.14 0.24 0.00 0.48 0.00 0.00 55.95 55.53 1y8b s SER 184 Cb 0.00 -0.21 0.47 0.00 0.10 0.00 0.00 66.02 66.38 1y8b s SER 184 CO 0.00 -0.24 1.65 0.22 0.98 0.00 0.00 173.24 175.85 1y8b h TYR 185 N 2.28 0.00 0.00 5.02 5.03 -1.94 -3.06 116.97 124.30 1y8b h TYR 185 Ca -0.40 0.00 0.00 0.00 2.58 0.00 0.00 58.73 60.91 1y8b h TYR 185 Cb 1.24 0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.52 1y8b h TYR 185 CO 0.72 0.00 0.00 0.94 -1.32 0.00 0.00 178.16 178.50 1y8b n GLN 186 N -2.94 0.24 0.04 1.82 7.27 -1.26 -2.55 117.38 120.00 1y8b n GLN 186 Ca 0.04 0.32 0.11 0.00 0.07 0.00 0.00 57.00 57.55 1y8b n GLN 186 Cb 0.50 -1.85 -0.05 0.00 2.41 0.00 0.00 30.24 31.25 1y8b n GLN 186 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 1y8b n ASP 187 N -2.28 0.51 -4.48 1.69 8.00 -1.16 -4.89 116.55 113.95 1y8b n ASP 187 Ca 0.04 0.05 -0.28 0.00 0.71 0.00 0.00 54.79 55.31 1y8b n ASP 187 Cb 0.33 1.05 0.26 0.00 -0.02 0.00 0.00 41.12 42.74 1y8b n ASP 187 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1y8b n VAL 188 N -2.32 0.00 0.00 2.53 0.31 -1.06 0.14 118.33 117.93 1y8b n VAL 188 Ca -0.01 -0.44 0.00 0.00 -0.01 0.00 0.00 64.34 63.89 1y8b n VAL 188 Cb 0.52 -1.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.45 1y8b n VAL 188 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 1y8b n VAL 189 N -4.99 0.00 -3.62 2.52 0.24 -0.95 -4.70 118.33 106.83 1y8b n VAL 189 Ca 0.03 0.00 -0.01 0.00 -2.04 0.00 0.00 64.34 62.32 1y8b n VAL 189 Cb 0.54 0.00 -0.01 0.00 -1.47 0.00 0.00 33.84 32.90 1y8b n VAL 189 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1y8b s ALA 190 N -1.00 -2.09 0.03 2.33 0.00 -1.26 -4.21 121.76 115.56 1y8b s ALA 190 Ca 0.00 0.88 -0.00 0.00 0.00 0.00 0.00 51.96 52.84 1y8b s ALA 190 Cb 0.00 0.27 -0.02 0.00 0.00 0.00 0.00 23.12 23.37 1y8b s ALA 190 CO 0.00 -0.91 -0.03 -0.59 0.00 0.00 0.00 175.76 174.23 1y8b s PHE 191 N -2.58 0.31 0.38 0.00 -0.12 -1.26 -3.57 117.98 111.14 1y8b s PHE 191 Ca 0.12 -0.64 0.04 0.00 -0.05 0.00 0.00 56.93 56.40 1y8b s PHE 191 Cb 0.02 -0.23 -0.05 0.00 -0.63 0.00 0.00 43.02 42.13 1y8b s PHE 191 CO -0.04 -0.23 0.06 0.15 -0.05 0.00 0.00 175.22 175.11 1y8b s LYS 192 N -1.99 1.83 -0.46 1.99 -0.14 -1.25 -4.77 119.74 114.94 1y8b s LYS 192 Ca -0.11 -2.07 -0.14 0.00 -1.36 0.00 0.00 55.97 52.30 1y8b s LYS 192 Cb -0.06 -1.00 0.08 0.00 -1.68 0.00 0.00 37.83 35.17 1y8b s LYS 192 CO -0.03 -0.26 0.36 0.08 -0.76 0.00 0.00 175.35 174.75 1y8b s VAL 193 N -3.14 4.95 0.10 3.17 1.01 -0.12 -2.56 120.40 123.81 1y8b s VAL 193 Ca 0.29 -1.19 0.04 0.00 0.00 0.00 0.00 61.98 61.12 1y8b s VAL 193 Cb 0.07 -3.99 -0.04 0.00 0.00 0.00 0.00 36.38 32.42 1y8b s VAL 193 CO 0.14 -0.58 0.06 -0.69 0.00 0.00 0.00 175.10 174.04 1y8b s VAL 194 N 1.58 4.36 -0.14 2.92 1.01 -0.91 -4.59 120.40 124.63 1y8b s VAL 194 Ca 0.04 -0.90 0.00 0.00 0.00 0.00 0.00 61.98 61.12 1y8b s VAL 194 Cb -0.24 -3.12 0.00 0.00 0.00 0.00 0.00 36.38 33.02 1y8b s VAL 194 CO 0.05 0.08 0.00 0.47 0.00 0.00 0.00 175.10 175.70 1y8b n ASP 195 N 0.33 0.00 0.00 3.32 9.92 -1.26 -2.27 116.55 126.59 1y8b n ASP 195 Ca -0.09 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.17 1y8b n ASP 195 Cb 0.52 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.00 1y8b n ASP 195 CO 0.00 0.00 0.00 1.17 0.13 0.00 0.00 177.20 178.50 1y8b n LYS 196 N 0.79 0.00 -2.49 -1.24 4.81 -1.26 -5.17 118.16 113.60 1y8b n LYS 196 Ca 0.00 0.00 -0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1y8b n LYS 196 Cb 0.00 -0.01 0.01 0.00 0.02 0.00 0.00 35.03 35.05 1y8b n LYS 196 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1y8b n GLN 197 N -2.07 0.18 -2.48 1.64 -0.00 -0.96 -5.12 117.38 108.57 1y8b n GLN 197 Ca 0.00 -0.47 -0.42 0.00 -0.00 0.00 0.00 57.00 56.11 1y8b n GLN 197 Cb 0.00 0.67 -0.03 0.00 -0.00 0.00 0.00 30.24 30.88 1y8b n GLN 197 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 1y8b s LEU 198 N 0.00 4.34 -1.14 2.61 1.02 -1.25 -2.13 118.68 122.13 1y8b s LEU 198 Ca 0.10 1.90 -0.21 0.00 0.02 0.00 0.00 54.13 55.94 1y8b s LEU 198 Cb -0.01 -3.57 0.04 0.00 0.02 0.00 0.00 46.19 42.67 1y8b s LEU 198 CO 0.01 -0.48 1.64 -0.13 0.02 0.00 0.00 176.35 177.42 1y8b s ARG 199 N 1.43 3.60 -0.20 1.70 0.52 -1.06 -4.76 118.95 120.17 1y8b s ARG 199 Ca 0.57 -1.42 -0.23 0.00 -0.52 0.00 0.00 55.73 54.12 1y8b s ARG 199 Cb -0.27 -5.40 -0.02 0.00 0.52 0.00 0.00 34.95 29.78 1y8b s ARG 199 CO 0.27 -2.45 0.74 0.42 0.02 0.00 0.00 175.30 174.29 1y8b s ILE 200 N 5.50 4.93 -0.14 1.52 1.01 -1.26 -3.82 121.20 128.94 1y8b s ILE 200 Ca 0.53 1.41 -0.03 0.00 0.00 0.00 0.00 60.65 62.56 1y8b s ILE 200 Cb 0.01 -4.04 -0.03 0.00 0.01 0.00 0.00 42.46 38.41 1y8b s ILE 200 CO -0.00 0.04 -0.05 -1.10 0.00 0.00 0.00 174.94 173.83 1y8b s GLN 201 N 2.25 3.56 0.43 2.79 -0.21 -1.23 -2.61 119.66 124.62 1y8b s GLN 201 Ca 0.33 -0.54 0.01 0.00 0.02 0.00 0.00 55.36 55.18 1y8b s GLN 201 Cb -0.16 -2.86 -0.01 0.00 1.00 0.00 0.00 33.01 30.99 1y8b s GLN 201 CO 0.10 0.29 0.64 -0.51 -2.12 0.00 0.00 175.29 173.69 1y8b s LEU 202 N 0.23 3.71 0.00 2.90 1.43 -0.95 -2.23 118.68 123.77 1y8b s LEU 202 Ca -0.03 0.25 0.00 0.00 -1.03 0.00 0.00 54.13 53.32 1y8b s LEU 202 Cb -0.14 -3.13 0.00 0.00 0.03 0.00 0.00 46.19 42.95 1y8b s LEU 202 CO 0.03 -0.64 0.56 0.29 0.23 0.00 0.00 176.35 176.82 1y8b n LYS 203 N -2.01 0.00 -0.13 1.70 5.02 0.37 0.14 118.16 123.24 1y8b n LYS 203 Ca 0.01 0.15 0.07 0.00 -2.02 0.00 0.00 58.31 56.52 1y8b n LYS 203 Cb 0.58 -1.60 0.14 0.00 -0.02 0.00 0.00 35.03 34.12 1y8b n LYS 203 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1y8b n ASN 204 N -1.06 2.79 -2.10 4.39 3.02 -1.26 -4.96 115.26 116.08 1y8b n ASN 204 Ca 0.00 -1.84 -0.12 0.00 -0.03 0.00 0.00 54.58 52.59 1y8b n ASN 204 Cb 0.10 -0.18 0.04 0.00 -0.61 0.00 0.00 39.78 39.14 1y8b n ASN 204 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1y8b n GLY 205 N 0.81 0.18 3.62 7.41 0.00 0.36 -5.02 105.19 112.55 1y8b n GLY 205 Ca 0.12 -0.19 -0.32 0.00 0.00 0.00 0.00 46.02 45.63 1y8b n GLY 205 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1y8b s LYS 206 N -5.68 2.53 -0.27 1.61 2.36 -1.25 -4.84 119.74 114.20 1y8b s LYS 206 Ca 0.30 -0.76 -0.12 0.00 -2.55 0.00 0.00 55.97 52.84 1y8b s LYS 206 Cb -0.13 -2.51 -0.05 0.00 -1.05 0.00 0.00 37.83 34.09 1y8b s LYS 206 CO 0.38 0.58 0.23 -1.21 1.55 0.00 0.00 175.35 176.88 1y8b s GLU 207 N -1.67 3.99 0.47 4.03 2.02 -1.26 -2.25 118.70 124.04 1y8b s GLU 207 Ca 0.19 -0.22 0.04 0.00 0.02 0.00 0.00 54.97 55.00 1y8b s GLU 207 Cb -0.11 -3.63 -0.04 0.00 0.10 0.00 0.00 34.13 30.44 1y8b s GLU 207 CO 0.10 -0.15 0.01 -0.08 0.02 0.00 0.00 175.26 175.16 1y8b s THR 208 N 1.68 1.49 0.32 3.63 -1.32 -1.07 -5.01 115.64 115.36 1y8b s THR 208 Ca 0.09 -2.00 -0.02 0.00 -1.21 0.00 0.00 61.69 58.55 1y8b s THR 208 Cb -0.15 -2.50 -0.01 0.00 -1.51 0.00 0.00 72.50 68.32 1y8b s THR 208 CO 0.10 0.00 0.42 -0.89 -2.21 0.00 0.00 174.62 172.04 1y8b s THR 209 N -2.82 0.00 0.97 5.08 2.01 -1.26 -4.15 115.64 115.47 1y8b s THR 209 Ca 0.18 -1.66 -0.16 0.00 0.31 0.00 0.00 61.69 60.36 1y8b s THR 209 Cb 0.05 -2.56 0.20 0.00 0.01 0.00 0.00 72.50 70.20 1y8b s THR 209 CO 0.09 0.00 1.31 -0.76 -0.69 0.00 0.00 174.62 174.57 1y8b s LEU 210 N -3.22 2.61 -0.12 4.42 1.43 -1.26 -1.52 118.68 121.01 1y8b s LEU 210 Ca 0.32 0.30 -0.15 0.00 -1.03 0.00 0.00 54.13 53.56 1y8b s LEU 210 Cb 0.01 -2.33 -0.26 0.00 0.03 0.00 0.00 46.19 43.64 1y8b s LEU 210 CO 0.19 -2.79 0.46 -0.09 0.23 0.00 0.00 176.35 174.35 1y8b h ARG 211 N -1.68 0.21 -4.04 1.70 9.65 -1.93 -3.40 114.38 114.87 1y8b h ARG 211 Ca -0.44 -0.35 -0.54 0.00 -1.10 0.00 0.00 59.98 57.54 1y8b h ARG 211 Cb 1.24 0.13 -0.38 0.00 -1.39 0.00 0.00 29.97 29.57 1y8b h ARG 211 CO 0.38 1.17 -0.79 0.95 2.80 0.00 0.00 179.97 184.49 1y8b s THR 212 N -2.47 1.00 0.45 0.20 -4.23 -1.26 -4.99 115.64 104.34 1y8b s THR 212 Ca -0.22 -0.62 0.07 0.00 -1.18 0.00 0.00 61.69 59.74 1y8b s THR 212 Cb 0.05 -1.24 0.07 0.00 1.34 0.00 0.00 72.50 72.72 1y8b s THR 212 CO 0.74 0.06 1.13 -0.65 -0.54 0.00 0.00 174.62 175.36 1y8b h PRO 213 N 8.14 0.00 0.00 3.99 0.11 -2.01 -1.62 132.00 140.60 1y8b h PRO 213 Ca -0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.89 1y8b h PRO 213 Cb 1.11 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1y8b h PRO 213 CO 0.38 0.00 0.14 0.00 -0.21 0.00 0.00 178.00 178.31 1y8b n ALA 214 N -1.50 0.70 1.46 -0.75 0.00 -1.26 0.89 120.51 120.06 1y8b n ALA 214 Ca -0.00 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.58 1y8b n ALA 214 Cb 0.70 -0.62 0.58 0.00 0.00 0.00 0.00 19.45 20.10 1y8b n ALA 214 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1y8b n GLN 215 N -1.19 0.99 -2.82 0.00 3.00 -0.61 -4.66 117.38 112.08 1y8b n GLN 215 Ca 0.00 -0.44 -0.43 0.00 -0.01 0.00 0.00 57.00 56.12 1y8b n GLN 215 Cb 0.14 -1.49 -0.03 0.00 0.00 0.00 0.00 30.24 28.86 1y8b n GLN 215 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.06 177.00 1y8b s PHE 216 N -2.31 2.81 -0.21 1.08 0.40 0.26 -3.83 117.98 116.17 1y8b s PHE 216 Ca 0.32 -0.91 0.07 0.00 -0.60 0.00 0.00 56.93 55.81 1y8b s PHE 216 Cb 0.20 -4.37 -0.21 0.00 0.51 0.00 0.00 43.02 39.16 1y8b s PHE 216 CO 0.44 -1.65 -0.01 0.28 0.70 0.00 0.00 175.22 174.98 1y8b n VAL 217 N 5.91 1.50 -2.63 -0.44 0.31 -1.19 -4.65 118.33 117.14 1y8b n VAL 217 Ca 0.13 -0.68 0.00 0.00 -0.01 0.00 0.00 64.34 63.78 1y8b n VAL 217 Cb 0.48 -1.14 0.00 0.00 -0.91 0.00 0.00 33.84 32.27 1y8b n VAL 217 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1y8b n GLY 218 N 2.03 -1.85 3.84 2.92 0.00 -1.21 -3.38 105.19 107.54 1y8b n GLY 218 Ca -0.38 -1.23 -0.06 0.00 0.00 0.00 0.00 46.02 44.35 1y8b n GLY 218 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1y8b s TYR 219 N -2.67 0.09 0.14 1.61 1.13 0.39 -0.79 117.35 117.25 1y8b s TYR 219 Ca 0.00 -0.64 0.07 0.00 -1.41 0.00 0.00 57.07 55.10 1y8b s TYR 219 Cb 0.00 0.77 -0.04 0.00 -1.10 0.00 0.00 41.96 41.59 1y8b s TYR 219 CO 0.00 -1.25 -0.16 0.50 -2.51 0.00 0.00 175.55 172.12 1y8b s ARG 220 N -2.25 1.13 0.52 -3.49 6.06 -0.53 0.24 118.95 120.64 1y8b s ARG 220 Ca 0.19 -1.30 0.00 0.00 -2.50 0.00 0.00 55.73 52.12 1y8b s ARG 220 Cb -0.04 -1.13 0.00 0.00 0.06 0.00 0.00 34.95 33.84 1y8b s ARG 220 CO 0.08 0.23 0.00 0.41 -2.50 0.00 0.00 175.30 173.52 1y8b n GLY 221 N 0.50 -1.89 3.86 8.12 0.00 -1.26 -1.28 105.19 113.23 1y8b n GLY 221 Ca -0.15 -1.74 -0.32 0.00 0.00 0.00 0.00 46.02 43.82 1y8b n GLY 221 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1y8b s ASP 222 N -4.00 6.44 0.43 1.61 1.11 -0.57 -4.82 116.67 116.87 1y8b s ASP 222 Ca 0.00 1.48 0.17 0.00 0.18 0.00 0.00 52.55 54.38 1y8b s ASP 222 Cb 0.00 -2.48 1.09 0.00 1.07 0.00 0.00 42.92 42.59 1y8b s ASP 222 CO 0.00 -0.71 1.91 0.00 1.18 0.00 0.00 175.17 177.55 1y8b h ALA 223 N 0.38 2.17 -0.09 5.23 0.00 -1.91 0.61 119.26 125.65 1y8b h ALA 223 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1y8b h ALA 223 Cb 1.19 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1y8b h ALA 223 CO 0.62 -0.39 0.00 0.00 0.00 0.00 0.00 179.25 179.47 1y8b n ALA 224 N -2.53 2.51 -3.24 0.00 0.00 -1.26 -0.94 120.51 115.05 1y8b n ALA 224 Ca 0.15 -0.59 -0.24 0.00 0.00 0.00 0.00 53.44 52.76 1y8b n ALA 224 Cb 0.58 -1.02 -0.08 0.00 0.00 0.00 0.00 19.45 18.94 1y8b n ALA 224 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1y8b n ALA 225 N 0.69 2.35 -2.34 0.00 0.00 0.21 -4.93 120.51 116.49 1y8b n ALA 225 Ca 0.17 -3.15 -0.35 0.00 0.00 0.00 0.00 53.44 50.11 1y8b n ALA 225 Cb 0.45 -0.82 -0.04 0.00 0.00 0.00 0.00 19.45 19.04 1y8b n ALA 225 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1y8b s PRO 226 N -0.58 3.19 0.00 0.00 0.04 -1.10 -1.52 135.00 135.04 1y8b s PRO 226 Ca 0.34 -0.98 0.08 0.00 0.04 0.00 0.00 61.00 60.47 1y8b s PRO 226 Cb 0.12 -5.28 0.45 0.00 0.04 0.00 0.00 34.50 29.83 1y8b s PRO 226 CO -0.15 -2.79 0.86 0.25 0.04 0.00 0.00 177.00 175.21 1y8b n THR 227 N 7.24 0.00 -3.63 1.26 -2.24 -0.41 -4.65 114.28 111.85 1y8b n THR 227 Ca 0.39 0.00 -0.05 0.00 -2.27 0.00 0.00 64.05 62.12 1y8b n THR 227 Cb 0.48 -0.67 -0.06 0.00 -2.10 0.00 0.00 70.33 67.99 1y8b n THR 227 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1y8b s ILE 229 N -0.53 1.97 -0.23 0.00 1.10 -0.84 -1.45 121.20 121.21 1y8b s ILE 229 Ca 0.06 -1.06 -0.04 0.00 -0.51 0.00 0.00 60.65 59.10 1y8b s ILE 229 Cb -0.03 -1.64 -0.00 0.00 0.15 0.00 0.00 42.46 40.94 1y8b s ILE 229 CO -0.09 0.55 -0.03 -0.22 -2.11 0.00 0.00 174.94 173.05 1y8b s LEU 230 N -0.50 3.04 0.06 8.50 2.96 0.02 -2.45 118.68 130.32 1y8b s LEU 230 Ca 0.07 -0.50 0.02 0.00 -0.22 0.00 0.00 54.13 53.51 1y8b s LEU 230 Cb -0.10 -1.74 -0.03 0.00 0.50 0.00 0.00 46.19 44.81 1y8b s LEU 230 CO -0.00 -0.05 -0.08 -0.76 -1.32 0.00 0.00 176.35 174.14 1y8b s LEU 231 N 1.46 2.34 -0.02 -0.68 1.43 0.65 -3.18 118.68 120.68 1y8b s LEU 231 Ca 0.05 -0.71 0.02 0.00 -1.03 0.00 0.00 54.13 52.46 1y8b s LEU 231 Cb -0.15 -0.14 0.00 0.00 0.03 0.00 0.00 46.19 45.93 1y8b s LEU 231 CO -0.03 -0.29 -0.07 -1.59 0.23 0.00 0.00 176.35 174.60 1y8b s LYS 232 N -2.35 0.77 -0.14 1.70 0.00 -1.25 0.15 119.74 118.62 1y8b s LYS 232 Ca -0.02 -0.25 -0.08 0.00 0.00 0.00 0.00 55.97 55.62 1y8b s LYS 232 Cb -0.05 -0.74 0.05 0.00 0.00 0.00 0.00 37.83 37.09 1y8b s LYS 232 CO -0.01 0.10 0.33 1.21 0.00 0.00 0.00 175.35 176.98 1y8b s ASN 233 N 0.15 -0.39 -0.52 0.03 2.47 -0.26 -4.61 114.94 111.81 1y8b s ASN 233 Ca -0.02 0.71 0.00 0.00 0.42 0.00 0.00 52.86 53.97 1y8b s ASN 233 Cb -0.07 0.61 0.00 0.00 -1.45 0.00 0.00 41.25 40.34 1y8b s ASN 233 CO 0.00 -0.17 0.00 -3.20 -3.72 0.00 0.00 177.10 170.01 1y8b n ASN 234 N 4.06 -4.45 0.00 -4.21 4.05 -1.26 -2.03 115.26 111.42 1y8b n ASN 234 Ca -0.23 0.12 0.00 0.00 0.45 0.00 0.00 54.58 54.92 1y8b n ASN 234 Cb 0.55 -2.38 0.00 0.00 1.23 0.00 0.00 39.78 39.17 1y8b n ASN 234 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1y8b n GLY 235 N -1.24 3.08 3.82 8.20 0.00 -1.26 -4.69 105.19 113.09 1y8b n GLY 235 Ca -0.05 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.61 1y8b n GLY 235 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1y8b s LEU 236 N 0.00 4.32 0.01 0.99 1.43 -0.86 -4.04 118.68 120.53 1y8b s LEU 236 Ca 0.00 1.36 -0.16 0.00 -1.03 0.00 0.00 54.13 54.31 1y8b s LEU 236 Cb 0.00 -3.59 -0.06 0.00 0.03 0.00 0.00 46.19 42.57 1y8b s LEU 236 CO 0.00 0.02 0.44 -1.00 0.23 0.00 0.00 176.35 176.04 1y8b s HIS 237 N -1.56 3.74 -0.05 0.29 3.76 -1.26 -1.10 115.29 119.10 1y8b s HIS 237 Ca 0.43 1.04 0.04 0.00 -0.15 0.00 0.00 55.06 56.42 1y8b s HIS 237 Cb -0.16 -2.33 0.00 0.00 1.11 0.00 0.00 32.58 31.20 1y8b s HIS 237 CO 0.20 0.63 -0.16 0.42 -0.85 0.00 0.00 174.74 174.98 1y8b s ILE 238 N -1.05 1.41 -0.02 0.60 1.01 0.40 -2.05 121.20 121.50 1y8b s ILE 238 Ca 0.25 -0.68 0.00 0.00 0.00 0.00 0.00 60.65 60.22 1y8b s ILE 238 Cb -0.17 -1.23 0.02 0.00 0.01 0.00 0.00 42.46 41.09 1y8b s ILE 238 CO 0.14 0.41 0.01 -1.61 0.00 0.00 0.00 174.94 173.89 1y8b s GLU 239 N 0.24 0.12 -0.09 2.79 2.02 0.41 -0.26 118.70 123.93 1y8b s GLU 239 Ca -0.08 0.11 -0.04 0.00 0.02 0.00 0.00 54.97 54.97 1y8b s GLU 239 Cb -0.13 -0.32 -0.04 0.00 0.10 0.00 0.00 34.13 33.74 1y8b s GLU 239 CO 0.03 -0.12 0.07 -0.51 0.02 0.00 0.00 175.26 174.75 1y8b s LEU 240 N 0.88 3.96 -0.29 1.80 1.43 -1.03 0.16 118.68 125.59 1y8b s LEU 240 Ca -0.08 0.29 0.00 0.00 -1.03 0.00 0.00 54.13 53.31 1y8b s LEU 240 Cb -0.11 -1.97 0.09 0.00 0.03 0.00 0.00 46.19 44.22 1y8b s LEU 240 CO -0.02 0.38 0.05 -1.58 0.23 0.00 0.00 176.35 175.41 1y8b s GLN 241 N -1.03 1.07 -0.04 1.70 0.74 0.17 -1.99 119.66 120.28 1y8b s GLN 241 Ca 0.15 -1.14 -0.30 0.00 0.05 0.00 0.00 55.36 54.13 1y8b s GLN 241 Cb -0.12 -2.38 -0.07 0.00 1.10 0.00 0.00 33.01 31.55 1y8b s GLN 241 CO 0.04 -0.85 1.88 0.42 -0.55 0.00 0.00 175.29 176.23 1y8b s ILE 242 N 1.45 3.24 -0.30 -2.34 1.09 -1.24 -3.47 121.20 119.63 1y8b s ILE 242 Ca 0.05 0.28 -0.13 0.00 -1.10 0.00 0.00 60.65 59.75 1y8b s ILE 242 Cb -0.18 -3.20 0.16 0.00 -1.06 0.00 0.00 42.46 38.18 1y8b s ILE 242 CO -0.16 -0.05 0.91 1.51 -0.10 0.00 0.00 174.94 177.05 1y8b s ASP 243 N 4.58 -0.73 -0.00 3.58 1.47 -1.26 -4.94 116.67 119.37 1y8b s ASP 243 Ca 0.84 0.88 -0.14 0.00 1.18 0.00 0.00 52.55 55.32 1y8b s ASP 243 Cb -0.37 1.78 -0.08 0.00 -0.34 0.00 0.00 42.92 43.91 1y8b s ASP 243 CO 0.36 -0.14 0.81 0.00 0.68 0.00 0.00 175.17 176.89 1y8b h ALA 244 N 7.68 -0.74 0.00 2.11 0.00 -1.91 -3.41 119.26 122.99 1y8b h ALA 244 Ca -0.16 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1y8b h ALA 244 Cb 1.12 0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1y8b h ALA 244 CO 0.08 -0.70 0.00 -1.71 0.00 0.00 0.00 179.25 176.92 1y8b n ASN 245 N -4.01 0.00 -4.46 0.00 5.15 -1.26 -4.66 115.26 106.01 1y8b n ASN 245 Ca -0.06 0.00 -0.25 0.00 -0.60 0.00 0.00 54.58 53.67 1y8b n ASN 245 Cb 0.20 0.00 -0.10 0.00 -0.53 0.00 0.00 39.78 39.34 1y8b n ASN 245 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 1y8b s GLY 246 N 0.00 1.82 0.54 8.20 0.00 -1.26 -5.01 107.32 111.60 1y8b s GLY 246 Ca 0.00 -1.78 0.32 0.00 0.00 0.00 0.00 44.72 43.26 1y8b s GLY 246 CO 0.00 -1.85 2.02 0.07 0.00 0.00 0.00 173.10 173.34 1y8b h ARG 247 N 2.58 0.00 -0.30 2.90 0.11 -2.03 -2.87 114.38 114.77 1y8b h ARG 247 Ca -0.42 0.00 -0.08 0.00 0.10 0.00 0.00 59.98 59.58 1y8b h ARG 247 Cb 1.24 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.31 1y8b h ARG 247 CO 0.56 0.07 -0.12 -0.84 0.10 0.00 0.00 179.97 179.74 1y8b h ILE 248 N 0.00 1.29 0.00 0.08 -0.00 -1.95 -2.57 117.51 114.36 1y8b h ILE 248 Ca -0.00 -1.20 0.00 0.00 -0.00 0.00 0.00 64.86 63.66 1y8b h ILE 248 Cb 0.47 1.43 0.00 0.00 -0.00 0.00 0.00 36.82 38.71 1y8b h ILE 248 CO 0.01 0.38 0.57 1.23 -0.00 0.00 0.00 178.15 180.34 1y8b h GLY 249 N 0.38 0.00 0.95 0.16 0.00 -1.77 0.29 103.07 103.08 1y8b h GLY 249 Ca 0.07 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.37 1y8b h GLY 249 CO 0.04 0.00 0.16 0.50 0.00 0.00 0.00 176.54 177.24 1y8b h LYS 250 N 0.00 0.67 -1.24 4.80 1.79 -1.63 -2.32 116.57 118.65 1y8b h LYS 250 Ca 0.00 -0.13 -0.26 0.00 -2.18 0.00 0.00 60.65 58.08 1y8b h LYS 250 Cb 1.14 -0.10 -0.13 0.00 -1.58 0.00 0.00 32.23 31.55 1y8b h LYS 250 CO 0.00 0.63 0.33 -0.25 -1.08 0.00 0.00 179.45 179.08 1y8b n ASP 251 N -4.59 4.64 -4.60 0.86 9.92 0.10 -4.88 116.55 118.01 1y8b n ASP 251 Ca 0.01 -2.84 -0.42 0.00 -0.53 0.00 0.00 54.79 51.01 1y8b n ASP 251 Cb 0.16 -0.83 -0.05 0.00 -0.64 0.00 0.00 41.12 39.77 1y8b n ASP 251 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1y8b s ASP 252 N 0.13 6.62 0.00 -2.24 2.15 -0.88 -4.91 116.67 117.54 1y8b s ASP 252 Ca 0.27 0.53 0.03 0.00 0.43 0.00 0.00 52.55 53.80 1y8b s ASP 252 Cb 0.22 -2.41 0.15 0.00 -0.30 0.00 0.00 42.92 40.58 1y8b s ASP 252 CO 0.03 -0.68 1.06 -0.81 -0.17 0.00 0.00 175.17 174.60 1y8b n PRO 253 N 6.33 0.96 0.00 4.34 -0.04 -1.26 -3.16 135.00 142.17 1y8b n PRO 253 Ca 0.04 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.50 1y8b n PRO 253 Cb 0.48 -1.04 0.00 0.00 -0.04 0.00 0.00 33.50 32.90 1y8b n PRO 253 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1y8b n ALA 254 N -0.54 1.03 0.00 0.55 0.00 -1.26 -4.75 120.51 115.54 1y8b n ALA 254 Ca 0.02 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1y8b n ALA 254 Cb 0.01 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.46 1y8b n ALA 254 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1y8b n HIS 255 N -0.29 0.00 -2.25 0.00 -0.00 -1.19 -4.42 115.22 107.07 1y8b n HIS 255 Ca 0.00 0.00 -0.37 0.00 0.46 0.00 0.00 57.72 57.81 1y8b n HIS 255 Cb 0.05 0.00 -0.01 0.00 -0.12 0.00 0.00 29.99 29.92 1y8b n HIS 255 CO 0.00 0.00 0.00 0.42 0.46 0.00 0.00 176.34 177.22 1y8b s ILE 256 N 0.00 3.09 0.00 3.57 1.01 -1.26 -4.31 121.20 123.30 1y8b s ILE 256 Ca 0.00 0.80 0.00 0.00 0.00 0.00 0.00 60.65 61.45 1y8b s ILE 256 Cb 0.00 -3.40 0.00 0.00 0.01 0.00 0.00 42.46 39.07 1y8b s ILE 256 CO 0.00 -0.03 0.31 0.59 0.00 0.00 0.00 174.94 175.81 1y8b n ASN 257 N -0.60 0.00 -3.25 3.58 4.13 -1.26 -4.90 115.26 112.96 1y8b n ASN 257 Ca 0.08 -1.09 -0.03 0.00 1.68 0.00 0.00 54.58 55.22 1y8b n ASN 257 Cb 0.48 -0.02 -0.04 0.00 -1.54 0.00 0.00 39.78 38.66 1y8b n ASN 257 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1y8b s ASP 258 N -0.09 -0.58 -0.26 6.41 2.15 -1.23 -4.84 116.67 118.24 1y8b s ASP 258 Ca 0.00 0.46 -0.14 0.00 0.43 0.00 0.00 52.55 53.30 1y8b s ASP 258 Cb 0.00 1.63 -0.04 0.00 -0.30 0.00 0.00 42.92 44.21 1y8b s ASP 258 CO 0.00 -0.29 0.32 -0.69 -0.17 0.00 0.00 175.17 174.35 1y8b s VAL 259 N 2.70 5.22 -0.17 1.11 1.01 -1.26 -0.65 120.40 128.36 1y8b s VAL 259 Ca 0.16 0.48 -0.03 0.00 0.00 0.00 0.00 61.98 62.59 1y8b s VAL 259 Cb -0.15 -3.65 -0.02 0.00 0.00 0.00 0.00 36.38 32.56 1y8b s VAL 259 CO -0.20 0.21 -0.05 -0.63 0.00 0.00 0.00 175.10 174.43 1y8b s ILE 260 N 1.77 3.63 0.03 2.22 1.09 0.41 0.74 121.20 131.09 1y8b s ILE 260 Ca 0.13 -0.44 0.03 0.00 -1.10 0.00 0.00 60.65 59.28 1y8b s ILE 260 Cb -0.15 -2.60 -0.02 0.00 -1.06 0.00 0.00 42.46 38.63 1y8b s ILE 260 CO 0.09 0.47 -0.09 0.68 -0.10 0.00 0.00 174.94 175.99 1y8b s VAL 261 N 0.70 0.71 -0.50 2.92 -7.23 -1.01 0.15 120.40 116.14 1y8b s VAL 261 Ca -0.03 -0.79 -0.27 0.00 -1.81 0.00 0.00 61.98 59.09 1y8b s VAL 261 Cb -0.15 -0.68 -0.04 0.00 0.56 0.00 0.00 36.38 36.08 1y8b s VAL 261 CO 0.02 -0.09 2.06 -0.70 -0.31 0.00 0.00 175.10 176.09 1y8b s GLU 262 N -0.97 2.59 -0.08 4.82 2.12 -0.87 -3.50 118.70 122.81 1y8b s GLU 262 Ca -0.02 1.11 -0.01 0.00 0.36 0.00 0.00 54.97 56.41 1y8b s GLU 262 Cb -0.07 -4.42 -0.01 0.00 0.26 0.00 0.00 34.13 29.89 1y8b s GLU 262 CO 0.00 -2.74 0.06 0.00 -0.54 0.00 0.00 175.26 172.05 1y8b h ALA 263 N 16.23 -0.05 -2.51 6.30 0.00 -1.71 -3.43 119.26 134.10 1y8b h ALA 263 Ca -0.28 -0.01 -0.77 0.00 0.00 0.00 0.00 54.91 53.85 1y8b h ALA 263 Cb 1.20 0.02 -0.25 0.00 0.00 0.00 0.00 17.79 18.76 1y8b h ALA 263 CO 1.15 -0.05 -0.07 0.00 0.00 0.00 0.00 179.25 180.28 1y8b s ALA 264 N -2.74 3.86 0.32 0.00 0.00 -1.26 -4.21 121.76 117.73 1y8b s ALA 264 Ca -0.01 -2.96 0.11 0.00 0.00 0.00 0.00 51.96 49.10 1y8b s ALA 264 Cb 0.00 -3.37 0.54 0.00 0.00 0.00 0.00 23.12 20.29 1y8b s ALA 264 CO 0.02 -2.15 1.72 0.82 0.00 0.00 0.00 175.76 176.17 1y8b h ILE 265 N 5.31 1.34 -2.93 0.00 1.08 -1.82 -3.41 117.51 117.08 1y8b h ILE 265 Ca -0.08 -1.63 -0.17 0.00 -0.39 0.00 0.00 64.86 62.59 1y8b h ILE 265 Cb 1.06 1.86 -0.28 0.00 -3.07 0.00 0.00 36.82 36.39 1y8b h ILE 265 CO 0.88 0.47 -0.42 -0.44 -0.69 0.00 0.00 178.15 177.95 1y8b s SER 266 N -6.90 -0.34 0.04 1.72 0.01 -1.26 -3.59 113.70 103.38 1y8b s SER 266 Ca -0.03 0.63 0.07 0.00 1.31 0.00 0.00 55.95 57.93 1y8b s SER 266 Cb 0.14 0.53 -0.02 0.00 0.21 0.00 0.00 66.02 66.87 1y8b s SER 266 CO 0.75 -0.16 -0.19 0.42 0.41 0.00 0.00 173.24 174.46 1y8b s THR 267 N 1.11 1.56 -0.23 1.44 -4.23 -1.16 -3.16 115.64 110.97 1y8b s THR 267 Ca -0.08 -1.14 -0.10 0.00 -1.18 0.00 0.00 61.69 59.19 1y8b s THR 267 Cb -0.08 -1.36 -0.05 0.00 1.34 0.00 0.00 72.50 72.34 1y8b s THR 267 CO -0.08 0.18 0.15 -0.63 -0.54 0.00 0.00 174.62 173.70 1y8b s ILE 268 N -0.79 5.30 0.06 2.99 -1.09 -1.22 -1.62 121.20 124.82 1y8b s ILE 268 Ca 0.06 0.16 -0.25 0.00 -2.23 0.00 0.00 60.65 58.39 1y8b s ILE 268 Cb -0.09 -3.46 -0.06 0.00 -1.58 0.00 0.00 42.46 37.28 1y8b s ILE 268 CO 0.02 0.36 0.77 -0.76 -1.23 0.00 0.00 174.94 174.10 1y8b s LEU 269 N 0.95 4.46 -0.76 2.97 1.43 -0.42 -2.89 118.68 124.43 1y8b s LEU 269 Ca 0.07 1.48 -0.12 0.00 -1.03 0.00 0.00 54.13 54.52 1y8b s LEU 269 Cb -0.13 -3.25 0.20 0.00 0.03 0.00 0.00 46.19 43.04 1y8b s LEU 269 CO 0.03 0.03 0.68 -1.81 0.23 0.00 0.00 176.35 175.52 1y8b s ASP 270 N -0.16 6.45 0.00 2.29 1.01 -1.25 -3.60 116.67 121.42 1y8b s ASP 270 Ca 0.38 -2.61 0.00 0.00 0.71 0.00 0.00 52.55 51.04 1y8b s ASP 270 Cb -0.21 -2.15 0.00 0.00 1.01 0.00 0.00 42.92 41.57 1y8b s ASP 270 CO 0.23 -0.57 0.22 0.00 0.21 0.00 0.00 175.17 175.26 1y8b n GLU 272 N -0.46 0.00 -0.26 0.00 -0.58 -1.26 -4.95 120.64 113.13 1y8b n GLU 272 Ca 0.00 0.00 -0.01 0.00 -0.42 0.00 0.00 57.16 56.73 1y8b n GLU 272 Cb 0.00 0.00 0.05 0.00 -0.57 0.00 0.00 31.44 30.92 1y8b n GLU 272 CO 0.00 0.00 0.00 -0.44 -0.48 0.00 0.00 177.13 176.21 1y8b h ASP 273 N 0.00 -1.01 0.43 1.62 3.32 -1.92 -2.64 116.42 116.22 1y8b h ASP 273 Ca 0.00 0.24 -0.02 0.00 0.02 0.00 0.00 57.03 57.27 1y8b h ASP 273 Cb 0.00 0.56 0.00 0.00 0.22 0.00 0.00 39.33 40.12 1y8b h ASP 273 CO 0.00 -0.28 -0.20 -1.28 -1.72 0.00 0.00 179.24 175.75 1y8b h SER 274 N -0.07 -0.48 -3.59 6.45 0.87 -1.95 -3.41 113.55 111.37 1y8b h SER 274 Ca 0.31 -0.02 -0.64 0.00 -1.23 0.00 0.00 61.79 60.22 1y8b h SER 274 Cb 0.57 0.13 -0.14 0.00 -0.44 0.00 0.00 62.40 62.51 1y8b h SER 274 CO -0.78 -0.05 0.21 -0.69 -0.53 0.00 0.00 176.83 174.98 1y8b s VAL 275 N -3.54 4.79 -0.73 2.23 1.01 -1.00 -4.95 120.40 118.21 1y8b s VAL 275 Ca -0.09 0.38 -0.26 0.00 0.00 0.00 0.00 61.98 62.00 1y8b s VAL 275 Cb 0.01 -4.20 0.04 0.00 0.00 0.00 0.00 36.38 32.22 1y8b s VAL 275 CO 0.29 -0.54 1.23 0.00 0.00 0.00 0.00 175.10 176.07 1y8b s ALA 276 N 2.93 2.81 -0.06 5.51 0.00 -1.23 -4.35 121.76 127.37 1y8b s ALA 276 Ca 0.26 -1.46 -0.08 0.00 0.00 0.00 0.00 51.96 50.68 1y8b s ALA 276 Cb -0.14 -4.19 0.02 0.00 0.00 0.00 0.00 23.12 18.81 1y8b s ALA 276 CO 0.19 -3.20 0.20 0.00 0.00 0.00 0.00 175.76 172.94 1y8b s ALA 277 N 5.45 -0.48 -0.31 0.00 0.00 -1.26 -4.95 121.76 120.21 1y8b s ALA 277 Ca 0.33 0.41 0.06 0.00 0.00 0.00 0.00 51.96 52.76 1y8b s ALA 277 Cb -0.09 -0.22 0.20 0.00 0.00 0.00 0.00 23.12 23.00 1y8b s ALA 277 CO 0.14 -0.13 0.60 0.14 0.00 0.00 0.00 175.76 176.52 1y8b s VAL 278 N -0.28 -0.98 0.01 0.00 -7.23 -1.26 -4.89 120.40 105.76 1y8b s VAL 278 Ca -0.04 0.00 -0.20 0.00 -1.81 0.00 0.00 61.98 59.93 1y8b s VAL 278 Cb -0.03 -0.86 0.04 0.00 0.56 0.00 0.00 36.38 36.09 1y8b s VAL 278 CO 0.01 0.00 0.44 -0.62 -0.31 0.00 0.00 175.10 174.62 1y8b s ASP 279 N 2.71 -0.34 0.11 4.85 -1.08 -1.26 -4.93 116.67 116.74 1y8b s ASP 279 Ca 0.11 0.16 -0.27 0.00 -0.52 0.00 0.00 52.55 52.04 1y8b s ASP 279 Cb -0.09 0.42 -0.08 0.00 -1.46 0.00 0.00 42.92 41.70 1y8b s ASP 279 CO -0.24 -0.60 1.64 0.00 0.52 0.00 0.00 175.17 176.50 1y8b h ALA 280 N 3.24 -0.44 0.13 3.66 0.00 -1.96 -0.22 119.26 123.67 1y8b h ALA 280 Ca -0.30 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 1y8b h ALA 280 Cb 1.19 0.43 0.00 0.00 0.00 0.00 0.00 17.79 19.40 1y8b h ALA 280 CO 0.41 -0.80 -0.06 0.93 0.00 0.00 0.00 179.25 179.73 1y8b h GLU 281 N -0.47 -0.17 -0.34 0.00 5.08 -1.97 -3.32 114.58 113.40 1y8b h GLU 281 Ca 0.03 0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.44 1y8b h GLU 281 Cb 0.50 0.04 -0.07 0.00 0.50 0.00 0.00 28.75 29.72 1y8b h GLU 281 CO -0.16 0.21 -0.46 -0.44 -1.00 0.00 0.00 179.01 177.17 1y8b h ASP 282 N -0.96 -1.52 -1.73 1.42 5.19 -1.95 0.38 116.42 117.24 1y8b h ASP 282 Ca -0.02 0.20 0.50 0.00 -0.62 0.00 0.00 57.03 57.09 1y8b h ASP 282 Cb 0.46 0.62 -0.07 0.00 0.18 0.00 0.00 39.33 40.52 1y8b h ASP 282 CO 0.03 -0.33 1.37 1.17 -3.12 0.00 0.00 179.24 178.37 1y8b n LYS 283 N -4.87 0.00 0.08 3.56 3.00 -0.10 0.27 118.16 120.11 1y8b n LYS 283 Ca -0.03 1.06 -0.10 0.00 -0.00 0.00 0.00 58.31 59.25 1y8b n LYS 283 Cb 0.28 -2.51 -0.10 0.00 0.00 0.00 0.00 35.03 32.70 1y8b n LYS 283 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.40 178.22 1y8b h ILE 284 N 0.00 1.61 0.00 3.15 2.04 -0.35 -1.68 117.51 122.29 1y8b h ILE 284 Ca 0.82 -3.15 -0.09 0.00 1.00 0.00 0.00 64.86 63.44 1y8b h ILE 284 Cb 3.56 2.79 -0.01 0.00 -0.74 0.00 0.00 36.82 42.42 1y8b h ILE 284 CO -0.01 0.91 -0.44 0.25 0.00 0.00 0.00 178.15 178.86 1y8b h LEU 285 N 0.04 0.00 0.00 1.44 7.12 0.42 -1.57 115.31 122.76 1y8b h LEU 285 Ca -0.05 0.00 -0.06 0.00 0.13 0.00 0.00 57.88 57.90 1y8b h LEU 285 Cb 1.76 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 41.88 1y8b h LEU 285 CO 0.15 0.44 -0.38 0.25 -0.13 0.00 0.00 178.44 178.77 1y8b h LEU 286 N 0.00 0.00 -2.58 2.25 5.85 -1.42 -3.30 115.31 116.11 1y8b h LEU 286 Ca -0.00 -0.55 0.00 0.00 0.84 0.00 0.00 57.88 58.17 1y8b h LEU 286 Cb 0.79 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.82 1y8b h LEU 286 CO 0.06 0.99 0.11 0.22 -0.34 0.00 0.00 178.44 179.48 1y8b h TYR 287 N -1.00 0.00 -0.75 1.25 3.20 -1.34 -1.54 116.97 116.80 1y8b h TYR 287 Ca -0.09 0.00 0.07 0.00 3.14 0.00 0.00 58.73 61.85 1y8b h TYR 287 Cb 0.81 0.00 -0.05 0.00 1.54 0.00 0.00 36.73 39.03 1y8b h TYR 287 CO 0.11 0.00 0.49 -0.09 -1.64 0.00 0.00 178.16 177.04 1y8b h ARG 288 N 0.00 0.74 0.12 1.82 2.43 -1.36 -0.79 114.38 117.34 1y8b h ARG 288 Ca 0.00 -0.04 -0.31 0.00 -0.81 0.00 0.00 59.98 58.81 1y8b h ARG 288 Cb 0.22 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.59 1y8b h ARG 288 CO 0.00 0.49 -1.60 -0.91 -1.51 0.00 0.00 179.97 176.44 1y8b h ASN 289 N 0.76 0.39 -0.04 -3.80 2.35 -1.46 -2.96 115.58 110.82 1y8b h ASN 289 Ca 0.33 -0.58 -0.00 0.00 -0.55 0.00 0.00 56.30 55.50 1y8b h ASN 289 Cb 0.29 -0.13 -0.00 0.00 0.05 0.00 0.00 38.32 38.54 1y8b h ASN 289 CO -0.11 1.49 0.02 -0.07 -1.65 0.00 0.00 177.43 177.10 1y8b h LEU 290 N 0.07 0.05 -0.95 1.61 -0.00 -1.45 2.16 115.31 116.80 1y8b h LEU 290 Ca -0.27 -0.16 -0.10 0.00 -0.00 0.00 0.00 57.88 57.35 1y8b h LEU 290 Cb 2.03 -0.01 -0.01 0.00 -0.00 0.00 0.00 40.66 42.66 1y8b h LEU 290 CO 0.15 0.20 -0.27 0.25 -0.00 0.00 0.00 178.44 178.78 1y8b h LEU 291 N -0.10 0.45 0.04 1.67 6.46 -1.31 -2.93 115.31 119.59 1y8b h LEU 291 Ca 0.01 -0.16 -0.25 0.00 -0.12 0.00 0.00 57.88 57.37 1y8b h LEU 291 Cb 0.17 -0.12 -0.02 0.00 -0.73 0.00 0.00 40.66 39.95 1y8b h LEU 291 CO -0.00 0.71 -1.25 1.23 -0.62 0.00 0.00 178.44 178.51 1y8b h GLY 292 N 1.03 0.10 -0.52 3.75 0.00 -1.33 -3.29 103.07 102.81 1y8b h GLY 292 Ca 0.06 -0.25 0.27 0.00 0.00 0.00 0.00 47.33 47.41 1y8b h GLY 292 CO 0.05 0.22 1.00 -2.00 0.00 0.00 0.00 176.54 175.81 1y8b h LEU 293 N 0.02 0.00 0.00 3.11 6.46 0.38 2.13 115.31 127.40 1y8b h LEU 293 Ca -0.12 0.00 -0.02 0.00 -0.12 0.00 0.00 57.88 57.62 1y8b h LEU 293 Cb 1.89 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 41.81 1y8b h LEU 293 CO 0.14 0.00 -0.27 -0.03 -0.62 0.00 0.00 178.44 177.66 1y8b h MET 294 N 0.00 0.00 -0.00 1.25 4.05 -1.68 -3.13 114.93 115.42 1y8b h MET 294 Ca 0.44 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.86 1y8b h MET 294 Cb 2.43 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 33.23 1y8b h MET 294 CO -0.00 0.10 -0.04 1.04 0.23 0.00 0.00 176.91 178.24 1y8b n GLN 295 N -3.06 1.02 -3.52 0.39 6.02 0.72 -4.90 117.38 114.04 1y8b n GLN 295 Ca 0.03 -0.31 -0.23 0.00 -0.01 0.00 0.00 57.00 56.49 1y8b n GLN 295 Cb 0.58 -1.49 0.07 0.00 1.02 0.00 0.00 30.24 30.42 1y8b n GLN 295 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1y8b n GLY 296 N 1.15 -0.46 0.00 1.08 0.00 -1.15 -4.85 105.19 100.96 1y8b n GLY 296 Ca 0.19 0.20 0.00 0.00 0.00 0.00 0.00 46.02 46.41 1y8b n GLY 296 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1y8b n THR 297 N -4.86 0.03 -1.41 2.61 -1.04 -1.26 -4.96 114.28 103.39 1y8b n THR 297 Ca 0.01 -0.07 -0.16 0.00 -2.04 0.00 0.00 64.05 61.78 1y8b n THR 297 Cb 0.56 1.64 -0.16 0.00 -1.82 0.00 0.00 70.33 70.54 1y8b n THR 297 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1y8b n LEU 298 N -0.02 -1.09 -4.61 -4.42 -0.00 -1.26 -4.84 117.00 100.76 1y8b n LEU 298 Ca 0.00 -0.90 -0.32 0.00 -0.00 0.00 0.00 56.01 54.79 1y8b n LEU 298 Cb 0.29 -0.72 -0.10 0.00 -0.00 0.00 0.00 43.42 42.89 1y8b n LEU 298 CO 0.00 -1.69 -0.38 -1.58 -0.00 0.00 0.00 177.39 173.74 1y8b s GLN 299 N 6.89 2.54 -0.20 1.47 0.74 -1.26 -4.64 119.66 125.20 1y8b s GLN 299 Ca 1.00 -0.75 -0.04 0.00 0.05 0.00 0.00 55.36 55.61 1y8b s GLN 299 Cb -0.57 -2.51 -0.02 0.00 1.10 0.00 0.00 33.01 31.01 1y8b s GLN 299 CO 0.39 0.59 -0.02 -1.21 -0.55 0.00 0.00 175.29 174.49 1y8b s GLU 300 N -1.61 3.57 -0.17 1.67 2.02 -1.25 -5.06 118.70 117.87 1y8b s GLU 300 Ca 0.19 -0.55 0.01 0.00 0.02 0.00 0.00 54.97 54.64 1y8b s GLU 300 Cb -0.11 -3.03 0.03 0.00 0.10 0.00 0.00 34.13 31.11 1y8b s GLU 300 CO 0.10 0.00 -0.13 0.15 0.02 0.00 0.00 175.26 175.40 1y8b s LYS 301 N 1.00 2.23 -0.03 1.61 1.02 -1.26 -4.12 119.74 120.19 1y8b s LYS 301 Ca 0.01 -0.69 0.02 0.00 0.02 0.00 0.00 55.97 55.33 1y8b s LYS 301 Cb -0.14 -2.26 0.01 0.00 -0.52 0.00 0.00 37.83 34.92 1y8b s LYS 301 CO 0.01 -0.31 -0.07 1.41 -0.92 0.00 0.00 175.35 175.47 1y8b s MET 302 N 1.44 0.84 0.70 1.68 1.75 -1.26 -5.14 119.30 119.31 1y8b s MET 302 Ca 0.02 -0.23 -0.14 0.00 -1.25 0.00 0.00 55.69 54.10 1y8b s MET 302 Cb -0.14 -0.80 0.02 0.00 2.84 0.00 0.00 34.83 36.75 1y8b s MET 302 CO -0.10 0.06 1.11 -1.83 -0.65 0.00 0.00 175.02 173.61 1y8b s GLU 303 N 0.34 2.56 -0.39 4.11 -1.05 -1.26 -4.54 118.70 118.48 1y8b s GLU 303 Ca -0.05 1.36 0.06 0.00 -0.15 0.00 0.00 54.97 56.19 1y8b s GLU 303 Cb -0.09 -1.92 0.18 0.00 -0.44 0.00 0.00 34.13 31.86 1y8b s GLU 303 CO 0.00 -1.43 0.67 0.21 0.95 0.00 0.00 175.26 175.66 1y8b s LYS 304 N -4.30 0.72 -0.89 -4.83 2.47 -1.26 -4.99 119.74 106.66 1y8b s LYS 304 Ca 0.66 -0.15 -0.18 0.00 -1.56 0.00 0.00 55.97 54.74 1y8b s LYS 304 Cb -0.20 0.11 -0.23 0.00 -1.46 0.00 0.00 37.83 36.04 1y8b s LYS 304 CO 0.46 -1.08 2.30 0.09 0.16 0.00 0.00 175.35 177.28 1y8b n ASN 305 N 4.47 0.29 0.00 1.43 3.02 -1.26 -0.53 115.26 122.68 1y8b n ASN 305 Ca 0.10 -1.03 0.00 0.00 -0.03 0.00 0.00 54.58 53.62 1y8b n ASN 305 Cb 0.57 -1.14 0.00 0.00 -0.61 0.00 0.00 39.78 38.61 1y8b n ASN 305 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1y8b n GLY 306 N 6.20 -0.97 0.00 7.41 0.00 -1.26 -5.12 105.19 111.45 1y8b n GLY 306 Ca 0.57 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.59 1y8b n GLY 306 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1y8b n ARG 307 N 0.00 -1.71 -3.37 1.61 1.85 0.31 -5.10 116.66 110.26 1y8b n ARG 307 Ca 0.00 0.00 -0.16 0.00 -1.00 0.00 0.00 57.85 56.69 1y8b n ARG 307 Cb 0.00 0.00 -0.08 0.00 -1.05 0.00 0.00 32.46 31.33 1y8b n ARG 307 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 1y8b s GLN 308 N -1.27 0.55 -0.26 2.89 1.11 -1.26 -4.04 119.66 117.38 1y8b s GLN 308 Ca 0.00 -0.64 -0.26 0.00 0.01 0.00 0.00 55.36 54.47 1y8b s GLN 308 Cb 0.00 -0.68 0.00 0.00 -1.01 0.00 0.00 33.01 31.32 1y8b s GLN 308 CO 0.00 -1.15 0.91 -1.50 0.01 0.00 0.00 175.29 173.57 1y8b s ILE 309 N 1.71 4.74 -0.03 1.08 2.07 -1.26 -5.02 121.20 124.49 1y8b s ILE 309 Ca 0.15 1.66 -0.03 0.00 -1.41 0.00 0.00 60.65 61.02 1y8b s ILE 309 Cb -0.15 -4.22 0.01 0.00 0.13 0.00 0.00 42.46 38.23 1y8b s ILE 309 CO -0.12 -0.19 0.08 -0.69 -1.91 0.00 0.00 174.94 172.11 1y8b s VAL 310 N 3.07 0.01 -0.27 4.00 1.01 -1.26 -4.39 120.40 122.58 1y8b s VAL 310 Ca 0.38 -0.07 0.03 0.00 0.00 0.00 0.00 61.98 62.33 1y8b s VAL 310 Cb -0.15 -0.14 0.06 0.00 0.00 0.00 0.00 36.38 36.16 1y8b s VAL 310 CO 0.09 -0.04 -0.10 -0.13 0.00 0.00 0.00 175.10 174.92 1y8b s ARG 311 N -0.08 2.18 0.06 2.72 3.00 -1.26 -5.05 118.95 120.52 1y8b s ARG 311 Ca -0.01 -1.38 0.00 0.00 0.00 0.00 0.00 55.73 54.34 1y8b s ARG 311 Cb -0.01 -2.91 -0.04 0.00 0.00 0.00 0.00 34.95 31.99 1y8b s ARG 311 CO 0.00 -0.59 0.18 0.21 0.00 0.00 0.00 175.30 175.10 1y8b s LYS 312 N 1.09 3.33 0.06 3.54 2.20 -1.26 -3.92 119.74 124.78 1y8b s LYS 312 Ca -0.08 -0.48 -0.33 0.00 -0.36 0.00 0.00 55.97 54.72 1y8b s LYS 312 Cb -0.20 -2.98 -0.12 0.00 -1.51 0.00 0.00 37.83 33.02 1y8b s LYS 312 CO -0.05 0.61 1.79 1.28 -0.36 0.00 0.00 175.35 178.61 1y8b n LEU 313 N 0.38 3.58 -4.69 5.43 4.32 -1.26 -4.92 117.00 119.84 1y8b n LEU 313 Ca -0.06 1.01 -0.32 0.00 -0.02 0.00 0.00 56.01 56.61 1y8b n LEU 313 Cb 0.51 -1.45 0.15 0.00 -1.62 0.00 0.00 43.42 41.01 1y8b n LEU 313 CO 0.50 -0.03 0.72 0.20 -1.22 0.00 0.00 177.39 177.56 1y8b s ASN 314 N 2.74 3.27 0.19 -1.43 0.01 -1.26 -5.02 114.94 113.45 1y8b s ASN 314 Ca 0.85 2.26 0.00 0.00 -0.71 0.00 0.00 52.86 55.26 1y8b s ASN 314 Cb -0.61 -2.58 0.00 0.00 0.41 0.00 0.00 41.25 38.48 1y8b s ASN 314 CO 0.42 -2.88 0.00 0.47 -1.51 0.00 0.00 177.10 173.61 1y8b n ASP 315 N -3.79 0.00 -1.53 -1.22 9.92 -1.26 -5.06 116.55 113.61 1y8b n ASP 315 Ca 0.12 -0.23 0.00 0.00 -0.53 0.00 0.00 54.79 54.15 1y8b n ASP 315 Cb 0.51 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.99 1y8b n ASP 315 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 1y8b n ASP 316 N -0.69 1.67 -3.59 -2.24 9.92 -1.26 -5.00 116.55 115.36 1y8b n ASP 316 Ca 0.00 -0.76 -0.02 0.00 -0.53 0.00 0.00 54.79 53.48 1y8b n ASP 316 Cb 0.00 0.00 -0.05 0.00 -0.64 0.00 0.00 41.12 40.43 1y8b n ASP 316 CO 0.00 0.00 0.00 -0.60 0.13 0.00 0.00 177.20 176.73 1y8b s ARG 317 N -1.21 0.52 0.25 -1.24 3.52 -1.26 -5.15 118.95 114.38 1y8b s ARG 317 Ca 0.00 1.19 -0.16 0.00 -0.13 0.00 0.00 55.73 56.64 1y8b s ARG 317 Cb 0.00 0.59 -0.08 0.00 -1.56 0.00 0.00 34.95 33.90 1y8b s ARG 317 CO 0.00 -0.16 0.68 -1.01 -0.81 0.00 0.00 175.30 174.00 1y8b s HIS 318 N 2.46 3.51 0.33 5.12 3.76 -1.26 -4.31 115.29 124.90 1y8b s HIS 318 Ca -0.06 1.22 0.09 0.00 -0.15 0.00 0.00 55.06 56.16 1y8b s HIS 318 Cb -0.09 -2.51 -0.06 0.00 1.11 0.00 0.00 32.58 31.03 1y8b s HIS 318 CO -0.19 0.25 -0.09 0.71 -0.85 0.00 0.00 174.74 174.57 1y8b s TYR 319 N -1.73 2.29 -0.02 1.40 2.02 0.31 -4.97 117.35 116.66 1y8b s TYR 319 Ca 0.47 -0.53 -0.24 0.00 -0.37 0.00 0.00 57.07 56.40 1y8b s TYR 319 Cb -0.13 -1.30 -0.04 0.00 -0.40 0.00 0.00 41.96 40.09 1y8b s TYR 319 CO 0.19 0.52 0.73 0.95 -1.57 0.00 0.00 175.55 176.37 1y8b s THR 320 N -2.69 4.92 0.60 -0.71 -4.23 0.65 -0.97 115.64 113.21 1y8b s THR 320 Ca 0.32 1.52 -0.18 0.00 -1.18 0.00 0.00 61.69 62.17 1y8b s THR 320 Cb 0.02 -4.07 -0.03 0.00 1.34 0.00 0.00 72.50 69.77 1y8b s THR 320 CO 0.15 0.30 1.14 0.00 -0.54 0.00 0.00 174.62 175.68 1y8b s ALA 321 N 0.42 2.55 0.46 3.99 0.00 0.33 0.15 121.76 129.66 1y8b s ALA 321 Ca 0.38 0.77 0.24 0.00 0.00 0.00 0.00 51.96 53.35 1y8b s ALA 321 Cb -0.19 -3.37 1.26 0.00 0.00 0.00 0.00 23.12 20.82 1y8b s ALA 321 CO 0.20 -1.08 1.82 0.00 0.00 0.00 0.00 175.76 176.70 1y8b h ALA 322 N 0.66 2.51 -0.12 0.00 0.00 -1.82 1.37 119.26 121.86 1y8b h ALA 322 Ca -0.49 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.44 1y8b h ALA 322 Cb 1.27 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.09 1y8b h ALA 322 CO 0.55 -0.85 0.00 -3.47 0.00 0.00 0.00 179.25 175.48 1y8b n ASP 323 N -4.45 2.03 0.00 0.00 -0.08 -1.26 -4.80 116.55 108.00 1y8b n ASP 323 Ca 0.23 -2.20 0.00 0.00 -1.51 0.00 0.00 54.79 51.30 1y8b n ASP 323 Cb 0.92 -0.54 0.00 0.00 2.34 0.00 0.00 41.12 43.84 1y8b n ASP 323 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1y8b n GLY 324 N 0.13 1.85 2.78 0.27 0.00 0.47 -4.98 105.19 105.71 1y8b n GLY 324 Ca 0.06 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.83 1y8b n GLY 324 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1y8b n SER 325 N 0.00 -2.47 -4.84 1.61 7.64 -1.23 -4.47 113.62 109.86 1y8b n SER 325 Ca 0.00 -0.95 -0.36 0.00 1.01 0.00 0.00 58.87 58.57 1y8b n SER 325 Cb 0.00 -0.82 -0.07 0.00 -1.01 0.00 0.00 64.21 62.32 1y8b n SER 325 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1y8b s GLU 326 N -4.93 3.34 -0.01 1.43 8.01 -1.26 0.12 118.70 125.40 1y8b s GLU 326 Ca 0.57 -0.20 -0.16 0.00 0.01 0.00 0.00 54.97 55.19 1y8b s GLU 326 Cb -0.07 -3.10 0.03 0.00 -4.31 0.00 0.00 34.13 26.68 1y8b s GLU 326 CO 0.45 0.76 0.34 -1.50 0.01 0.00 0.00 175.26 175.32 1y8b s ILE 327 N -1.02 0.05 0.02 -1.63 2.07 -0.14 -4.67 121.20 115.88 1y8b s ILE 327 Ca 0.15 -0.44 -0.07 0.00 -1.41 0.00 0.00 60.65 58.89 1y8b s ILE 327 Cb -0.12 -0.66 -0.00 0.00 0.13 0.00 0.00 42.46 41.81 1y8b s ILE 327 CO 0.05 -0.24 0.12 -0.94 -1.91 0.00 0.00 174.94 172.02 1y8b s SER 328 N -1.34 0.10 0.34 4.50 1.04 -1.26 0.11 113.70 117.19 1y8b s SER 328 Ca -0.13 -0.37 0.09 0.00 0.48 0.00 0.00 55.95 56.02 1y8b s SER 328 Cb -0.05 0.22 -0.06 0.00 0.10 0.00 0.00 66.02 66.24 1y8b s SER 328 CO 0.05 -0.45 -0.02 -0.22 0.98 0.00 0.00 173.24 173.57 1y8b s LEU 329 N -1.78 2.91 0.00 2.42 2.96 -1.26 -4.98 118.68 118.94 1y8b s LEU 329 Ca -0.10 -1.04 0.00 0.00 -0.22 0.00 0.00 54.13 52.77 1y8b s LEU 329 Cb -0.04 -1.25 0.00 0.00 0.50 0.00 0.00 46.19 45.39 1y8b s LEU 329 CO -0.02 -0.22 0.00 1.41 -1.32 0.00 0.00 176.35 176.20 1y8b n HIS 330 N -0.90 0.00 0.00 5.38 8.25 -1.26 -4.73 115.22 121.95 1y8b n HIS 330 Ca -0.04 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.42 1y8b n HIS 330 Cb 0.63 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.74 1y8b n HIS 330 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1y8b n GLY 331 N 0.00 1.23 3.64 -1.41 0.00 -1.26 -4.73 105.19 102.65 1y8b n GLY 331 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 1y8b n GLY 331 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1y8b s ARG 332 N 0.00 2.29 0.45 1.61 3.52 -1.26 -4.62 118.95 120.94 1y8b s ARG 332 Ca 0.00 -1.27 -0.22 0.00 -0.13 0.00 0.00 55.73 54.12 1y8b s ARG 332 Cb 0.00 -2.24 -0.09 0.00 -1.56 0.00 0.00 34.95 31.07 1y8b s ARG 332 CO 0.00 0.41 1.05 0.45 -0.81 0.00 0.00 175.30 176.40 1y8b s SER 333 N -3.22 6.48 0.63 -2.12 0.15 -0.71 -4.94 113.70 109.98 1y8b s SER 333 Ca 0.28 2.00 -0.18 0.00 0.70 0.00 0.00 55.95 58.75 1y8b s SER 333 Cb -0.08 -2.57 -0.02 0.00 -1.71 0.00 0.00 66.02 61.63 1y8b s SER 333 CO 0.18 -0.68 1.20 -0.11 1.20 0.00 0.00 173.24 175.03 1y8b n LEU 334 N -0.59 5.35 -4.23 3.45 7.94 -1.24 -4.87 117.00 122.81 1y8b n LEU 334 Ca 0.08 0.83 -0.38 0.00 -1.11 0.00 0.00 56.01 55.42 1y8b n LEU 334 Cb 0.51 -1.51 -0.11 0.00 0.53 0.00 0.00 43.42 42.84 1y8b n LEU 334 CO 0.42 -1.24 -0.18 -0.76 -1.11 0.00 0.00 177.39 174.52 1y8b s LEU 335 N -3.64 4.83 -0.17 -1.96 2.01 -1.26 -2.99 118.68 115.50 1y8b s LEU 335 Ca 0.81 -1.48 -0.16 0.00 0.01 0.00 0.00 54.13 53.30 1y8b s LEU 335 Cb -0.39 -1.90 -0.04 0.00 0.01 0.00 0.00 46.19 43.87 1y8b s LEU 335 CO 0.42 -0.46 0.41 0.12 1.01 0.00 0.00 176.35 177.86 1y8b s PHE 336 N 1.35 3.43 -0.27 0.29 2.19 -0.64 -4.78 117.98 119.55 1y8b s PHE 336 Ca 0.02 0.71 -0.18 0.00 0.33 0.00 0.00 56.93 57.81 1y8b s PHE 336 Cb -0.22 -2.51 -0.03 0.00 -1.31 0.00 0.00 43.02 38.96 1y8b s PHE 336 CO 0.01 0.09 0.51 0.42 1.83 0.00 0.00 175.22 178.08 1y8b s ILE 337 N 0.95 5.06 -0.10 3.12 -1.09 -0.72 -1.31 121.20 127.12 1y8b s ILE 337 Ca 0.21 0.84 0.01 0.00 -2.23 0.00 0.00 60.65 59.48 1y8b s ILE 337 Cb -0.15 -3.84 -0.02 0.00 -1.58 0.00 0.00 42.46 36.88 1y8b s ILE 337 CO 0.08 0.06 -0.14 -0.60 -1.23 0.00 0.00 174.94 173.11 1y8b s ARG 338 N 2.32 3.07 -0.13 2.79 3.52 -1.24 0.56 118.95 129.84 1y8b s ARG 338 Ca 0.21 -0.69 -0.08 0.00 -0.13 0.00 0.00 55.73 55.04 1y8b s ARG 338 Cb -0.16 -2.53 -0.04 0.00 -1.56 0.00 0.00 34.95 30.66 1y8b s ARG 338 CO 0.09 0.36 0.15 1.21 -0.81 0.00 0.00 175.30 176.30 1y8b s ASN 339 N -0.03 6.37 -0.20 -2.12 3.84 -1.24 -4.16 114.94 117.39 1y8b s ASN 339 Ca -0.03 0.44 -0.09 0.00 0.21 0.00 0.00 52.86 53.39 1y8b s ASN 339 Cb -0.14 -2.08 -0.04 0.00 -0.55 0.00 0.00 41.25 38.43 1y8b s ASN 339 CO 0.04 0.36 0.10 -0.69 -2.79 0.00 0.00 177.10 174.11 1y8b s VAL 340 N -0.73 5.02 -0.41 -5.21 1.01 -1.26 -4.92 120.40 113.90 1y8b s VAL 340 Ca 0.14 0.05 0.04 0.00 0.00 0.00 0.00 61.98 62.22 1y8b s VAL 340 Cb -0.12 -3.29 0.17 0.00 0.00 0.00 0.00 36.38 33.14 1y8b s VAL 340 CO 0.03 0.43 0.45 -0.83 0.00 0.00 0.00 175.10 175.18 1y8b s GLY 341 N 0.56 0.01 0.01 4.51 0.00 -1.26 -2.75 107.32 108.40 1y8b s GLY 341 Ca 0.05 -1.24 -0.01 0.00 0.00 0.00 0.00 44.72 43.53 1y8b s GLY 341 CO 0.01 2.79 0.04 1.42 0.00 0.00 0.00 173.10 177.35 1y8b n HIS 342 N 3.59 -0.58 0.25 1.90 8.25 -1.26 -4.64 115.22 122.74 1y8b n HIS 342 Ca 0.18 -0.04 0.14 0.00 -0.26 0.00 0.00 57.72 57.73 1y8b n HIS 342 Cb 0.48 0.02 0.57 0.00 1.12 0.00 0.00 29.99 32.19 1y8b n HIS 342 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1y8b h LEU 343 N 0.00 0.00 -0.26 2.41 -0.00 -2.00 -3.06 115.31 112.40 1y8b h LEU 343 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.87 1y8b h LEU 343 Cb 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.70 1y8b h LEU 343 CO 0.01 0.11 0.00 1.15 -0.00 0.00 0.00 178.44 179.71 1y8b n MET 344 N -3.26 0.00 -3.68 1.13 0.00 -1.26 -4.45 117.12 105.60 1y8b n MET 344 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 57.70 57.58 1y8b n MET 344 Cb 0.36 -1.00 -0.09 0.00 0.00 0.00 0.00 33.22 32.50 1y8b n MET 344 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 175.97 176.92 1y8b s THR 345 N -1.71 -0.00 0.31 3.17 -4.23 -1.16 -4.90 115.64 107.12 1y8b s THR 345 Ca 0.00 0.01 -0.20 0.00 -1.18 0.00 0.00 61.69 60.32 1y8b s THR 345 Cb 0.00 -0.76 -0.09 0.00 1.34 0.00 0.00 72.50 72.98 1y8b s THR 345 CO 0.00 0.01 0.83 -0.63 -0.54 0.00 0.00 174.62 174.28 1y8b s ILE 346 N 0.60 4.47 0.60 2.99 1.01 -1.26 -4.85 121.20 124.76 1y8b s ILE 346 Ca -0.03 1.38 -0.18 0.00 0.00 0.00 0.00 60.65 61.83 1y8b s ILE 346 Cb -0.05 -3.78 -0.09 0.00 0.01 0.00 0.00 42.46 38.55 1y8b s ILE 346 CO -0.04 -0.01 0.42 -2.65 0.00 0.00 0.00 174.94 172.66 1y8b n PRO 347 N 0.15 0.40 -0.01 2.79 -0.02 -1.26 -4.91 135.00 132.14 1y8b n PRO 347 Ca 0.02 0.16 0.03 0.00 -2.02 0.00 0.00 63.50 61.69 1y8b n PRO 347 Cb 0.52 -1.63 -0.06 0.00 -0.02 0.00 0.00 33.50 32.32 1y8b n PRO 347 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1y8b n VAL 348 N -1.82 0.06 -4.05 -1.45 0.31 -1.26 -4.88 118.33 105.24 1y8b n VAL 348 Ca 0.11 -0.18 -0.12 0.00 -0.01 0.00 0.00 64.34 64.13 1y8b n VAL 348 Cb 0.48 0.17 -0.05 0.00 -0.91 0.00 0.00 33.84 33.54 1y8b n VAL 348 CO 0.00 0.00 0.00 0.27 -1.32 0.00 0.00 176.83 175.78 1y8b s ILE 349 N -2.46 0.00 0.05 2.52 -4.36 -1.26 -4.76 121.20 110.93 1y8b s ILE 349 Ca -0.03 -1.54 0.05 0.00 -0.26 0.00 0.00 60.65 58.88 1y8b s ILE 349 Cb 0.04 -2.48 -0.04 0.00 1.25 0.00 0.00 42.46 41.23 1y8b s ILE 349 CO 0.30 0.00 -0.11 0.26 0.24 0.00 0.00 174.94 175.63 1y8b s TRP 350 N -3.46 2.75 0.82 1.37 0.52 -1.26 -4.64 118.94 115.05 1y8b s TRP 350 Ca 0.28 -0.13 -0.05 0.00 0.02 0.00 0.00 56.10 56.21 1y8b s TRP 350 Cb -0.00 -1.51 0.17 0.00 -1.15 0.00 0.00 33.47 30.98 1y8b s TRP 350 CO 0.15 0.36 1.13 -0.51 0.02 0.00 0.00 176.95 178.09 1y8b s ASP 351 N -1.68 3.76 0.24 2.95 1.01 -1.26 -2.72 116.67 118.97 1y8b s ASP 351 Ca 0.18 -0.32 0.10 0.00 0.71 0.00 0.00 52.55 53.22 1y8b s ASP 351 Cb -0.11 0.16 0.20 0.00 1.01 0.00 0.00 42.92 44.18 1y8b s ASP 351 CO 0.09 -2.28 1.52 0.28 0.21 0.00 0.00 175.17 174.99 1y8b h SER 352 N -0.96 0.00 0.17 0.27 0.02 -1.92 -2.83 113.55 108.30 1y8b h SER 352 Ca -0.37 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.58 1y8b h SER 352 Cb 1.25 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.79 1y8b h SER 352 CO 0.35 0.71 0.00 -1.84 -1.14 0.00 0.00 176.83 174.91 1y8b n GLU 353 N -3.62 0.67 -0.77 3.45 0.00 -1.26 -4.83 120.64 114.28 1y8b n GLU 353 Ca -0.01 0.02 0.00 0.00 0.00 0.00 0.00 57.16 57.17 1y8b n GLU 353 Cb 0.71 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.65 1y8b n GLU 353 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1y8b n GLY 354 N 0.76 0.32 0.32 -1.84 0.00 -1.07 -4.81 105.19 98.87 1y8b n GLY 354 Ca 0.17 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.12 1y8b n GLY 354 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1y8b h ASN 355 N 0.00 1.05 0.00 1.61 4.21 -1.88 -3.47 115.58 117.10 1y8b h ASN 355 Ca 0.00 -0.23 0.00 0.00 1.21 0.00 0.00 56.30 57.28 1y8b h ASN 355 Cb 0.17 -0.28 0.00 0.00 -1.12 0.00 0.00 38.32 37.10 1y8b h ASN 355 CO 0.00 1.01 0.00 1.21 -1.29 0.00 0.00 177.43 178.36 1y8b n GLU 356 N -4.26 0.00 -3.80 0.81 2.13 -1.26 -4.96 120.64 109.29 1y8b n GLU 356 Ca 0.05 0.00 -0.26 0.00 0.66 0.00 0.00 57.16 57.61 1y8b n GLU 356 Cb 0.26 0.00 0.01 0.00 0.27 0.00 0.00 31.44 31.98 1y8b n GLU 356 CO 0.00 0.00 0.00 1.51 -0.41 0.00 0.00 177.13 178.23 1y8b n ILE 357 N 0.00 -1.67 0.33 6.31 3.06 -1.26 -4.71 119.36 121.42 1y8b n ILE 357 Ca 0.00 -0.28 0.12 0.00 -2.50 0.00 0.00 62.75 60.09 1y8b n ILE 357 Cb 0.00 -1.44 0.51 0.00 0.54 0.00 0.00 39.64 39.25 1y8b n ILE 357 CO 0.00 0.00 0.00 -2.65 -2.50 0.00 0.00 176.55 171.40 1y8b n PRO 358 N -3.10 0.18 -0.91 9.51 -0.02 -1.26 -4.67 135.00 134.73 1y8b n PRO 358 Ca -0.10 0.48 0.12 0.00 -2.02 0.00 0.00 63.50 61.98 1y8b n PRO 358 Cb 0.36 -1.89 -0.03 0.00 -0.02 0.00 0.00 33.50 31.92 1y8b n PRO 358 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1y8b n GLU 359 N -2.23 -1.83 -0.25 -0.52 2.13 -1.26 -2.81 120.64 113.87 1y8b n GLU 359 Ca 0.01 1.20 -0.03 0.00 0.66 0.00 0.00 57.16 59.01 1y8b n GLU 359 Cb 0.18 -2.23 -0.04 0.00 0.27 0.00 0.00 31.44 29.62 1y8b n GLU 359 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1y8b n GLY 360 N -2.67 1.44 0.13 8.31 0.00 -1.11 -3.94 105.19 107.35 1y8b n GLY 360 Ca 0.01 -0.25 -0.22 0.00 0.00 0.00 0.00 46.02 45.55 1y8b n GLY 360 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1y8b h ILE 361 N 2.45 0.94 -0.19 -0.61 6.09 -1.81 -2.22 117.51 122.17 1y8b h ILE 361 Ca 0.04 -2.42 -0.05 0.00 -1.37 0.00 0.00 64.86 61.06 1y8b h ILE 361 Cb 0.39 2.69 -0.01 0.00 0.47 0.00 0.00 36.82 40.36 1y8b h ILE 361 CO 0.31 0.76 -0.12 0.17 -3.07 0.00 0.00 178.15 176.20 1y8b h LEU 362 N -0.16 0.28 0.12 2.19 -0.00 -1.82 -2.30 115.31 113.63 1y8b h LEU 362 Ca -0.33 -0.06 -0.30 0.00 -0.00 0.00 0.00 57.88 57.19 1y8b h LEU 362 Cb 1.88 -0.07 -0.00 0.00 -0.00 0.00 0.00 40.66 42.46 1y8b h LEU 362 CO 0.09 0.44 -1.45 0.44 -0.00 0.00 0.00 178.44 177.96 1y8b h ASP 363 N 0.28 0.40 0.90 0.17 3.32 -1.86 -2.84 116.42 116.79 1y8b h ASP 363 Ca 0.06 -0.51 -0.04 0.00 0.02 0.00 0.00 57.03 56.55 1y8b h ASP 363 Cb 0.39 -0.13 0.01 0.00 0.22 0.00 0.00 39.33 39.82 1y8b h ASP 363 CO 0.02 1.42 -0.43 1.23 -1.72 0.00 0.00 179.24 179.76 1y8b h GLY 364 N 1.67 -1.26 0.98 2.75 0.00 -1.10 -2.63 103.07 103.47 1y8b h GLY 364 Ca -0.21 0.47 0.00 0.00 0.00 0.00 0.00 47.33 47.59 1y8b h GLY 364 CO 0.17 -0.46 -0.02 -2.08 0.00 0.00 0.00 176.54 174.16 1y8b h VAL 365 N -1.27 0.96 0.00 4.60 2.07 -1.59 0.01 116.25 121.03 1y8b h VAL 365 Ca -0.12 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.40 1y8b h VAL 365 Cb 0.93 0.96 0.00 0.00 -1.52 0.00 0.00 31.29 31.66 1y8b h VAL 365 CO 0.20 0.00 0.46 0.24 0.02 0.00 0.00 177.57 178.49 1y8b h MET 366 N -0.04 0.00 0.14 1.57 2.07 -1.49 0.69 114.93 117.88 1y8b h MET 366 Ca 0.00 0.00 -0.29 0.00 -2.07 0.00 0.00 59.70 57.34 1y8b h MET 366 Cb 0.03 0.00 0.03 0.00 -1.87 0.00 0.00 31.60 29.79 1y8b h MET 366 CO -0.00 0.00 -1.22 1.15 1.07 0.00 0.00 176.91 177.90 1y8b h THR 367 N 0.00 1.31 -1.07 2.22 2.02 -0.60 -3.21 112.91 113.59 1y8b h THR 367 Ca 0.00 -2.49 0.31 0.00 0.77 0.00 0.00 66.41 65.00 1y8b h THR 367 Cb 0.91 2.81 -0.04 0.00 -1.74 0.00 0.00 68.15 70.09 1y8b h THR 367 CO 0.00 0.75 1.10 1.23 0.37 0.00 0.00 175.52 178.97 1y8b h GLY 368 N 0.17 0.00 0.10 2.16 0.00 0.36 0.45 103.07 106.32 1y8b h GLY 368 Ca -0.19 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.07 1y8b h GLY 368 CO 0.23 0.00 -0.32 0.00 0.00 0.00 0.00 176.54 176.46 1y8b h ALA 369 N 0.79 0.03 -0.56 3.60 0.00 -1.67 -3.23 119.26 118.22 1y8b h ALA 369 Ca 0.51 -0.64 0.16 0.00 0.00 0.00 0.00 54.91 54.94 1y8b h ALA 369 Cb 2.71 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 20.60 1y8b h ALA 369 CO -0.01 0.17 0.66 0.97 0.00 0.00 0.00 179.25 181.05 1y8b h ILE 370 N -0.90 0.24 0.09 0.00 6.09 -0.19 0.59 117.51 123.42 1y8b h ILE 370 Ca -0.07 0.00 -0.25 0.00 -1.37 0.00 0.00 64.86 63.16 1y8b h ILE 370 Cb 1.15 0.46 -0.01 0.00 0.47 0.00 0.00 36.82 38.89 1y8b h ILE 370 CO -0.01 0.00 -1.16 0.00 -3.07 0.00 0.00 178.15 173.91 1y8b h ALA 371 N 1.20 0.18 -0.19 0.18 0.00 -1.52 -3.24 119.26 115.87 1y8b h ALA 371 Ca 0.27 -0.89 0.06 0.00 0.00 0.00 0.00 54.91 54.34 1y8b h ALA 371 Cb 1.59 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.32 1y8b h ALA 371 CO -0.00 1.06 0.77 1.25 0.00 0.00 0.00 179.25 182.33 1y8b h LEU 372 N 0.05 0.00 -0.69 0.00 5.85 0.18 0.98 115.31 121.68 1y8b h LEU 372 Ca -0.09 0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.50 1y8b h LEU 372 Cb 1.90 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.92 1y8b h LEU 372 CO 0.18 0.00 -0.32 0.22 -0.34 0.00 0.00 178.44 178.18 1y8b h TYR 373 N 0.00 0.76 0.00 1.25 3.20 -1.66 0.22 116.97 120.74 1y8b h TYR 373 Ca 0.09 -0.20 -0.02 0.00 3.14 0.00 0.00 58.73 61.74 1y8b h TYR 373 Cb 1.63 -0.17 -0.00 0.00 1.54 0.00 0.00 36.73 39.73 1y8b h TYR 373 CO 0.00 0.89 -0.37 0.22 -1.64 0.00 0.00 178.16 177.27 1y8b h ASP 374 N 0.55 0.00 0.10 -2.11 3.58 0.77 -3.26 116.42 116.05 1y8b h ASP 374 Ca 0.06 0.00 -0.26 0.00 0.42 0.00 0.00 57.03 57.25 1y8b h ASP 374 Cb 0.82 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.87 1y8b h ASP 374 CO 0.07 0.09 -1.33 -0.07 -2.88 0.00 0.00 179.24 175.12 1y8b h LEU 375 N 0.00 0.34 0.36 2.28 3.38 -1.18 -3.01 115.31 117.47 1y8b h LEU 375 Ca -0.01 -0.84 -0.01 0.00 0.09 0.00 0.00 57.88 57.12 1y8b h LEU 375 Cb 1.08 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.69 1y8b h LEU 375 CO 0.01 1.58 -0.46 0.11 0.09 0.00 0.00 178.44 179.77 1y8b h LYS 376 N -0.38 -0.81 -0.77 1.13 1.79 -0.70 -0.92 116.57 115.91 1y8b h LYS 376 Ca -0.29 0.06 0.15 0.00 -2.18 0.00 0.00 60.65 58.38 1y8b h LYS 376 Cb 1.69 0.18 -0.15 0.00 -1.58 0.00 0.00 32.23 32.38 1y8b h LYS 376 CO 0.04 -0.54 -0.22 -0.39 -1.08 0.00 0.00 179.45 177.26 1y8b h VAL 377 N -0.84 0.21 0.00 0.50 -1.51 -1.73 -3.43 116.25 109.45 1y8b h VAL 377 Ca -0.04 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.43 1y8b h VAL 377 Cb 0.75 0.21 0.00 0.00 -2.13 0.00 0.00 31.29 30.12 1y8b h VAL 377 CO -0.11 0.00 0.00 1.67 -1.23 0.00 0.00 177.57 177.90 1y8b n GLN 378 N -5.50 -0.70 0.00 5.19 7.27 -0.35 -4.04 117.38 119.25 1y8b n GLN 378 Ca 0.10 0.14 0.00 0.00 0.07 0.00 0.00 57.00 57.31 1y8b n GLN 378 Cb 0.39 -4.02 0.00 0.00 2.41 0.00 0.00 30.24 29.02 1y8b n GLN 378 CO 0.00 0.00 0.00 0.36 0.07 0.00 0.00 177.06 177.49 1y8b n LYS 379 N -0.62 0.00 -3.16 3.69 -0.00 -1.26 -5.08 118.16 111.73 1y8b n LYS 379 Ca 0.00 0.00 0.04 0.00 -0.00 0.00 0.00 58.31 58.35 1y8b n LYS 379 Cb 0.14 0.00 -0.00 0.00 -0.00 0.00 0.00 35.03 35.17 1y8b n LYS 379 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.40 178.61 1y8b s ASN 380 N 0.00 -1.58 0.11 -5.58 3.04 -1.26 -5.15 114.94 104.53 1y8b s ASN 380 Ca 0.00 0.04 0.09 0.00 0.04 0.00 0.00 52.86 53.03 1y8b s ASN 380 Cb 0.00 1.99 -0.04 0.00 -1.54 0.00 0.00 41.25 41.67 1y8b s ASN 380 CO 0.00 -0.27 -0.22 -0.55 -3.04 0.00 0.00 177.10 173.01 1y8b s SER 381 N 2.69 2.76 0.36 -4.21 0.15 -1.26 -4.71 113.70 109.47 1y8b s SER 381 Ca 0.11 -0.71 0.25 0.00 0.70 0.00 0.00 55.95 56.30 1y8b s SER 381 Cb -0.09 -0.16 0.59 0.00 -1.71 0.00 0.00 66.02 64.65 1y8b s SER 381 CO -0.23 0.09 1.70 0.03 1.20 0.00 0.00 173.24 176.02 1y8b h ARG 382 N 3.98 0.00 -0.12 5.44 3.08 -1.95 -3.19 114.38 121.63 1y8b h ARG 382 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.58 1y8b h ARG 382 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.23 1y8b h ARG 382 CO 0.40 0.00 0.00 -2.37 -1.07 0.00 0.00 179.97 176.93 1y8b n THR 383 N -2.77 1.00 0.00 2.04 5.66 -1.26 -4.96 114.28 113.99 1y8b n THR 383 Ca 0.04 -1.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.04 1y8b n THR 383 Cb 0.47 0.50 0.00 0.00 -1.55 0.00 0.00 70.33 69.75 1y8b n THR 383 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1y8b n GLY 384 N -0.16 0.50 1.15 1.09 0.00 -1.21 -4.68 105.19 101.88 1y8b n GLY 384 Ca 0.04 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.04 1y8b n GLY 384 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1y8b n SER 385 N 0.40 -0.64 -4.50 1.61 2.88 -1.25 -4.78 113.62 107.34 1y8b n SER 385 Ca 0.00 -1.41 -0.36 0.00 -1.33 0.00 0.00 58.87 55.76 1y8b n SER 385 Cb 0.00 1.06 -0.12 0.00 -0.75 0.00 0.00 64.21 64.40 1y8b n SER 385 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1y8b s VAL 386 N -2.62 4.59 -0.44 2.46 1.01 -1.26 -4.96 120.40 119.18 1y8b s VAL 386 Ca 0.06 -0.08 -0.11 0.00 0.00 0.00 0.00 61.98 61.84 1y8b s VAL 386 Cb -0.01 -3.14 0.08 0.00 0.00 0.00 0.00 36.38 33.30 1y8b s VAL 386 CO 0.03 0.34 0.31 -0.72 0.00 0.00 0.00 175.10 175.06 1y8b s TYR 387 N 1.46 3.31 -0.14 5.22 -0.85 -1.26 -0.73 117.35 124.36 1y8b s TYR 387 Ca 0.06 -1.37 0.01 0.00 -0.52 0.00 0.00 57.07 55.25 1y8b s TYR 387 Cb -0.15 -3.06 -0.00 0.00 0.38 0.00 0.00 41.96 39.13 1y8b s TYR 387 CO 0.05 -0.84 -0.17 0.42 -1.52 0.00 0.00 175.55 173.48 1y8b s ILE 388 N 1.49 2.55 -0.44 -3.49 1.09 -1.17 -1.76 121.20 119.47 1y8b s ILE 388 Ca 0.03 -0.82 -0.10 0.00 -1.10 0.00 0.00 60.65 58.66 1y8b s ILE 388 Cb -0.24 -2.05 0.09 0.00 -1.06 0.00 0.00 42.46 39.19 1y8b s ILE 388 CO 0.03 0.53 0.30 0.68 -0.10 0.00 0.00 174.94 176.38 1y8b s VAL 389 N 0.67 4.39 -0.04 2.92 -7.23 0.19 -1.80 120.40 119.50 1y8b s VAL 389 Ca -0.08 -1.42 -0.00 0.00 -1.81 0.00 0.00 61.98 58.66 1y8b s VAL 389 Cb -0.16 -3.72 0.03 0.00 0.56 0.00 0.00 36.38 33.09 1y8b s VAL 389 CO 0.02 -0.57 0.01 -0.75 -0.31 0.00 0.00 175.10 173.50 1y8b s LYS 390 N 1.45 0.32 0.00 4.82 2.36 -1.25 -3.70 119.74 123.73 1y8b s LYS 390 Ca 0.04 0.14 0.00 0.00 -2.55 0.00 0.00 55.97 53.59 1y8b s LYS 390 Cb -0.24 -0.61 0.00 0.00 -1.05 0.00 0.00 37.83 35.93 1y8b s LYS 390 CO 0.02 -0.21 0.00 -2.30 1.55 0.00 0.00 175.35 174.41 1y8b n PRO 391 N 4.59 0.00 -1.21 4.03 -0.02 -1.26 -4.73 135.00 136.40 1y8b n PRO 391 Ca -0.17 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.31 1y8b n PRO 391 Cb 0.50 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.98 1y8b n PRO 391 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1y8b n LYS 392 N 0.00 0.00 -2.68 -0.52 3.00 -1.26 -4.76 118.16 111.94 1y8b n LYS 392 Ca 0.00 0.40 -0.38 0.00 -0.00 0.00 0.00 58.31 58.33 1y8b n LYS 392 Cb 0.00 -0.81 -0.06 0.00 0.00 0.00 0.00 35.03 34.16 1y8b n LYS 392 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.40 178.81 1y8b s MET 393 N -0.30 4.59 -0.30 1.64 -2.45 -1.26 -4.91 119.30 116.32 1y8b s MET 393 Ca 0.00 1.48 -0.04 0.00 -1.25 0.00 0.00 55.69 55.87 1y8b s MET 393 Cb 0.00 -2.94 0.19 0.00 1.25 0.00 0.00 34.83 33.32 1y8b s MET 393 CO 0.00 0.26 0.73 -1.01 1.05 0.00 0.00 175.02 176.05 1y8b s HIS 394 N -1.44 -1.30 0.13 4.11 3.76 -1.26 -5.07 115.29 114.22 1y8b s HIS 394 Ca 0.48 1.36 -0.02 0.00 -0.15 0.00 0.00 55.06 56.74 1y8b s HIS 394 Cb -0.23 0.45 0.03 0.00 1.11 0.00 0.00 32.58 33.94 1y8b s HIS 394 CO 0.29 -0.71 0.07 0.41 -0.85 0.00 0.00 174.74 173.95 1y8b n GLY 395 N 5.44 -2.74 0.30 -2.22 0.00 -1.26 -4.49 105.19 100.22 1y8b n GLY 395 Ca -0.02 -0.90 -0.10 0.00 0.00 0.00 0.00 46.02 45.00 1y8b n GLY 395 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1y8b h PRO 396 N 0.00 1.06 0.00 1.61 0.13 -1.86 -2.69 132.00 130.25 1y8b h PRO 396 Ca -0.03 -0.37 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 1y8b h PRO 396 Cb 0.10 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 31.15 1y8b h PRO 396 CO 0.02 1.07 -0.15 0.00 -0.23 0.00 0.00 178.00 178.71 1y8b n GLN 397 N -4.16 0.25 0.19 0.86 0.00 -1.26 -3.17 117.38 110.08 1y8b n GLN 397 Ca 0.02 0.17 0.10 0.00 0.00 0.00 0.00 57.00 57.29 1y8b n GLN 397 Cb 0.38 -1.75 0.12 0.00 0.00 0.00 0.00 30.24 28.99 1y8b n GLN 397 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.06 177.99 1y8b h GLU 398 N 0.00 0.00 -0.05 2.61 5.08 -1.77 -3.22 114.58 117.23 1y8b h GLU 398 Ca 0.00 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.38 1y8b h GLU 398 Cb 0.72 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.97 1y8b h GLU 398 CO 0.00 0.07 0.05 0.28 -1.00 0.00 0.00 179.01 178.41 1y8b h VAL 399 N 0.00 0.73 -0.35 3.13 2.07 -1.44 -1.39 116.25 118.99 1y8b h VAL 399 Ca -0.00 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.51 1y8b h VAL 399 Cb 1.06 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 31.78 1y8b h VAL 399 CO 0.01 0.00 0.22 0.00 0.02 0.00 0.00 177.57 177.82 1y8b h ALA 400 N 1.96 0.45 -0.05 1.67 0.00 -1.76 0.62 119.26 122.15 1y8b h ALA 400 Ca 0.03 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.78 1y8b h ALA 400 Cb 0.12 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 17.77 1y8b h ALA 400 CO -0.00 -0.06 -0.39 0.74 0.00 0.00 0.00 179.25 179.54 1y8b h PHE 401 N 0.46 0.49 -0.89 0.00 -1.00 -1.53 0.74 116.94 115.22 1y8b h PHE 401 Ca 0.13 -0.23 0.11 0.00 2.81 0.00 0.00 57.97 60.79 1y8b h PHE 401 Cb -0.01 -0.07 -0.07 0.00 3.61 0.00 0.00 35.95 39.42 1y8b h PHE 401 CO -0.04 1.00 0.57 0.00 -1.61 0.00 0.00 178.31 178.23 1y8b h ALA 402 N 0.39 1.70 0.00 2.45 0.00 -1.16 1.77 119.26 124.41 1y8b h ALA 402 Ca -0.03 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.70 1y8b h ALA 402 Cb 1.07 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.65 1y8b h ALA 402 CO 0.08 0.10 -1.07 -0.91 0.00 0.00 0.00 179.25 177.45 1y8b h ASN 403 N 0.82 0.00 1.00 0.00 -0.26 -0.85 -2.56 115.58 113.73 1y8b h ASN 403 Ca 0.42 0.00 -0.19 0.00 -0.56 0.00 0.00 56.30 55.97 1y8b h ASN 403 Cb 0.51 0.00 -0.03 0.00 -1.06 0.00 0.00 38.32 37.74 1y8b h ASN 403 CO -0.19 0.71 -1.05 0.50 -1.06 0.00 0.00 177.43 176.34 1y8b h LYS 404 N 0.00 0.00 0.00 0.81 3.64 0.70 -3.25 116.57 118.47 1y8b h LYS 404 Ca -0.10 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.18 1y8b h LYS 404 Cb 1.62 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.42 1y8b h LYS 404 CO 0.08 0.67 -0.86 -0.07 -2.27 0.00 0.00 179.45 176.99 1y8b h LEU 405 N 0.00 0.00 0.09 5.20 3.38 0.26 -3.36 115.31 120.87 1y8b h LEU 405 Ca -0.08 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.89 1y8b h LEU 405 Cb 1.68 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.43 1y8b h LEU 405 CO 0.09 0.43 -0.04 -0.26 0.09 0.00 0.00 178.44 178.74 1y8b h PHE 406 N 0.00 -0.11 -0.34 1.13 0.04 -1.53 -2.82 116.94 113.32 1y8b h PHE 406 Ca -0.06 -0.00 0.10 0.00 2.80 0.00 0.00 57.97 60.80 1y8b h PHE 406 Cb 1.38 0.04 -0.01 0.00 2.20 0.00 0.00 35.95 39.55 1y8b h PHE 406 CO 0.00 0.37 0.80 0.00 -0.60 0.00 0.00 178.31 178.88 1y8b h THR 407 N -0.65 0.06 0.38 -1.55 1.03 -1.70 0.15 112.91 110.64 1y8b h THR 407 Ca -0.01 0.00 -0.02 0.00 -0.01 0.00 0.00 66.41 66.37 1y8b h THR 407 Cb 0.53 0.28 0.00 0.00 -1.07 0.00 0.00 68.15 67.89 1y8b h THR 407 CO 0.02 0.00 -0.18 -0.09 -0.01 0.00 0.00 175.52 175.26 1y8b h ARG 408 N 0.00 -0.50 -0.65 0.00 1.12 -1.66 1.62 114.38 114.32 1y8b h ARG 408 Ca 0.16 0.03 -0.06 0.00 -1.11 0.00 0.00 59.98 59.00 1y8b h ARG 408 Cb 1.76 0.11 -0.03 0.00 -0.01 0.00 0.00 29.97 31.80 1y8b h ARG 408 CO -0.00 -0.31 0.17 0.82 -3.11 0.00 0.00 179.97 177.54 1y8b h ILE 409 N -0.55 1.25 -0.44 1.20 2.04 -0.84 0.29 117.51 120.46 1y8b h ILE 409 Ca -0.05 -0.90 -0.10 0.00 1.00 0.00 0.00 64.86 64.80 1y8b h ILE 409 Cb 0.42 0.57 -0.01 0.00 -0.74 0.00 0.00 36.82 37.06 1y8b h ILE 409 CO 0.09 0.34 -0.12 -0.33 0.00 0.00 0.00 178.15 178.13 1y8b h GLU 410 N 0.97 0.85 0.28 2.37 5.08 -1.18 -2.69 114.58 120.26 1y8b h GLU 410 Ca 0.21 -0.33 -0.01 0.00 -1.00 0.00 0.00 59.36 58.22 1y8b h GLU 410 Cb 0.33 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1y8b h GLU 410 CO -0.00 0.97 -0.13 1.79 -1.00 0.00 0.00 179.01 180.64 1y8b h THR 411 N 0.68 0.25 -0.55 1.13 1.35 0.27 -1.92 112.91 114.12 1y8b h THR 411 Ca 0.11 -0.82 0.09 0.00 -0.55 0.00 0.00 66.41 65.23 1y8b h THR 411 Cb 0.66 0.42 -0.10 0.00 -1.73 0.00 0.00 68.15 67.40 1y8b h THR 411 CO 0.05 0.07 -0.43 -0.03 -0.25 0.00 0.00 175.52 174.93 1y8b h MET 412 N -1.05 -0.23 -1.19 4.72 1.85 -0.52 2.17 114.93 120.68 1y8b h MET 412 Ca -0.04 0.02 -0.46 0.00 -0.61 0.00 0.00 59.70 58.61 1y8b h MET 412 Cb 0.40 0.05 -0.22 0.00 0.43 0.00 0.00 31.60 32.26 1y8b h MET 412 CO 0.06 -0.15 0.59 1.28 -0.40 0.00 0.00 176.91 178.29 1y8b n LEU 413 N -5.41 6.68 0.01 3.39 4.32 -1.01 -4.54 117.00 120.44 1y8b n LEU 413 Ca 0.02 -3.56 0.00 0.00 -0.02 0.00 0.00 56.01 52.44 1y8b n LEU 413 Cb 0.35 -0.94 0.00 0.00 -1.62 0.00 0.00 43.42 41.21 1y8b n LEU 413 CO -0.00 1.22 0.00 0.61 -1.22 0.00 0.00 177.39 177.99 1y8b n GLY 414 N -0.39 -0.35 0.80 -0.72 0.00 0.41 -4.50 105.19 100.44 1y8b n GLY 414 Ca 0.45 0.08 0.10 0.00 0.00 0.00 0.00 46.02 46.66 1y8b n GLY 414 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1y8b n MET 415 N -2.24 -1.73 -2.02 1.61 2.81 0.71 -4.92 117.12 111.33 1y8b n MET 415 Ca 0.00 1.30 0.00 0.00 -1.81 0.00 0.00 57.70 57.19 1y8b n MET 415 Cb 0.00 -2.07 0.00 0.00 -0.71 0.00 0.00 33.22 30.44 1y8b n MET 415 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1y8b n ALA 416 N -2.97 -2.21 -1.47 3.04 0.00 -1.26 -4.49 120.51 111.15 1y8b n ALA 416 Ca -0.02 0.40 -0.20 0.00 0.00 0.00 0.00 53.44 53.62 1y8b n ALA 416 Cb 0.37 -1.21 -0.20 0.00 0.00 0.00 0.00 19.45 18.41 1y8b n ALA 416 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1y8b n PRO 417 N 1.50 0.05 0.00 0.00 -0.02 -1.26 -4.86 135.00 130.41 1y8b n PRO 417 Ca 0.00 -0.09 0.00 0.00 -2.02 0.00 0.00 63.50 61.39 1y8b n PRO 417 Cb 0.00 -1.28 0.00 0.00 -0.02 0.00 0.00 33.50 32.20 1y8b n PRO 417 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1y8b n ASN 418 N 6.79 0.00 -2.63 2.55 2.85 -1.26 -5.06 115.26 118.49 1y8b n ASN 418 Ca 0.61 0.00 -0.05 0.00 -0.11 0.00 0.00 54.58 55.03 1y8b n ASN 418 Cb 0.19 0.00 0.05 0.00 1.24 0.00 0.00 39.78 41.27 1y8b n ASN 418 CO 0.00 0.00 0.00 0.41 -2.11 0.00 0.00 177.26 175.56 1y8b n THR 419 N 0.00 0.00 -1.57 -0.44 -1.04 -1.26 -5.13 114.28 104.84 1y8b n THR 419 Ca 0.00 -1.02 -0.44 0.00 -2.04 0.00 0.00 64.05 60.54 1y8b n THR 419 Cb 0.00 0.79 -0.01 0.00 -1.82 0.00 0.00 70.33 69.28 1y8b n THR 419 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1y8b n LEU 420 N -0.59 1.49 -4.98 -4.42 4.32 -1.26 -4.79 117.00 106.78 1y8b n LEU 420 Ca -0.15 1.15 -0.21 0.00 -0.02 0.00 0.00 56.01 56.79 1y8b n LEU 420 Cb 0.74 -1.26 0.01 0.00 -1.62 0.00 0.00 43.42 41.30 1y8b n LEU 420 CO -0.10 -1.62 0.19 -0.75 -1.22 0.00 0.00 177.39 173.90 1y8b s LYS 421 N -1.54 3.01 -0.28 3.23 2.47 0.09 -4.75 119.74 121.97 1y8b s LYS 421 Ca 0.60 -0.80 -0.15 0.00 -1.56 0.00 0.00 55.97 54.06 1y8b s LYS 421 Cb -0.71 -2.68 0.09 0.00 -1.46 0.00 0.00 37.83 33.07 1y8b s LYS 421 CO 0.59 -0.18 0.69 -1.64 0.16 0.00 0.00 175.35 174.97 1y8b s MET 422 N -4.40 0.70 -0.44 4.03 -1.94 -1.26 -3.02 119.30 112.96 1y8b s MET 422 Ca 0.48 1.25 -0.28 0.00 -1.71 0.00 0.00 55.69 55.44 1y8b s MET 422 Cb -0.10 0.21 0.03 0.00 2.01 0.00 0.00 34.83 36.98 1y8b s MET 422 CO 0.35 -0.15 1.05 0.20 -0.01 0.00 0.00 175.02 176.45 1y8b s GLY 423 N 1.76 1.41 -0.29 -0.03 0.00 -0.75 0.27 107.32 109.69 1y8b s GLY 423 Ca -0.10 -0.52 -0.24 0.00 0.00 0.00 0.00 44.72 43.87 1y8b s GLY 423 CO -0.20 2.24 0.81 -0.26 0.00 0.00 0.00 173.10 175.69 1y8b s ILE 424 N 4.05 4.79 -0.37 0.90 -4.36 -1.26 -3.90 121.20 121.05 1y8b s ILE 424 Ca 0.43 1.29 0.11 0.00 -0.26 0.00 0.00 60.65 62.23 1y8b s ILE 424 Cb -0.09 -4.15 0.34 0.00 1.25 0.00 0.00 42.46 39.80 1y8b s ILE 424 CO 0.27 -0.22 0.71 0.80 0.24 0.00 0.00 174.94 176.73 1y8b n MET 425 N 6.20 0.93 -0.89 0.37 1.56 -1.26 -4.60 117.12 119.42 1y8b n MET 425 Ca 0.04 -3.33 -0.36 0.00 -0.27 0.00 0.00 57.70 53.78 1y8b n MET 425 Cb 0.48 -1.63 0.08 0.00 2.15 0.00 0.00 33.22 34.30 1y8b n MET 425 CO 0.00 0.00 0.00 -0.25 -0.73 0.00 0.00 175.97 174.99 1y8b n ASP 426 N 0.44 -3.41 -2.69 6.12 8.00 -1.26 -4.76 116.55 118.99 1y8b n ASP 426 Ca 0.24 0.05 -0.07 0.00 0.71 0.00 0.00 54.79 55.72 1y8b n ASP 426 Cb 0.64 -0.76 0.05 0.00 -0.02 0.00 0.00 41.12 41.03 1y8b n ASP 426 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 1y8b n GLU 427 N 0.83 1.24 0.00 -1.24 -0.00 -1.26 -5.02 120.64 115.20 1y8b n GLU 427 Ca -0.00 -3.00 0.00 0.00 -0.00 0.00 0.00 57.16 54.16 1y8b n GLU 427 Cb 0.65 -1.05 0.00 0.00 -0.00 0.00 0.00 31.44 31.04 1y8b n GLU 427 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.13 176.28 1y8b n GLU 428 N -0.27 0.00 -3.84 3.44 0.28 -1.26 -4.89 120.64 114.10 1y8b n GLU 428 Ca 0.06 0.00 -0.32 0.00 -0.16 0.00 0.00 57.16 56.74 1y8b n GLU 428 Cb 0.82 0.00 -0.04 0.00 1.43 0.00 0.00 31.44 33.65 1y8b n GLU 428 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 177.13 177.47 1y8b s ARG 429 N 0.00 3.50 7.06 3.44 3.52 -1.26 -4.91 118.95 130.30 1y8b s ARG 429 Ca 0.00 -0.28 0.00 0.00 -0.13 0.00 0.00 55.73 55.32 1y8b s ARG 429 Cb 0.00 -3.01 0.00 0.00 -1.56 0.00 0.00 34.95 30.38 1y8b s ARG 429 CO 0.00 0.59 0.00 0.54 -0.81 0.00 0.00 175.30 175.62 1y8b n ARG 430 N 0.48 0.00 0.00 5.12 5.12 -1.26 -4.21 116.66 121.91 1y8b n ARG 430 Ca -0.06 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.86 1y8b n ARG 430 Cb 0.52 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.82 1y8b n ARG 430 CO 0.00 0.00 0.00 -2.37 -1.93 0.00 0.00 177.63 173.33 1y8b n THR 431 N 0.00 0.00 -2.68 0.55 5.66 -1.26 -4.99 114.28 111.56 1y8b n THR 431 Ca 0.00 0.00 -0.05 0.00 -3.05 0.00 0.00 64.05 60.95 1y8b n THR 431 Cb 0.00 0.00 0.09 0.00 -1.55 0.00 0.00 70.33 68.87 1y8b n THR 431 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 1y8b n SER 432 N 0.00 -1.52 -0.06 1.09 3.41 -1.26 -4.94 113.62 110.35 1y8b n SER 432 Ca 0.00 -2.29 -0.05 0.00 -0.26 0.00 0.00 58.87 56.27 1y8b n SER 432 Cb 0.38 1.29 -0.15 0.00 -0.26 0.00 0.00 64.21 65.47 1y8b n SER 432 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 1y8b n LEU 433 N 0.19 0.23 -2.83 1.04 -0.00 -1.26 -4.68 117.00 109.69 1y8b n LEU 433 Ca -0.07 0.11 -0.11 0.00 -0.00 0.00 0.00 56.01 55.94 1y8b n LEU 433 Cb 0.73 0.32 0.06 0.00 -0.00 0.00 0.00 43.42 44.53 1y8b n LEU 433 CO -0.07 0.36 0.17 0.59 -0.00 0.00 0.00 177.39 178.44 1y8b n ASN 434 N -2.73 -0.93 0.44 1.96 3.02 -1.26 -4.99 115.26 110.77 1y8b n ASN 434 Ca -0.23 -3.12 -0.18 0.00 -0.03 0.00 0.00 54.58 51.02 1y8b n ASN 434 Cb 1.01 0.75 -0.09 0.00 -0.61 0.00 0.00 39.78 40.84 1y8b n ASN 434 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1y8b h LEU 435 N 2.78 -0.95 -1.90 3.41 3.38 -1.94 0.16 115.31 120.25 1y8b h LEU 435 Ca -0.09 0.02 0.48 0.00 0.09 0.00 0.00 57.88 58.38 1y8b h LEU 435 Cb 1.12 0.25 -0.08 0.00 0.09 0.00 0.00 40.66 42.04 1y8b h LEU 435 CO 0.23 -0.63 1.15 0.08 0.09 0.00 0.00 178.44 179.37 1y8b h ARG 436 N -1.23 0.02 0.00 1.13 0.11 -1.93 3.17 114.38 115.65 1y8b h ARG 436 Ca -0.12 -0.00 -0.06 0.00 0.10 0.00 0.00 59.98 59.91 1y8b h ARG 436 Cb 0.87 -0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.94 1y8b h ARG 436 CO 0.19 0.01 -0.38 1.03 0.10 0.00 0.00 179.97 180.93 1y8b h SER 437 N 0.02 0.00 0.13 0.08 0.87 -1.75 -3.11 113.55 109.78 1y8b h SER 437 Ca 0.80 -0.52 -0.20 0.00 -1.23 0.00 0.00 61.79 60.65 1y8b h SER 437 Cb 3.10 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 65.06 1y8b h SER 437 CO -0.07 0.97 -0.74 0.00 -0.53 0.00 0.00 176.83 176.45 1y8b h ILE 439 N 0.36 1.20 0.00 0.00 6.09 0.55 -2.59 117.51 123.12 1y8b h ILE 439 Ca -0.04 -0.75 0.00 0.00 -1.37 0.00 0.00 64.86 62.70 1y8b h ILE 439 Cb 1.34 0.83 0.00 0.00 0.47 0.00 0.00 36.82 39.46 1y8b h ILE 439 CO 0.14 0.27 0.56 0.00 -3.07 0.00 0.00 178.15 176.04 1y8b n ALA 440 N -2.47 0.15 0.75 0.18 0.00 -1.18 0.24 120.51 118.19 1y8b n ALA 440 Ca 0.02 0.02 0.04 0.00 0.00 0.00 0.00 53.44 53.52 1y8b n ALA 440 Cb 0.22 -0.18 0.21 0.00 0.00 0.00 0.00 19.45 19.71 1y8b n ALA 440 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1y8b n GLN 441 N -1.55 0.38 -0.49 0.00 7.27 -0.98 -2.28 117.38 119.72 1y8b n GLN 441 Ca -0.00 0.00 -0.10 0.00 0.07 0.00 0.00 57.00 56.97 1y8b n GLN 441 Cb 0.56 -1.30 0.07 0.00 2.41 0.00 0.00 30.24 31.98 1y8b n GLN 441 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1y8b n ALA 442 N -0.80 3.75 0.31 1.69 0.00 0.65 -4.51 120.51 121.61 1y8b n ALA 442 Ca 0.05 -1.15 0.16 0.00 0.00 0.00 0.00 53.44 52.50 1y8b n ALA 442 Cb 0.02 -1.18 0.88 0.00 0.00 0.00 0.00 19.45 19.17 1y8b n ALA 442 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1y8b h ARG 443 N 0.41 0.00 0.00 0.00 2.47 -1.71 -3.37 114.38 112.19 1y8b h ARG 443 Ca 0.25 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.97 1y8b h ARG 443 Cb 1.73 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 30.05 1y8b h ARG 443 CO 0.44 0.00 0.00 0.27 0.56 0.00 0.00 179.97 181.24 1y8b n ASN 444 N -2.84 0.00 -2.12 7.04 2.04 -1.26 -4.50 115.26 113.62 1y8b n ASN 444 Ca -0.02 0.00 -0.01 0.00 -0.44 0.00 0.00 54.58 54.11 1y8b n ASN 444 Cb 0.28 0.00 -0.01 0.00 -2.53 0.00 0.00 39.78 37.52 1y8b n ASN 444 CO 0.00 0.00 0.00 0.54 -0.44 0.00 0.00 177.26 177.36 1y8b n ARG 445 N 0.00 0.23 -3.87 -3.83 1.74 -1.26 -4.29 116.66 105.38 1y8b n ARG 445 Ca 0.00 -0.07 -0.36 0.00 -0.77 0.00 0.00 57.85 56.66 1y8b n ARG 445 Cb 0.00 -1.49 -0.14 0.00 -1.02 0.00 0.00 32.46 29.82 1y8b n ARG 445 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1y8b s VAL 446 N 2.08 3.35 1.20 1.55 0.11 -1.26 -4.11 120.40 123.31 1y8b s VAL 446 Ca 0.04 -0.86 -0.15 0.00 -2.93 0.00 0.00 61.98 58.08 1y8b s VAL 446 Cb 0.02 -2.71 0.29 0.00 -1.53 0.00 0.00 36.38 32.45 1y8b s VAL 446 CO 0.00 0.16 1.03 0.00 -3.33 0.00 0.00 175.10 172.96 1y8b s ALA 447 N 1.40 -0.24 0.54 1.54 0.00 0.76 -4.73 121.76 121.03 1y8b s ALA 447 Ca 0.01 -0.40 -0.04 0.00 0.00 0.00 0.00 51.96 51.54 1y8b s ALA 447 Cb -0.17 -3.13 0.01 0.00 0.00 0.00 0.00 23.12 19.83 1y8b s ALA 447 CO -0.02 -3.82 0.82 -0.59 0.00 0.00 0.00 175.76 172.15 1y8b s PHE 448 N -2.57 3.23 0.51 0.00 -0.71 -1.26 -4.09 117.98 113.10 1y8b s PHE 448 Ca 0.68 0.49 0.08 0.00 -1.04 0.00 0.00 56.93 57.14 1y8b s PHE 448 Cb -0.20 -2.59 0.04 0.00 -1.21 0.00 0.00 43.02 39.06 1y8b s PHE 448 CO 0.61 -0.67 0.60 0.42 -1.34 0.00 0.00 175.22 174.85 1y8b s ILE 449 N -2.84 2.29 -0.02 -4.49 1.09 -1.26 -4.25 121.20 111.73 1y8b s ILE 449 Ca 0.52 -1.16 -0.30 0.00 -1.10 0.00 0.00 60.65 58.61 1y8b s ILE 449 Cb -0.10 -2.45 0.12 0.00 -1.06 0.00 0.00 42.46 38.96 1y8b s ILE 449 CO 0.42 0.00 1.22 0.21 -0.10 0.00 0.00 174.94 176.70 1y8b s ASN 450 N -4.43 -0.09 0.73 3.58 3.84 -1.26 -3.26 114.94 114.05 1y8b s ASN 450 Ca 0.52 -0.15 0.00 0.00 0.21 0.00 0.00 52.86 53.44 1y8b s ASN 450 Cb -0.05 0.21 0.00 0.00 -0.55 0.00 0.00 41.25 40.86 1y8b s ASN 450 CO 0.32 -0.38 0.00 0.35 -2.79 0.00 0.00 177.10 174.60 1y8b n THR 451 N -0.43 0.00 0.00 -5.21 -2.24 -1.26 -4.68 114.28 100.46 1y8b n THR 451 Ca -0.07 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 1y8b n THR 451 Cb 0.62 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.85 1y8b n THR 451 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1y8b n GLY 452 N 0.00 3.52 0.00 3.38 0.00 -1.26 -3.96 105.19 106.87 1y8b n GLY 452 Ca 0.00 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.34 1y8b n GLY 452 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1y8b n PHE 453 N 0.00 0.00 -4.52 1.61 -1.74 -1.26 -4.92 117.46 106.63 1y8b n PHE 453 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.89 1y8b n PHE 453 Cb 0.00 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.00 1y8b n PHE 453 CO 0.00 0.00 0.00 -0.11 -0.56 0.00 0.00 176.76 176.09 1y8b n LEU 454 N -0.26 0.00 0.17 5.98 0.00 -1.26 -2.61 117.00 119.02 1y8b n LEU 454 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 56.01 56.13 1y8b n LEU 454 Cb 0.00 0.00 0.32 0.00 0.00 0.00 0.00 43.42 43.74 1y8b n LEU 454 CO 0.00 -0.23 1.11 0.44 0.00 0.00 0.00 177.39 178.71 1y8b h ASP 455 N 0.99 0.00 0.00 1.96 3.32 -1.98 0.89 116.42 121.61 1y8b h ASP 455 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1y8b h ASP 455 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1y8b h ASP 455 CO 0.00 0.00 0.06 0.03 -1.72 0.00 0.00 179.24 177.61 1y8b h ARG 456 N 0.00 0.00 -0.56 3.56 2.47 -1.86 -2.11 114.38 115.89 1y8b h ARG 456 Ca 0.15 0.00 0.08 0.00 -1.26 0.00 0.00 59.98 58.94 1y8b h ARG 456 Cb 1.94 0.00 -0.06 0.00 -1.65 0.00 0.00 29.97 30.20 1y8b h ARG 456 CO -0.00 0.00 0.22 1.79 0.56 0.00 0.00 179.97 182.54 1y8b h THR 457 N 0.00 0.83 -0.05 2.04 1.35 0.64 2.31 112.91 120.02 1y8b h THR 457 Ca 0.00 -0.14 -0.15 0.00 -0.55 0.00 0.00 66.41 65.56 1y8b h THR 457 Cb 0.13 0.37 -0.01 0.00 -1.73 0.00 0.00 68.15 66.91 1y8b h THR 457 CO 0.00 0.08 -0.65 1.23 -0.25 0.00 0.00 175.52 175.93 1y8b h GLY 458 N 0.42 0.24 1.86 5.82 0.00 -1.61 -3.03 103.07 106.77 1y8b h GLY 458 Ca 0.27 -0.32 -0.11 0.00 0.00 0.00 0.00 47.33 47.17 1y8b h GLY 458 CO -0.26 0.29 -0.62 -1.80 0.00 0.00 0.00 176.54 174.15 1y8b h ASP 459 N 0.16 0.00 -0.53 0.19 3.58 -1.23 -3.25 116.42 115.34 1y8b h ASP 459 Ca -0.01 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.41 1y8b h ASP 459 Cb 1.17 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 42.20 1y8b h ASP 459 CO 0.10 0.51 0.24 -0.08 -2.88 0.00 0.00 179.24 177.12 1y8b h GLU 460 N 0.00 0.78 -0.21 0.28 4.81 0.39 -2.45 114.58 118.18 1y8b h GLU 460 Ca -0.02 -0.13 -0.09 0.00 -0.13 0.00 0.00 59.36 58.99 1y8b h GLU 460 Cb 1.41 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 30.64 1y8b h GLU 460 CO 0.06 0.66 -0.26 0.52 -0.73 0.00 0.00 179.01 179.27 1y8b h MET 461 N 0.72 0.39 -0.13 1.92 2.86 -1.62 -2.29 114.93 116.77 1y8b h MET 461 Ca 0.18 -0.14 0.04 0.00 -2.06 0.00 0.00 59.70 57.72 1y8b h MET 461 Cb 0.15 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.78 1y8b h MET 461 CO -0.02 0.62 0.32 0.45 1.06 0.00 0.00 176.91 179.34 1y8b h HIS 462 N 0.35 0.00 0.33 -0.22 3.86 -1.47 2.37 115.15 120.37 1y8b h HIS 462 Ca 0.05 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.25 1y8b h HIS 462 Cb 0.64 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.11 1y8b h HIS 462 CO 0.02 0.00 -0.16 1.03 0.86 0.00 0.00 177.93 179.68 1y8b h SER 463 N 0.00 -0.38 0.00 2.45 0.87 -1.42 -3.35 113.55 111.73 1y8b h SER 463 Ca 0.06 -0.14 -0.02 0.00 -1.23 0.00 0.00 61.79 60.46 1y8b h SER 463 Cb 0.70 0.10 -0.05 0.00 -0.44 0.00 0.00 62.40 62.71 1y8b h SER 463 CO -0.00 -0.06 -0.35 1.33 -0.53 0.00 0.00 176.83 177.22 1y8b n VAL 464 N -5.17 1.46 -0.09 2.23 0.24 -0.67 -4.71 118.33 111.62 1y8b n VAL 464 Ca -0.10 -2.06 0.22 0.00 -2.04 0.00 0.00 64.34 60.37 1y8b n VAL 464 Cb 0.26 0.02 0.36 0.00 -1.47 0.00 0.00 33.84 33.02 1y8b n VAL 464 CO 0.00 0.00 0.00 -0.03 -2.14 0.00 0.00 176.83 174.66 1y8b h MET 465 N 0.42 0.00 -0.01 7.34 4.05 0.38 1.31 114.93 128.42 1y8b h MET 465 Ca -0.03 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.39 1y8b h MET 465 Cb 1.17 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.97 1y8b h MET 465 CO 0.01 0.00 0.00 -1.91 0.23 0.00 0.00 176.91 175.24 1y8b n GLU 466 N -3.11 0.45 -0.34 0.39 4.07 -1.26 -3.69 120.64 117.14 1y8b n GLU 466 Ca 0.18 0.00 0.17 0.00 -0.06 0.00 0.00 57.16 57.45 1y8b n GLU 466 Cb 1.39 -1.01 0.39 0.00 -0.06 0.00 0.00 31.44 32.15 1y8b n GLU 466 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1y8b h ALA 467 N 1.88 1.82 0.00 4.31 0.00 0.14 -3.35 119.26 124.06 1y8b h ALA 467 Ca 0.00 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1y8b h ALA 467 Cb 0.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1y8b h ALA 467 CO 0.00 -0.27 0.00 0.41 0.00 0.00 0.00 179.25 179.39 1y8b n GLY 468 N -1.33 0.95 3.73 0.00 0.00 -1.24 -4.44 105.19 102.85 1y8b n GLY 468 Ca 0.26 -1.02 -0.41 0.00 0.00 0.00 0.00 46.02 44.85 1y8b n GLY 468 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1y8b s PRO 469 N 0.00 4.63 0.29 1.61 0.04 -1.26 -5.05 135.00 135.26 1y8b s PRO 469 Ca 0.00 1.52 -0.04 0.00 0.04 0.00 0.00 61.00 62.52 1y8b s PRO 469 Cb 0.00 -3.37 -0.01 0.00 0.04 0.00 0.00 34.50 31.16 1y8b s PRO 469 CO 0.00 0.10 0.38 0.00 0.04 0.00 0.00 177.00 177.52 1y8b s MET 470 N 0.19 1.65 0.00 4.56 0.23 -1.26 -4.57 119.30 120.11 1y8b s MET 470 Ca 0.49 -1.63 0.00 0.00 -1.03 0.00 0.00 55.69 53.52 1y8b s MET 470 Cb -0.25 0.40 0.00 0.00 -1.53 0.00 0.00 34.83 33.46 1y8b s MET 470 CO 0.30 -0.65 0.00 -0.11 -2.03 0.00 0.00 175.02 172.53 1y8b n LEU 471 N -0.46 0.00 -0.50 0.18 -0.00 -1.17 -4.27 117.00 110.78 1y8b n LEU 471 Ca 0.01 0.00 0.06 0.00 -0.00 0.00 0.00 56.01 56.08 1y8b n LEU 471 Cb 0.63 0.00 0.05 0.00 -0.00 0.00 0.00 43.42 44.10 1y8b n LEU 471 CO 0.29 0.00 0.45 0.54 -0.00 0.00 0.00 177.39 178.67 1y8b n ARG 472 N 0.00 0.77 0.39 1.96 1.74 -1.18 -4.63 116.66 115.71 1y8b n ARG 472 Ca 0.00 -1.26 -0.16 0.00 -0.77 0.00 0.00 57.85 55.66 1y8b n ARG 472 Cb 0.00 -1.24 -0.07 0.00 -1.02 0.00 0.00 32.46 30.13 1y8b n ARG 472 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 1y8b h LYS 473 N 2.42 -0.98 -1.10 5.56 1.63 -1.85 -0.04 116.57 122.21 1y8b h LYS 473 Ca 0.00 0.07 0.30 0.00 -0.85 0.00 0.00 60.65 60.17 1y8b h LYS 473 Cb 0.52 0.22 -0.09 0.00 -0.60 0.00 0.00 32.23 32.29 1y8b h LYS 473 CO 0.00 -0.66 0.72 -2.95 -3.45 0.00 0.00 179.45 173.12 1y8b h ASN 474 N -1.27 0.33 1.94 4.20 -0.00 -1.88 0.97 115.58 119.86 1y8b h ASN 474 Ca -0.10 0.07 -0.00 0.00 -0.00 0.00 0.00 56.30 56.26 1y8b h ASN 474 Cb 0.78 0.02 -0.00 0.00 -0.00 0.00 0.00 38.32 39.12 1y8b h ASN 474 CO 0.17 0.04 -0.06 1.56 -0.00 0.00 0.00 177.43 179.14 1y8b h GLN 475 N 0.28 0.00 -0.68 4.14 4.20 -1.78 -3.26 115.11 118.01 1y8b h GLN 475 Ca 0.61 0.00 0.20 0.00 0.06 0.00 0.00 58.65 59.52 1y8b h GLN 475 Cb 1.77 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 29.53 1y8b h GLN 475 CO -0.24 0.01 0.64 1.98 -0.67 0.00 0.00 178.83 180.55 1y8b h MET 476 N 0.00 0.00 -1.04 1.46 4.05 0.30 0.50 114.93 120.20 1y8b h MET 476 Ca -0.00 0.00 0.29 0.00 -0.28 0.00 0.00 59.70 59.71 1y8b h MET 476 Cb 1.01 0.00 -0.13 0.00 -0.80 0.00 0.00 31.60 31.68 1y8b h MET 476 CO 0.00 0.00 0.62 -0.22 0.23 0.00 0.00 176.91 177.54 1y8b h LYS 477 N 0.00 0.40 -1.24 0.39 1.63 -1.66 -3.33 116.57 112.76 1y8b h LYS 477 Ca 0.32 -0.02 -0.17 0.00 -0.85 0.00 0.00 60.65 59.93 1y8b h LYS 477 Cb 1.60 -0.09 -0.21 0.00 -0.60 0.00 0.00 32.23 32.93 1y8b h LYS 477 CO -0.00 0.26 -0.53 -1.54 -3.45 0.00 0.00 179.45 174.19 1y8b s SER 478 N -5.04 -0.88 -0.10 4.20 1.04 0.16 -5.10 113.70 107.97 1y8b s SER 478 Ca -0.10 -1.33 -0.03 0.00 0.48 0.00 0.00 55.95 54.97 1y8b s SER 478 Cb 0.28 1.57 0.05 0.00 0.10 0.00 0.00 66.02 68.02 1y8b s SER 478 CO 0.80 -0.15 0.10 -0.89 0.98 0.00 0.00 173.24 174.08 1y8b s THR 479 N 1.39 -0.15 0.27 2.02 2.01 -1.22 -5.02 115.64 114.94 1y8b s THR 479 Ca 0.21 0.17 -0.02 0.00 0.31 0.00 0.00 61.69 62.36 1y8b s THR 479 Cb -0.04 -0.36 0.31 0.00 0.01 0.00 0.00 72.50 72.42 1y8b s THR 479 CO -0.06 -0.01 1.63 -0.65 -0.69 0.00 0.00 174.62 174.83 1y8b h PRO 480 N 8.41 0.13 -0.02 4.92 0.11 -1.96 0.97 132.00 144.56 1y8b h PRO 480 Ca -0.14 -0.01 0.03 0.00 0.11 0.00 0.00 66.00 65.99 1y8b h PRO 480 Cb 1.13 -0.03 -0.04 0.00 0.11 0.00 0.00 31.00 32.18 1y8b h PRO 480 CO 0.21 0.08 -0.16 -1.49 -0.21 0.00 0.00 178.00 176.43 1y8b h TRP 481 N 0.13 -0.42 0.01 0.65 4.06 -1.99 -1.47 115.95 116.91 1y8b h TRP 481 Ca 0.49 0.02 -0.19 0.00 2.06 0.00 0.00 58.89 61.27 1y8b h TRP 481 Cb 0.95 0.19 -0.02 0.00 -1.00 0.00 0.00 29.16 29.28 1y8b h TRP 481 CO -0.38 -0.24 -0.89 0.82 -3.56 0.00 0.00 178.44 174.19 1y8b h ILE 482 N -0.26 1.55 -0.72 1.49 5.03 -1.61 -2.35 117.51 120.64 1y8b h ILE 482 Ca 0.06 -2.80 0.09 0.00 -0.12 0.00 0.00 64.86 62.09 1y8b h ILE 482 Cb 0.34 2.55 -0.07 0.00 -3.03 0.00 0.00 36.82 36.61 1y8b h ILE 482 CO -0.17 0.81 0.37 0.50 -0.68 0.00 0.00 178.15 178.97 1y8b h LYS 483 N 0.06 0.61 0.08 2.37 1.63 0.14 -0.94 116.57 120.52 1y8b h LYS 483 Ca -0.03 -0.04 -0.19 0.00 -0.85 0.00 0.00 60.65 59.54 1y8b h LYS 483 Cb 1.54 -0.14 0.02 0.00 -0.60 0.00 0.00 32.23 33.05 1y8b h LYS 483 CO 0.13 0.40 -0.78 0.00 -3.45 0.00 0.00 179.45 175.76 1y8b h ALA 484 N 1.43 -0.02 0.08 5.00 0.00 -1.29 -3.15 119.26 121.32 1y8b h ALA 484 Ca 0.35 -0.65 0.01 0.00 0.00 0.00 0.00 54.91 54.62 1y8b h ALA 484 Cb 0.36 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.19 1y8b h ALA 484 CO -0.26 0.40 -0.40 -0.92 0.00 0.00 0.00 179.25 178.07 1y8b h TYR 485 N -0.19 -1.15 -1.00 0.00 5.03 -0.96 4.15 116.97 122.84 1y8b h TYR 485 Ca -0.12 0.03 0.22 0.00 2.58 0.00 0.00 58.73 61.44 1y8b h TYR 485 Cb 1.54 0.49 -0.12 0.00 1.55 0.00 0.00 36.73 40.19 1y8b h TYR 485 CO 0.17 -0.44 0.60 1.49 -1.32 0.00 0.00 178.16 178.66 1y8b h GLU 486 N -0.55 0.65 0.08 1.82 4.81 -1.33 -0.41 114.58 119.65 1y8b h GLU 486 Ca -0.00 -0.04 -0.28 0.00 -0.13 0.00 0.00 59.36 58.91 1y8b h GLU 486 Cb 0.56 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.78 1y8b h GLU 486 CO -0.22 0.43 -1.42 0.00 -0.73 0.00 0.00 179.01 177.07 1y8b h ARG 487 N 0.67 0.17 0.00 1.92 3.08 -1.20 -3.26 114.38 115.76 1y8b h ARG 487 Ca 0.61 -0.29 0.00 0.00 0.07 0.00 0.00 59.98 60.37 1y8b h ARG 487 Cb 1.07 0.11 0.00 0.00 0.08 0.00 0.00 29.97 31.23 1y8b h ARG 487 CO -0.43 1.02 0.00 -0.91 -1.07 0.00 0.00 179.97 178.59 1y8b h ASN 488 N 0.05 0.00 -0.83 7.04 4.21 0.96 -3.09 115.58 123.91 1y8b h ASN 488 Ca -0.19 0.00 0.13 0.00 1.21 0.00 0.00 56.30 57.45 1y8b h ASN 488 Cb 1.96 0.00 -0.14 0.00 -1.12 0.00 0.00 38.32 39.02 1y8b h ASN 488 CO 0.15 0.00 -0.37 -0.55 -1.29 0.00 0.00 177.43 175.37 1y8b h ASN 489 N 0.00 -1.34 -0.48 5.81 -1.07 -1.36 0.26 115.58 117.40 1y8b h ASN 489 Ca 0.00 0.28 -0.08 0.00 0.07 0.00 0.00 56.30 56.56 1y8b h ASN 489 Cb 0.13 0.69 -0.02 0.00 -2.07 0.00 0.00 38.32 37.05 1y8b h ASN 489 CO 0.00 -0.30 -0.03 0.58 0.07 0.00 0.00 177.43 177.76 1y8b h VAL 490 N -0.07 1.27 -0.13 6.14 2.07 -1.78 2.21 116.25 125.96 1y8b h VAL 490 Ca 0.30 -1.12 0.03 0.00 0.82 0.00 0.00 66.70 66.73 1y8b h VAL 490 Cb 0.58 1.02 -0.06 0.00 -1.52 0.00 0.00 31.29 31.31 1y8b h VAL 490 CO -0.87 0.39 -0.51 -0.07 0.02 0.00 0.00 177.57 176.53 1y8b h LEU 491 N 0.72 -1.63 0.15 2.57 -0.00 -0.68 0.34 115.31 116.78 1y8b h LEU 491 Ca 0.13 0.19 -0.26 0.00 -0.00 0.00 0.00 57.88 57.95 1y8b h LEU 491 Cb 0.55 0.64 0.01 0.00 -0.00 0.00 0.00 40.66 41.86 1y8b h LEU 491 CO 0.03 -0.46 -1.22 -1.28 -0.00 0.00 0.00 178.44 175.51 1y8b h SER 492 N -0.55 0.49 -0.95 -0.43 0.87 -1.21 -3.32 113.55 108.44 1y8b h SER 492 Ca 0.03 -0.91 0.30 0.00 -1.23 0.00 0.00 61.79 59.98 1y8b h SER 492 Cb 0.64 -0.16 -0.16 0.00 -0.44 0.00 0.00 62.40 62.28 1y8b h SER 492 CO -0.41 1.56 0.33 1.23 -0.53 0.00 0.00 176.83 179.01 1y8b h GLY 493 N -0.05 1.69 0.99 5.77 0.00 0.38 1.82 103.07 113.67 1y8b h GLY 493 Ca -0.24 -0.07 0.00 0.00 0.00 0.00 0.00 47.33 47.02 1y8b h GLY 493 CO 0.13 -0.51 0.33 -0.10 0.00 0.00 0.00 176.54 176.39 1y8b n LEU 494 N -5.24 0.19 0.00 3.11 0.00 0.10 -0.53 117.00 114.63 1y8b n LEU 494 Ca 0.27 0.42 0.02 0.00 0.00 0.00 0.00 56.01 56.72 1y8b n LEU 494 Cb 0.89 -0.36 0.11 0.00 0.00 0.00 0.00 43.42 44.05 1y8b n LEU 494 CO 0.03 -0.49 0.30 0.49 0.00 0.00 0.00 177.39 177.73 1y8b n PHE 495 N -1.76 0.00 -0.02 1.96 3.72 0.62 -1.39 117.46 120.59 1y8b n PHE 495 Ca -0.00 0.00 -0.00 0.00 -0.05 0.00 0.00 57.45 57.39 1y8b n PHE 495 Cb 0.35 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.83 1y8b n PHE 495 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1y8b n GLY 497 N 2.34 2.75 0.45 0.00 0.00 -0.49 -4.53 105.19 105.70 1y8b n GLY 497 Ca -0.07 -0.67 -0.13 0.00 0.00 0.00 0.00 46.02 45.16 1y8b n GLY 497 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1y8b h LEU 498 N 2.51 -1.92 -5.09 0.99 4.07 -1.73 -3.42 115.31 110.72 1y8b h LEU 498 Ca 0.07 0.26 0.03 0.00 0.08 0.00 0.00 57.88 58.32 1y8b h LEU 498 Cb 1.67 0.80 -0.16 0.00 1.08 0.00 0.00 40.66 44.06 1y8b h LEU 498 CO 0.42 -0.37 -0.16 -0.60 -1.08 0.00 0.00 178.44 176.65 1y8b s ARG 499 N -5.62 0.29 0.00 1.13 3.52 -1.26 -5.02 118.95 111.99 1y8b s ARG 499 Ca -0.14 -0.24 0.00 0.00 -0.13 0.00 0.00 55.73 55.22 1y8b s ARG 499 Cb 0.09 -0.00 0.00 0.00 -1.56 0.00 0.00 34.95 33.48 1y8b s ARG 499 CO 0.62 -0.38 0.00 0.41 -0.81 0.00 0.00 175.30 175.14 1y8b n GLY 500 N 2.96 -1.77 0.00 8.12 0.00 -1.26 -3.47 105.19 109.76 1y8b n GLY 500 Ca 0.11 0.61 0.00 0.00 0.00 0.00 0.00 46.02 46.73 1y8b n GLY 500 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1y8b n LYS 501 N 0.00 0.00 -3.61 1.61 5.02 -1.26 -5.01 118.16 114.91 1y8b n LYS 501 Ca 0.00 0.00 -0.02 0.00 -2.02 0.00 0.00 58.31 56.27 1y8b n LYS 501 Cb 0.00 0.00 -0.01 0.00 -0.02 0.00 0.00 35.03 35.00 1y8b n LYS 501 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1y8b s ALA 502 N 0.00 -2.14 0.07 7.82 0.00 -1.26 -4.68 121.76 121.56 1y8b s ALA 502 Ca 0.00 1.29 0.05 0.00 0.00 0.00 0.00 51.96 53.30 1y8b s ALA 502 Cb 0.00 0.04 -0.04 0.00 0.00 0.00 0.00 23.12 23.12 1y8b s ALA 502 CO 0.00 -0.76 -0.05 -0.65 0.00 0.00 0.00 175.76 174.30 1y8b s GLN 503 N -2.40 2.41 -0.39 0.00 1.11 -1.20 -4.70 119.66 114.49 1y8b s GLN 503 Ca 0.11 -0.87 -0.11 0.00 0.01 0.00 0.00 55.36 54.50 1y8b s GLN 503 Cb 0.01 -2.45 0.04 0.00 -1.01 0.00 0.00 33.01 29.60 1y8b s GLN 503 CO -0.04 0.54 0.23 0.42 0.01 0.00 0.00 175.29 176.45 1y8b s ILE 504 N -1.20 4.55 0.00 1.08 1.09 -1.26 -4.00 121.20 121.45 1y8b s ILE 504 Ca 0.22 -0.97 0.00 0.00 -1.10 0.00 0.00 60.65 58.80 1y8b s ILE 504 Cb -0.11 -3.59 0.00 0.00 -1.06 0.00 0.00 42.46 37.69 1y8b s ILE 504 CO 0.14 -0.30 0.00 0.61 -0.10 0.00 0.00 174.94 175.29 1y8b n GLY 505 N 4.99 0.00 0.00 6.18 0.00 -1.25 -3.30 105.19 111.81 1y8b n GLY 505 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.90 1y8b n GLY 505 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1y8b n LYS 506 N 0.00 0.00 0.00 1.61 2.85 -1.26 -3.50 118.16 117.86 1y8b n LYS 506 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1y8b n LYS 506 Cb 0.00 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.38 1y8b n LYS 506 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1y8b n GLY 507 N 0.00 1.82 3.15 2.58 0.00 -1.26 -4.92 105.19 106.57 1y8b n GLY 507 Ca 0.00 -2.08 0.05 0.00 0.00 0.00 0.00 46.02 43.99 1y8b n GLY 507 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1y8b s MET 508 N -1.47 0.28 -0.26 1.61 1.75 -1.26 -4.85 119.30 115.11 1y8b s MET 508 Ca 0.00 0.48 -0.02 0.00 -1.25 0.00 0.00 55.69 54.89 1y8b s MET 508 Cb 0.00 0.26 0.11 0.00 2.84 0.00 0.00 34.83 38.04 1y8b s MET 508 CO 0.00 -0.33 0.23 1.67 -0.65 0.00 0.00 175.02 175.94 1y8b s TRP 509 N 2.93 -0.23 -0.50 4.11 1.48 -1.26 -5.06 118.94 120.42 1y8b s TRP 509 Ca 0.06 -0.18 0.07 0.00 -1.06 0.00 0.00 56.10 54.99 1y8b s TRP 509 Cb -0.11 -0.52 0.19 0.00 -1.16 0.00 0.00 33.47 31.87 1y8b s TRP 509 CO -0.15 -0.78 0.67 0.00 -4.06 0.00 0.00 176.95 172.64 1y8b s ALA 510 N 2.29 -1.73 0.24 2.67 0.00 -1.26 -5.01 121.76 118.97 1y8b s ALA 510 Ca 0.08 -0.59 -0.04 0.00 0.00 0.00 0.00 51.96 51.41 1y8b s ALA 510 Cb -0.15 -2.59 0.43 0.00 0.00 0.00 0.00 23.12 20.82 1y8b s ALA 510 CO -0.26 -2.21 1.77 0.52 0.00 0.00 0.00 175.76 175.58 1y8b h MET 511 N 5.28 0.59 -0.95 0.00 0.00 -2.02 -1.73 114.93 116.09 1y8b h MET 511 Ca 0.08 -0.04 0.10 0.00 0.00 0.00 0.00 59.70 59.85 1y8b h MET 511 Cb 1.09 -0.13 -0.08 0.00 0.00 0.00 0.00 31.60 32.48 1y8b h MET 511 CO 0.06 0.39 0.59 -1.35 0.00 0.00 0.00 176.91 176.60 1y8b h PRO 512 N 0.60 0.95 -3.83 -0.22 0.11 -1.99 -3.46 132.00 124.17 1y8b h PRO 512 Ca 0.41 -0.06 -0.36 0.00 0.11 0.00 0.00 66.00 66.10 1y8b h PRO 512 Cb 0.52 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.40 1y8b h PRO 512 CO -0.32 0.63 -0.48 -0.25 -0.21 0.00 0.00 178.00 177.36 1y8b n ASP 513 N -4.63 -5.09 -4.93 -2.05 8.00 -0.65 -4.77 116.55 102.43 1y8b n ASP 513 Ca 0.17 -0.04 -0.25 0.00 0.71 0.00 0.00 54.79 55.37 1y8b n ASP 513 Cb 0.29 -4.23 0.04 0.00 -0.02 0.00 0.00 41.12 37.21 1y8b n ASP 513 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1y8b s LEU 514 N -6.09 3.11 -0.21 0.64 2.01 -1.26 -4.30 118.68 112.57 1y8b s LEU 514 Ca 0.10 0.46 -0.00 0.00 0.01 0.00 0.00 54.13 54.70 1y8b s LEU 514 Cb -0.05 -3.23 -0.20 0.00 0.01 0.00 0.00 46.19 42.72 1y8b s LEU 514 CO 0.13 -1.26 -0.04 0.23 1.01 0.00 0.00 176.35 176.43 1y8b n MET 515 N -2.63 0.68 0.15 1.70 2.81 -1.26 -3.38 117.12 115.19 1y8b n MET 515 Ca 0.06 0.18 -0.14 0.00 -1.81 0.00 0.00 57.70 55.99 1y8b n MET 515 Cb 0.59 -1.58 -0.08 0.00 -0.71 0.00 0.00 33.22 31.44 1y8b n MET 515 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1y8b h ALA 516 N 0.06 -0.31 -0.27 3.04 0.00 -1.93 -2.89 119.26 116.96 1y8b h ALA 516 Ca -0.53 -0.08 -0.19 0.00 0.00 0.00 0.00 54.91 54.11 1y8b h ALA 516 Cb 1.95 0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.86 1y8b h ALA 516 CO -0.03 -0.65 -0.57 0.38 0.00 0.00 0.00 179.25 178.37 1y8b h ASP 517 N -0.34 0.97 -0.87 0.00 3.04 -1.95 -3.16 116.42 114.11 1y8b h ASP 517 Ca -0.03 -0.55 0.23 0.00 -3.24 0.00 0.00 57.03 53.44 1y8b h ASP 517 Cb 0.26 -0.28 -0.14 0.00 -1.04 0.00 0.00 39.33 38.13 1y8b h ASP 517 CO 0.05 1.34 0.24 0.24 -2.04 0.00 0.00 179.24 179.07 1y8b h MET 518 N 0.65 0.21 -0.09 4.15 2.86 -1.55 1.69 114.93 122.84 1y8b h MET 518 Ca 0.00 -0.01 0.03 0.00 -2.06 0.00 0.00 59.70 57.66 1y8b h MET 518 Cb 1.19 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 32.80 1y8b h MET 518 CO 0.13 0.14 0.08 -0.92 1.06 0.00 0.00 176.91 177.40 1y8b h TYR 519 N 0.22 0.00 0.08 -0.22 3.20 -1.47 2.26 116.97 121.04 1y8b h TYR 519 Ca 0.54 0.00 -0.32 0.00 3.14 0.00 0.00 58.73 62.09 1y8b h TYR 519 Cb 1.08 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 39.33 1y8b h TYR 519 CO -0.26 0.00 -1.76 1.03 -1.64 0.00 0.00 178.16 175.53 1y8b h SER 520 N 0.00 0.28 0.21 -2.11 0.87 0.22 -2.43 113.55 110.59 1y8b h SER 520 Ca 0.05 -0.53 -0.35 0.00 -1.23 0.00 0.00 61.79 59.73 1y8b h SER 520 Cb 0.21 -0.09 0.02 0.00 -0.44 0.00 0.00 62.40 62.09 1y8b h SER 520 CO -0.00 1.46 -1.70 1.56 -0.53 0.00 0.00 176.83 177.62 1y8b h GLN 521 N 0.05 0.43 0.00 2.24 4.20 0.38 -3.29 115.11 119.11 1y8b h GLN 521 Ca -0.32 -0.73 -0.16 0.00 0.06 0.00 0.00 58.65 57.50 1y8b h GLN 521 Cb 2.02 0.27 -0.02 0.00 0.30 0.00 0.00 27.48 30.05 1y8b h GLN 521 CO 0.11 1.34 -0.78 -0.22 -0.67 0.00 0.00 178.83 178.61 1y8b h LYS 522 N 0.12 0.00 -0.10 1.46 3.64 0.36 -2.51 116.57 119.53 1y8b h LYS 522 Ca -0.33 0.00 0.02 0.00 -1.27 0.00 0.00 60.65 59.07 1y8b h LYS 522 Cb 2.12 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.92 1y8b h LYS 522 CO 0.20 0.78 -0.01 0.78 -2.27 0.00 0.00 179.45 178.93 1y8b h GLY 523 N 2.62 0.09 1.63 5.01 0.00 -1.46 -2.56 103.07 108.40 1y8b h GLY 523 Ca -0.01 0.01 -0.18 0.00 0.00 0.00 0.00 47.33 47.16 1y8b h GLY 523 CO 0.10 -0.02 -0.71 -0.55 0.00 0.00 0.00 176.54 175.36 1y8b h ASP 524 N 0.03 0.43 -0.95 0.19 3.32 -1.63 -3.04 116.42 114.77 1y8b h ASP 524 Ca 0.05 -0.28 0.27 0.00 0.02 0.00 0.00 57.03 57.09 1y8b h ASP 524 Cb 0.06 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 39.44 1y8b h ASP 524 CO -0.08 1.01 0.94 -0.61 -1.72 0.00 0.00 179.24 178.77 1y8b h GLN 525 N 0.25 0.00 -0.02 3.56 5.75 -1.01 0.98 115.11 124.62 1y8b h GLN 525 Ca -0.03 0.00 -0.24 0.00 -0.15 0.00 0.00 58.65 58.24 1y8b h GLN 525 Cb 1.28 0.00 0.01 0.00 1.07 0.00 0.00 27.48 29.84 1y8b h GLN 525 CO 0.12 0.00 -0.95 1.25 -2.65 0.00 0.00 178.83 176.60 1y8b h LEU 526 N 0.00 0.69 -2.00 -2.39 5.85 -1.48 -3.14 115.31 112.84 1y8b h LEU 526 Ca 0.45 -0.53 0.42 0.00 0.84 0.00 0.00 57.88 59.06 1y8b h LEU 526 Cb 2.32 -0.21 -0.06 0.00 0.37 0.00 0.00 40.66 43.08 1y8b h LEU 526 CO -0.00 1.33 1.05 0.03 -0.34 0.00 0.00 178.44 180.51 1y8b h ARG 527 N 0.31 0.00 -0.01 1.25 3.08 0.87 2.77 114.38 122.66 1y8b h ARG 527 Ca -0.09 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.96 1y8b h ARG 527 Cb 1.58 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.63 1y8b h ARG 527 CO 0.17 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 179.07 1y8b n ALA 528 N -2.82 2.60 -1.30 0.04 0.00 -1.18 -4.89 120.51 112.95 1y8b n ALA 528 Ca 0.32 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.63 1y8b n ALA 528 Cb 1.51 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 19.68 1y8b n ALA 528 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1y8b n GLY 529 N 0.79 -0.13 3.39 0.00 0.00 0.93 -4.58 105.19 105.60 1y8b n GLY 529 Ca 0.13 -0.27 -0.39 0.00 0.00 0.00 0.00 46.02 45.50 1y8b n GLY 529 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y8b s ALA 530 N -2.87 3.21 0.00 4.61 0.00 -1.16 -4.80 121.76 120.75 1y8b s ALA 530 Ca 0.00 -1.48 0.00 0.00 0.00 0.00 0.00 51.96 50.48 1y8b s ALA 530 Cb 0.00 -2.35 0.00 0.00 0.00 0.00 0.00 23.12 20.77 1y8b s ALA 530 CO 0.00 -1.02 0.06 0.09 0.00 0.00 0.00 175.76 174.89 1y8b n ASN 531 N 4.95 0.00 -4.97 0.00 3.02 -1.21 -4.91 115.26 112.13 1y8b n ASN 531 Ca -0.14 0.06 -0.21 0.00 -0.03 0.00 0.00 54.58 54.27 1y8b n ASN 531 Cb 0.48 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.66 1y8b n ASN 531 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1y8b s THR 532 N -0.13 3.84 -0.01 3.41 -4.23 -1.26 -4.80 115.64 112.46 1y8b s THR 532 Ca 0.00 -0.75 0.01 0.00 -1.18 0.00 0.00 61.69 59.77 1y8b s THR 532 Cb 0.00 -3.38 0.01 0.00 1.34 0.00 0.00 72.50 70.47 1y8b s THR 532 CO 0.00 -0.21 -0.02 0.00 -0.54 0.00 0.00 174.62 173.85 1y8b s ALA 533 N -2.41 0.23 0.26 3.99 0.00 -1.26 -4.52 121.76 118.06 1y8b s ALA 533 Ca 0.48 -0.03 -0.27 0.00 0.00 0.00 0.00 51.96 52.14 1y8b s ALA 533 Cb -0.10 -0.12 -0.09 0.00 0.00 0.00 0.00 23.12 22.81 1y8b s ALA 533 CO 0.35 0.02 0.90 -0.46 0.00 0.00 0.00 175.76 176.57 1y8b s TRP 534 N 0.23 3.84 -0.05 0.00 -0.00 -1.26 0.13 118.94 121.83 1y8b s TRP 534 Ca -0.02 1.79 -0.13 0.00 -0.00 0.00 0.00 56.10 57.74 1y8b s TRP 534 Cb -0.04 -2.90 0.03 0.00 -0.00 0.00 0.00 33.47 30.55 1y8b s TRP 534 CO -0.01 0.37 0.31 0.14 -0.00 0.00 0.00 176.95 177.76 1y8b s VAL 535 N -1.36 0.04 0.12 5.86 -7.23 0.26 -4.88 120.40 113.20 1y8b s VAL 535 Ca 0.44 -0.32 0.11 0.00 -1.81 0.00 0.00 61.98 60.40 1y8b s VAL 535 Cb -0.22 -0.56 -0.06 0.00 0.56 0.00 0.00 36.38 36.10 1y8b s VAL 535 CO 0.27 -0.18 1.46 1.55 -0.31 0.00 0.00 175.10 177.90 1y8b h PRO 536 N 4.48 0.00 -4.69 4.82 0.13 -1.93 -3.31 132.00 131.49 1y8b h PRO 536 Ca -0.29 0.00 -0.24 0.00 -0.87 0.00 0.00 66.00 64.60 1y8b h PRO 536 Cb 1.18 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.16 1y8b h PRO 536 CO 0.36 0.72 -0.68 -1.12 -0.23 0.00 0.00 178.00 177.05 1y8b s SER 537 N -6.66 1.11 0.31 1.44 0.01 -1.26 -4.80 113.70 103.86 1y8b s SER 537 Ca 0.01 -1.08 0.15 0.00 1.31 0.00 0.00 55.95 56.33 1y8b s SER 537 Cb 0.10 0.12 0.46 0.00 0.21 0.00 0.00 66.02 66.91 1y8b s SER 537 CO 0.77 -0.52 1.64 1.55 0.41 0.00 0.00 173.24 177.09 1y8b h PRO 538 N 2.86 0.00 -0.23 12.44 0.13 -1.98 -3.29 132.00 141.94 1y8b h PRO 538 Ca -0.36 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 64.80 1y8b h PRO 538 Cb 1.18 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.27 1y8b h PRO 538 CO 0.64 0.51 -0.32 1.15 -0.23 0.00 0.00 178.00 179.75 1y8b h THR 539 N 0.00 0.00 0.00 1.56 2.02 -1.96 0.16 112.91 114.69 1y8b h THR 539 Ca -0.01 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.15 1y8b h THR 539 Cb 1.06 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 67.46 1y8b h THR 539 CO 0.07 0.00 -0.13 0.00 0.37 0.00 0.00 175.52 175.82 1y8b h ALA 540 N -0.59 1.68 0.52 6.16 0.00 -1.94 -2.91 119.26 122.19 1y8b h ALA 540 Ca 0.04 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 1y8b h ALA 540 Cb 0.34 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1y8b h ALA 540 CO -0.34 0.16 -0.34 0.00 0.00 0.00 0.00 179.25 178.73 1y8b h ALA 541 N 1.87 -0.85 -0.80 0.00 0.00 -0.81 -1.63 119.26 117.03 1y8b h ALA 541 Ca -0.00 -0.16 0.05 0.00 0.00 0.00 0.00 54.91 54.80 1y8b h ALA 541 Cb 0.25 0.44 -0.06 0.00 0.00 0.00 0.00 17.79 18.42 1y8b h ALA 541 CO 0.02 -0.99 0.50 1.79 0.00 0.00 0.00 179.25 180.56 1y8b h THR 542 N -0.83 1.06 0.00 0.00 1.35 -0.98 0.15 112.91 113.66 1y8b h THR 542 Ca -0.06 -0.32 0.00 0.00 -0.55 0.00 0.00 66.41 65.48 1y8b h THR 542 Cb 0.69 0.05 0.00 0.00 -1.73 0.00 0.00 68.15 67.15 1y8b h THR 542 CO 0.04 0.17 0.00 0.25 -0.25 0.00 0.00 175.52 175.73 1y8b h LEU 543 N 0.93 0.00 0.07 3.87 7.12 -1.28 -1.60 115.31 124.43 1y8b h LEU 543 Ca 0.34 0.00 -0.33 0.00 0.13 0.00 0.00 57.88 58.02 1y8b h LEU 543 Cb 0.11 0.00 -0.03 0.00 -0.53 0.00 0.00 40.66 40.21 1y8b h LEU 543 CO -0.15 0.00 -1.82 -0.74 -0.13 0.00 0.00 178.44 175.60 1y8b h HIS 544 N 0.00 0.29 -1.00 1.25 2.76 0.24 -3.28 115.15 115.40 1y8b h HIS 544 Ca 0.00 -0.21 0.13 0.00 -2.20 0.00 0.00 60.37 58.09 1y8b h HIS 544 Cb 0.01 -0.01 -0.09 0.00 1.55 0.00 0.00 27.41 28.87 1y8b h HIS 544 CO 0.00 1.42 0.63 0.00 -1.30 0.00 0.00 177.93 178.68 1y8b h ALA 545 N 0.50 1.55 0.01 5.26 0.00 -0.31 0.50 119.26 126.77 1y8b h ALA 545 Ca -0.35 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.59 1y8b h ALA 545 Cb 2.02 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.62 1y8b h ALA 545 CO 0.09 0.19 -0.01 -0.07 0.00 0.00 0.00 179.25 179.46 1y8b h LEU 546 N 0.96 -0.01 -0.71 0.00 3.38 -1.68 -3.25 115.31 114.00 1y8b h LEU 546 Ca 0.51 -0.56 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 1y8b h LEU 546 Cb 0.54 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.26 1y8b h LEU 546 CO -0.28 0.56 0.44 -0.74 0.09 0.00 0.00 178.44 178.51 1y8b h HIS 547 N -0.59 0.92 -0.81 1.13 2.76 -1.48 -1.25 115.15 115.84 1y8b h HIS 547 Ca -0.00 0.00 0.23 0.00 -2.20 0.00 0.00 60.37 58.41 1y8b h HIS 547 Cb 0.57 -0.31 -0.03 0.00 1.55 0.00 0.00 27.41 29.19 1y8b h HIS 547 CO 0.12 0.61 0.84 -0.92 -1.30 0.00 0.00 177.93 177.29 1y8b h TYR 548 N 0.97 0.00 0.00 5.26 3.20 -0.04 1.40 116.97 127.75 1y8b h TYR 548 Ca 0.26 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.13 1y8b h TYR 548 Cb -0.06 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.21 1y8b h TYR 548 CO -0.02 0.00 -0.54 0.45 -1.64 0.00 0.00 178.16 176.41 1y8b h HIS 549 N 0.00 0.00 0.00 -3.82 3.86 -1.28 -3.29 115.15 110.62 1y8b h HIS 549 Ca 0.38 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.59 1y8b h HIS 549 Cb 2.06 0.00 0.00 0.00 1.06 0.00 0.00 27.41 30.53 1y8b h HIS 549 CO 0.00 0.00 0.00 0.94 0.86 0.00 0.00 177.93 179.73 1y8b n GLN 550 N -2.68 0.18 -3.34 2.45 7.27 0.48 -4.49 117.38 117.24 1y8b n GLN 550 Ca 0.02 0.07 -0.12 0.00 0.07 0.00 0.00 57.00 57.04 1y8b n GLN 550 Cb 0.52 -1.50 -0.07 0.00 2.41 0.00 0.00 30.24 31.59 1y8b n GLN 550 CO 0.00 0.00 0.00 0.95 0.07 0.00 0.00 177.06 178.08 1y8b s THR 551 N -2.79 -0.55 -0.06 1.69 -4.23 -1.21 -5.11 115.64 103.38 1y8b s THR 551 Ca 0.18 -0.36 -0.30 0.00 -1.18 0.00 0.00 61.69 60.03 1y8b s THR 551 Cb 0.16 -0.98 -0.06 0.00 1.34 0.00 0.00 72.50 72.96 1y8b s THR 551 CO 0.41 -0.35 1.83 0.20 -0.54 0.00 0.00 174.62 176.17 1y8b s ASN 552 N 2.48 6.41 0.38 3.99 0.02 -1.26 -4.84 114.94 122.11 1y8b s ASN 552 Ca 0.10 2.28 0.24 0.00 -1.02 0.00 0.00 52.86 54.46 1y8b s ASN 552 Cb -0.13 -2.53 0.54 0.00 0.02 0.00 0.00 41.25 39.15 1y8b s ASN 552 CO -0.31 -1.13 1.68 -0.37 0.02 0.00 0.00 177.10 176.99 1y8b h VAL 553 N 5.85 0.00 -0.21 1.60 -1.51 -1.91 -3.28 116.25 116.79 1y8b h VAL 553 Ca -0.43 -0.81 -0.00 0.00 -1.23 0.00 0.00 66.70 64.23 1y8b h VAL 553 Cb 1.20 1.80 -0.01 0.00 -2.13 0.00 0.00 31.29 32.16 1y8b h VAL 553 CO 0.96 0.00 0.12 -0.61 -1.23 0.00 0.00 177.57 176.81 1y8b h GLN 554 N 0.00 0.28 -0.91 5.19 4.15 -1.98 -1.93 115.11 119.91 1y8b h GLN 554 Ca 0.00 -0.03 0.15 0.00 0.77 0.00 0.00 58.65 59.55 1y8b h GLN 554 Cb 0.89 -0.06 -0.07 0.00 0.21 0.00 0.00 27.48 28.44 1y8b h GLN 554 CO 0.00 0.23 0.59 1.03 -1.93 0.00 0.00 178.83 178.75 1y8b h SER 555 N 0.25 0.67 0.12 -0.69 0.87 -1.97 0.54 113.55 113.33 1y8b h SER 555 Ca 0.07 0.05 -0.01 0.00 -1.23 0.00 0.00 61.79 60.68 1y8b h SER 555 Cb 0.03 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 61.90 1y8b h SER 555 CO -0.01 0.32 -0.06 0.58 -0.53 0.00 0.00 176.83 177.13 1y8b h VAL 556 N 0.70 0.97 0.00 2.23 2.07 -1.51 0.62 116.25 121.32 1y8b h VAL 556 Ca 0.47 -0.32 -0.08 0.00 0.82 0.00 0.00 66.70 67.60 1y8b h VAL 556 Cb 0.76 1.17 -0.01 0.00 -1.52 0.00 0.00 31.29 31.69 1y8b h VAL 556 CO -0.23 0.08 -0.36 1.56 0.02 0.00 0.00 177.57 178.64 1y8b h GLN 557 N -0.30 0.00 0.02 1.57 7.50 -0.79 -2.97 115.11 120.14 1y8b h GLN 557 Ca -0.02 0.00 -0.00 0.00 0.50 0.00 0.00 58.65 59.13 1y8b h GLN 557 Cb 0.25 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.78 1y8b h GLN 557 CO 0.03 0.36 -0.01 0.00 -1.50 0.00 0.00 178.83 177.71 1y8b h ALA 558 N 1.64 -0.02 -0.42 3.87 0.00 0.41 -2.68 119.26 122.06 1y8b h ALA 558 Ca -0.00 -0.37 0.07 0.00 0.00 0.00 0.00 54.91 54.60 1y8b h ALA 558 Cb 0.74 0.01 -0.09 0.00 0.00 0.00 0.00 17.79 18.44 1y8b h ALA 558 CO 0.05 -0.11 -0.45 -0.97 0.00 0.00 0.00 179.25 177.76 1y8b h ASN 559 N -0.83 -1.51 -0.01 0.00 -0.73 0.28 0.67 115.58 113.44 1y8b h ASN 559 Ca -0.00 0.22 0.00 0.00 1.87 0.00 0.00 56.30 58.40 1y8b h ASN 559 Cb 0.76 0.65 -0.00 0.00 0.27 0.00 0.00 38.32 40.00 1y8b h ASN 559 CO 0.00 -0.37 0.01 0.16 -0.37 0.00 0.00 177.43 176.86 1y8b h ILE 560 N -0.34 0.83 0.00 2.57 3.07 -1.63 0.25 117.51 122.26 1y8b h ILE 560 Ca 0.13 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.54 1y8b h ILE 560 Cb 0.59 0.99 0.00 0.00 -0.27 0.00 0.00 36.82 38.13 1y8b h ILE 560 CO -0.59 0.00 0.00 0.00 -1.05 0.00 0.00 178.15 176.51 1y8b n ALA 561 N -2.47 2.56 1.41 0.16 0.00 0.21 -2.90 120.51 119.49 1y8b n ALA 561 Ca -0.03 -0.16 0.14 0.00 0.00 0.00 0.00 53.44 53.39 1y8b n ALA 561 Cb 0.10 -1.50 0.51 0.00 0.00 0.00 0.00 19.45 18.56 1y8b n ALA 561 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1y8b n GLN 562 N -1.17 1.09 0.00 0.00 7.27 0.88 -4.92 117.38 120.53 1y8b n GLN 562 Ca 0.18 -0.57 0.00 0.00 0.07 0.00 0.00 57.00 56.68 1y8b n GLN 562 Cb 0.19 -1.49 0.00 0.00 2.41 0.00 0.00 30.24 31.35 1y8b n GLN 562 CO 0.00 0.00 0.00 0.25 0.07 0.00 0.00 177.06 177.38 1y8b n THR 563 N -0.46 0.00 -3.26 1.69 -2.24 -1.14 -5.07 114.28 103.79 1y8b n THR 563 Ca 0.16 0.00 -0.33 0.00 -2.27 0.00 0.00 64.05 61.61 1y8b n THR 563 Cb 0.32 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.50 1y8b n THR 563 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1y8b n GLU 564 N 0.00 3.25 0.17 -0.78 4.07 -1.26 -4.83 120.64 121.27 1y8b n GLU 564 Ca 0.00 -4.64 0.13 0.00 -0.06 0.00 0.00 57.16 52.59 1y8b n GLU 564 Cb 0.00 -2.35 0.62 0.00 -0.06 0.00 0.00 31.44 29.65 1y8b n GLU 564 CO 0.00 0.00 0.00 0.74 -0.06 0.00 0.00 177.13 177.81 1y8b h PHE 565 N 4.60 0.00 0.00 4.31 -1.00 -1.97 -2.76 116.94 120.12 1y8b h PHE 565 Ca 0.20 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.98 1y8b h PHE 565 Cb 0.64 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.20 1y8b h PHE 565 CO 0.83 0.00 0.23 0.09 -1.61 0.00 0.00 178.31 177.85 1y8b n ASN 566 N -2.37 0.00 0.17 2.17 4.13 -1.26 0.04 115.26 118.13 1y8b n ASN 566 Ca -0.00 0.23 0.13 0.00 1.68 0.00 0.00 54.58 56.62 1y8b n ASN 566 Cb 0.12 -0.23 0.55 0.00 -1.54 0.00 0.00 39.78 38.68 1y8b n ASN 566 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1y8b h ALA 567 N 1.00 1.00 0.00 5.41 0.00 -1.93 -2.23 119.26 122.52 1y8b h ALA 567 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1y8b h ALA 567 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1y8b h ALA 567 CO 0.00 0.00 -0.97 -1.91 0.00 0.00 0.00 179.25 176.37 1y8b n GLU 568 N -2.45 0.43 -0.41 0.00 2.13 0.11 -4.15 120.64 116.30 1y8b n GLU 568 Ca 0.01 0.06 0.33 0.00 0.66 0.00 0.00 57.16 58.22 1y8b n GLU 568 Cb 0.24 -1.70 0.62 0.00 0.27 0.00 0.00 31.44 30.86 1y8b n GLU 568 CO 0.00 0.00 0.00 0.74 -0.41 0.00 0.00 177.13 177.46 1y8b h PHE 569 N 0.00 0.52 0.03 4.31 -1.00 -1.55 -0.16 116.94 119.09 1y8b h PHE 569 Ca 0.00 0.02 -0.00 0.00 2.81 0.00 0.00 57.97 60.80 1y8b h PHE 569 Cb 0.85 -0.14 0.00 0.00 3.61 0.00 0.00 35.95 40.28 1y8b h PHE 569 CO 0.00 -0.11 -0.01 0.93 -1.61 0.00 0.00 178.31 177.50 1y8b h GLU 570 N 0.17 -0.03 0.00 1.51 4.39 -1.78 -3.29 114.58 115.55 1y8b h GLU 570 Ca 0.74 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.45 1y8b h GLU 570 Cb 2.27 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 30.93 1y8b h GLU 570 CO -0.35 -0.02 0.64 -1.35 -1.16 0.00 0.00 179.01 176.77 1y8b h PRO 571 N -0.54 0.00 0.61 2.33 0.11 -1.65 -1.52 132.00 131.33 1y8b h PRO 571 Ca -0.00 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.08 1y8b h PRO 571 Cb 0.03 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.14 1y8b h PRO 571 CO 0.01 0.00 -0.29 1.25 -0.21 0.00 0.00 178.00 178.75 1y8b h LEU 572 N 0.00 -0.69 -1.86 2.35 5.85 -1.11 -2.97 115.31 116.88 1y8b h LEU 572 Ca 0.00 0.02 0.31 0.00 0.84 0.00 0.00 57.88 59.04 1y8b h LEU 572 Cb 1.29 0.18 -0.04 0.00 0.37 0.00 0.00 40.66 42.45 1y8b h LEU 572 CO 0.00 -0.29 0.86 0.25 -0.34 0.00 0.00 178.44 178.92 1y8b h LEU 573 N -1.21 0.00 -0.78 2.25 5.85 -1.38 0.50 115.31 120.54 1y8b h LEU 573 Ca -0.08 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.61 1y8b h LEU 573 Cb 0.63 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.63 1y8b h LEU 573 CO 0.14 0.00 0.40 0.44 -0.34 0.00 0.00 178.44 179.07 1y8b h ASP 574 N 0.00 1.01 0.03 1.25 5.19 -1.58 -2.45 116.42 119.87 1y8b h ASP 574 Ca 0.50 -0.12 -0.17 0.00 -0.62 0.00 0.00 57.03 56.62 1y8b h ASP 574 Cb 2.22 -0.26 -0.01 0.00 0.18 0.00 0.00 39.33 41.45 1y8b h ASP 574 CO -0.01 0.84 -0.91 -2.24 -3.12 0.00 0.00 179.24 173.81 1y8b h ASP 575 N 1.10 0.11 -1.05 6.45 2.03 -0.09 -3.35 116.42 121.62 1y8b h ASP 575 Ca 0.27 -0.76 0.31 0.00 -0.73 0.00 0.00 57.03 56.12 1y8b h ASP 575 Cb 0.09 -0.04 -0.13 0.00 -0.83 0.00 0.00 39.33 38.42 1y8b h ASP 575 CO -0.04 1.37 0.63 -0.07 -1.03 0.00 0.00 179.24 180.11 1y8b h LEU 576 N -0.80 0.51 0.00 0.15 3.38 -1.20 0.88 115.31 118.23 1y8b h LEU 576 Ca -0.23 0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1y8b h LEU 576 Cb 1.34 0.08 0.00 0.00 0.09 0.00 0.00 40.66 42.17 1y8b h LEU 576 CO -0.07 -0.04 0.00 -0.11 0.09 0.00 0.00 178.44 178.32 1y8b n LEU 577 N -4.88 0.00 -4.85 1.67 7.94 -0.93 -4.60 117.00 111.35 1y8b n LEU 577 Ca 0.30 0.00 -0.35 0.00 -1.11 0.00 0.00 56.01 54.85 1y8b n LEU 577 Cb 0.96 0.00 -0.06 0.00 0.53 0.00 0.00 43.42 44.85 1y8b n LEU 577 CO 0.16 0.00 0.19 0.42 -1.11 0.00 0.00 177.39 177.04 1y8b s THR 578 N -2.00 4.93 -0.22 1.96 -4.23 0.31 -4.84 115.64 111.55 1y8b s THR 578 Ca 0.00 0.69 -0.07 0.00 -1.18 0.00 0.00 61.69 61.13 1y8b s THR 578 Cb 0.00 -3.70 -0.03 0.00 1.34 0.00 0.00 72.50 70.11 1y8b s THR 578 CO 0.00 0.23 0.07 -0.63 -0.54 0.00 0.00 174.62 173.75 1y8b s ILE 579 N -1.47 4.49 0.00 2.99 1.01 -1.26 -4.96 121.20 121.99 1y8b s ILE 579 Ca 0.37 -0.12 0.00 0.00 0.00 0.00 0.00 60.65 60.90 1y8b s ILE 579 Cb -0.14 -3.07 0.00 0.00 0.01 0.00 0.00 42.46 39.26 1y8b s ILE 579 CO 0.19 0.38 0.08 -2.65 0.00 0.00 0.00 174.94 172.95 1y8b n PRO 580 N 4.37 0.00 -2.16 2.79 -0.02 -1.26 -4.77 135.00 133.95 1y8b n PRO 580 Ca -0.16 0.00 -0.41 0.00 -2.02 0.00 0.00 63.50 60.91 1y8b n PRO 580 Cb 0.52 -1.30 -0.03 0.00 -0.02 0.00 0.00 33.50 32.67 1y8b n PRO 580 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1y8b s VAL 581 N 1.76 3.57 -0.30 -1.45 -7.23 -1.26 -4.88 120.40 110.62 1y8b s VAL 581 Ca 0.00 0.50 -0.11 0.00 -1.81 0.00 0.00 61.98 60.56 1y8b s VAL 581 Cb 0.00 -4.02 0.18 0.00 0.56 0.00 0.00 36.38 33.10 1y8b s VAL 581 CO 0.00 -0.82 0.98 0.00 -0.31 0.00 0.00 175.10 174.95 1y8b s ALA 582 N 7.18 -3.30 0.89 1.32 0.00 -1.26 -3.06 121.76 123.53 1y8b s ALA 582 Ca 0.66 1.48 0.00 0.00 0.00 0.00 0.00 51.96 54.10 1y8b s ALA 582 Cb -0.15 -2.48 0.00 0.00 0.00 0.00 0.00 23.12 20.49 1y8b s ALA 582 CO 0.27 -1.49 0.00 0.39 0.00 0.00 0.00 175.76 174.93 1y8b n GLU 583 N 5.44 2.30 -0.26 0.00 1.02 -1.26 -4.76 120.64 123.13 1y8b n GLU 583 Ca -0.05 0.00 -0.31 0.00 -0.02 0.00 0.00 57.16 56.78 1y8b n GLU 583 Cb 0.54 0.00 0.30 0.00 -0.02 0.00 0.00 31.44 32.25 1y8b n GLU 583 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 1y8b s ASN 584 N -1.00 -1.60 0.00 1.62 0.01 -1.26 -4.69 114.94 108.02 1y8b s ASN 584 Ca 0.00 0.81 0.00 0.00 -0.71 0.00 0.00 52.86 52.96 1y8b s ASN 584 Cb 0.00 -1.12 0.00 0.00 0.41 0.00 0.00 41.25 40.54 1y8b s ASN 584 CO 0.00 -5.69 0.00 0.00 -1.51 0.00 0.00 177.10 169.90 1y8b n ALA 585 N -5.85 0.00 0.00 0.60 0.00 -1.26 -4.84 120.51 109.16 1y8b n ALA 585 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.58 1y8b n ALA 585 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.06 1y8b n ALA 585 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1y8b n ASN 586 N 0.00 0.00 0.00 0.00 4.05 -1.26 -5.00 115.26 113.05 1y8b n ASN 586 Ca 0.00 0.00 -0.00 0.00 0.45 0.00 0.00 54.58 55.03 1y8b n ASN 586 Cb 0.00 0.00 -0.00 0.00 1.23 0.00 0.00 39.78 41.01 1y8b n ASN 586 CO 0.00 0.00 0.00 1.87 -3.05 0.00 0.00 177.26 176.08 1y8b n TRP 587 N 0.00 0.00 -2.92 1.20 -0.00 -1.26 -5.07 117.44 109.39 1y8b n TRP 587 Ca 0.00 0.00 -0.23 0.00 -0.00 0.00 0.00 57.50 57.27 1y8b n TRP 587 Cb 0.00 -0.00 0.01 0.00 -0.00 0.00 0.00 31.31 31.32 1y8b n TRP 587 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 177.69 176.57 1y8b s SER 588 N -4.99 5.81 0.09 5.87 0.01 -1.26 -5.01 113.70 114.21 1y8b s SER 588 Ca -0.00 0.33 -0.06 0.00 1.31 0.00 0.00 55.95 57.53 1y8b s SER 588 Cb 0.00 -1.55 -0.23 0.00 0.21 0.00 0.00 66.02 64.45 1y8b s SER 588 CO 0.00 -0.74 1.17 0.00 0.41 0.00 0.00 173.24 174.09 1y8b h ALA 589 N 0.34 0.14 0.00 1.44 0.00 -2.02 -3.21 119.26 115.95 1y8b h ALA 589 Ca -0.46 -0.82 -0.04 0.00 0.00 0.00 0.00 54.91 53.58 1y8b h ALA 589 Cb 1.25 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.06 1y8b h ALA 589 CO 0.58 0.88 -0.21 -0.56 0.00 0.00 0.00 179.25 179.94 1y8b h GLN 590 N 0.14 0.00 0.06 0.00 3.07 -2.00 -2.96 115.11 113.43 1y8b h GLN 590 Ca -0.13 0.00 0.03 0.00 0.09 0.00 0.00 58.65 58.63 1y8b h GLN 590 Cb 1.87 0.00 -0.04 0.00 0.08 0.00 0.00 27.48 29.39 1y8b h GLN 590 CO 0.20 0.21 -0.30 0.93 0.09 0.00 0.00 178.83 179.96 1y8b h GLU 591 N 0.00 -0.46 0.00 0.06 4.39 -1.96 0.15 114.58 116.76 1y8b h GLU 591 Ca -0.00 0.03 -0.00 0.00 0.34 0.00 0.00 59.36 59.73 1y8b h GLU 591 Cb 0.46 0.11 -0.00 0.00 -0.10 0.00 0.00 28.75 29.22 1y8b h GLU 591 CO 0.03 -0.31 -0.01 0.82 -1.16 0.00 0.00 179.01 178.38 1y8b h ILE 592 N -0.48 0.16 0.00 3.13 1.08 -1.66 -1.19 117.51 118.54 1y8b h ILE 592 Ca 0.04 -0.06 -0.01 0.00 -0.39 0.00 0.00 64.86 64.44 1y8b h ILE 592 Cb 0.54 1.05 -0.00 0.00 -3.07 0.00 0.00 36.82 35.33 1y8b h ILE 592 CO -0.21 0.01 -0.07 1.56 -0.69 0.00 0.00 178.15 178.74 1y8b h GLN 593 N 0.00 0.00 0.00 2.37 4.20 -0.80 -0.60 115.11 120.28 1y8b h GLN 593 Ca -0.00 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.69 1y8b h GLN 593 Cb 0.05 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.83 1y8b h GLN 593 CO 0.00 0.76 -0.11 -0.56 -0.67 0.00 0.00 178.83 178.25 1y8b h GLN 594 N -1.00 0.00 0.04 1.46 3.07 -0.71 -2.16 115.11 115.82 1y8b h GLN 594 Ca -0.02 0.00 -0.22 0.00 0.09 0.00 0.00 58.65 58.50 1y8b h GLN 594 Cb 0.78 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 28.33 1y8b h GLN 594 CO -0.01 0.11 -1.16 1.49 0.09 0.00 0.00 178.83 179.34 1y8b h GLU 595 N 0.00 0.09 0.61 0.06 4.81 -1.31 -3.20 114.58 115.64 1y8b h GLU 595 Ca -0.00 -0.16 -0.02 0.00 -0.13 0.00 0.00 59.36 59.05 1y8b h GLU 595 Cb 0.40 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.83 1y8b h GLU 595 CO 0.01 1.08 -0.43 1.25 -0.73 0.00 0.00 179.01 180.19 1y8b h LEU 596 N -0.71 -1.12 -1.98 1.64 5.85 -1.02 0.32 115.31 118.29 1y8b h LEU 596 Ca -0.29 0.07 0.08 0.00 0.84 0.00 0.00 57.88 58.59 1y8b h LEU 596 Cb 1.45 0.34 -0.01 0.00 0.37 0.00 0.00 40.66 42.81 1y8b h LEU 596 CO -0.07 -0.64 0.41 -2.24 -0.34 0.00 0.00 178.44 175.55 1y8b h ASP 597 N -1.00 0.00 0.24 1.25 2.03 -1.58 0.92 116.42 118.27 1y8b h ASP 597 Ca -0.07 0.00 -0.34 0.00 -0.73 0.00 0.00 57.03 55.88 1y8b h ASP 597 Cb 0.83 0.00 0.02 0.00 -0.83 0.00 0.00 39.33 39.35 1y8b h ASP 597 CO 0.04 0.00 -1.65 -1.13 -1.03 0.00 0.00 179.24 175.46 1y8b h ASN 598 N 0.00 0.68 0.15 4.15 -0.73 -1.12 -3.33 115.58 115.37 1y8b h ASN 598 Ca 0.14 -0.90 -0.01 0.00 1.87 0.00 0.00 56.30 57.40 1y8b h ASN 598 Cb 0.95 -0.22 0.00 0.00 0.27 0.00 0.00 38.32 39.32 1y8b h ASN 598 CO -0.00 1.74 -0.07 0.78 -0.37 0.00 0.00 177.43 179.51 1y8b h ASN 599 N 0.12 -0.17 -1.35 1.15 2.35 0.18 -3.05 115.58 114.82 1y8b h ASN 599 Ca -0.31 -0.36 0.39 0.00 -0.55 0.00 0.00 56.30 55.47 1y8b h ASN 599 Cb 2.12 0.04 -0.05 0.00 0.05 0.00 0.00 38.32 40.48 1y8b h ASN 599 CO 0.21 0.33 1.09 -0.37 -1.65 0.00 0.00 177.43 177.04 1y8b h VAL 600 N -0.74 0.18 -0.39 2.81 -1.51 -1.19 1.24 116.25 116.64 1y8b h VAL 600 Ca -0.02 0.00 -0.13 0.00 -1.23 0.00 0.00 66.70 65.32 1y8b h VAL 600 Cb 0.52 0.21 -0.01 0.00 -2.13 0.00 0.00 31.29 29.88 1y8b h VAL 600 CO 0.03 0.00 -0.29 1.56 -1.23 0.00 0.00 177.57 177.64 1y8b h GLN 601 N 0.00 0.84 0.00 5.19 1.08 -1.64 -0.54 115.11 120.04 1y8b h GLN 601 Ca 0.64 -0.38 -0.07 0.00 -1.45 0.00 0.00 58.65 57.38 1y8b h GLN 601 Cb 2.81 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 30.22 1y8b h GLN 601 CO -0.01 1.02 -0.34 0.78 -0.95 0.00 0.00 178.83 179.33 1y8b h GLY 602 N 0.91 0.00 0.00 3.46 0.00 0.15 -2.11 103.07 105.48 1y8b h GLY 602 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.41 1y8b h GLY 602 CO 0.07 0.00 -0.13 -2.22 0.00 0.00 0.00 176.54 174.26 1y8b h ILE 603 N 0.00 0.00 -0.95 2.60 2.04 -1.15 -2.54 117.51 117.51 1y8b h ILE 603 Ca -0.00 -0.91 0.23 0.00 1.00 0.00 0.00 64.86 65.17 1y8b h ILE 603 Cb 0.74 0.00 -0.07 0.00 -0.74 0.00 0.00 36.82 36.75 1y8b h ILE 603 CO 0.04 0.00 0.63 -0.07 0.00 0.00 0.00 178.15 178.75 1y8b h LEU 604 N -0.91 0.39 0.05 1.44 3.38 -1.19 0.59 115.31 119.05 1y8b h LEU 604 Ca 0.00 0.05 -0.24 0.00 0.09 0.00 0.00 57.88 57.78 1y8b h LEU 604 Cb 0.13 -0.02 0.02 0.00 0.09 0.00 0.00 40.66 40.88 1y8b h LEU 604 CO 0.00 0.13 -0.96 1.23 0.09 0.00 0.00 178.44 178.93 1y8b h GLY 605 N 0.37 0.63 0.87 0.83 0.00 -1.51 -2.19 103.07 102.08 1y8b h GLY 605 Ca 0.51 -1.20 -0.15 0.00 0.00 0.00 0.00 47.33 46.49 1y8b h GLY 605 CO -0.19 1.06 -0.52 -1.82 0.00 0.00 0.00 176.54 175.07 1y8b h TYR 606 N 0.15 0.70 0.55 5.60 3.20 -0.69 -2.91 116.97 123.57 1y8b h TYR 606 Ca -0.13 -0.31 -0.03 0.00 3.14 0.00 0.00 58.73 61.40 1y8b h TYR 606 Cb 1.65 -0.10 0.01 0.00 1.54 0.00 0.00 36.73 39.82 1y8b h TYR 606 CO 0.13 1.10 -0.26 0.28 -1.64 0.00 0.00 178.16 177.76 1y8b h VAL 607 N 0.10 0.00 -0.95 1.81 2.07 0.01 1.12 116.25 120.41 1y8b h VAL 607 Ca -0.04 -0.23 0.29 0.00 0.82 0.00 0.00 66.70 67.54 1y8b h VAL 607 Cb 1.17 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 30.79 1y8b h VAL 607 CO 0.11 0.00 0.41 1.62 0.02 0.00 0.00 177.57 179.73 1y8b h VAL 608 N -0.96 0.28 0.04 2.57 3.04 -1.53 1.61 116.25 121.30 1y8b h VAL 608 Ca -0.08 -0.09 -0.27 0.00 -1.01 0.00 0.00 66.70 65.26 1y8b h VAL 608 Cb 0.56 0.01 -0.03 0.00 -2.01 0.00 0.00 31.29 29.82 1y8b h VAL 608 CO 0.12 0.05 -1.38 0.03 -1.01 0.00 0.00 177.57 175.38 1y8b h ARG 609 N 0.25 0.09 0.00 4.17 3.08 -1.45 -2.98 114.38 117.54 1y8b h ARG 609 Ca 0.66 -0.16 -0.12 0.00 0.07 0.00 0.00 59.98 60.44 1y8b h ARG 609 Cb 1.46 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 31.55 1y8b h ARG 609 CO -0.65 0.91 -0.59 2.35 -1.07 0.00 0.00 179.97 180.92 1y8b h TRP 610 N 0.02 0.00 0.00 3.04 7.01 0.45 0.34 115.95 126.82 1y8b h TRP 610 Ca -0.17 0.00 -0.09 0.00 2.11 0.00 0.00 58.89 60.74 1y8b h TRP 610 Cb 1.92 0.00 -0.01 0.00 -2.10 0.00 0.00 29.16 28.97 1y8b h TRP 610 CO 0.02 0.56 -0.50 0.28 -2.79 0.00 0.00 178.44 176.00 1y8b h VAL 611 N 0.00 1.36 0.00 2.65 2.07 0.21 -3.02 116.25 119.52 1y8b h VAL 611 Ca -0.01 -2.21 -0.20 0.00 0.82 0.00 0.00 66.70 65.10 1y8b h VAL 611 Cb 1.43 2.76 -0.03 0.00 -1.52 0.00 0.00 31.29 33.93 1y8b h VAL 611 CO 0.07 0.46 -1.09 -0.33 0.02 0.00 0.00 177.57 176.70 1y8b h GLU 612 N -1.00 0.00 0.00 1.57 3.07 -1.66 -3.37 114.58 113.19 1y8b h GLU 612 Ca -0.14 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.72 1y8b h GLU 612 Cb 1.08 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.99 1y8b h GLU 612 CO -0.08 0.95 -0.09 0.94 -1.40 0.00 0.00 179.01 179.33 1y8b n GLN 613 N -4.46 0.16 -3.83 2.33 7.27 -0.55 -4.94 117.38 113.36 1y8b n GLN 613 Ca -0.29 0.12 -0.32 0.00 0.07 0.00 0.00 57.00 56.58 1y8b n GLN 613 Cb 0.64 -1.67 0.02 0.00 2.41 0.00 0.00 30.24 31.63 1y8b n GLN 613 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1y8b n GLY 614 N 1.39 -0.72 2.97 1.69 0.00 0.11 -4.90 105.19 105.72 1y8b n GLY 614 Ca 0.06 0.34 -0.17 0.00 0.00 0.00 0.00 46.02 46.25 1y8b n GLY 614 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1y8b s ILE 615 N -3.64 0.48 -0.36 -0.61 1.10 -1.06 -4.81 121.20 112.30 1y8b s ILE 615 Ca 0.33 -0.25 0.04 0.00 -0.51 0.00 0.00 60.65 60.25 1y8b s ILE 615 Cb -0.13 -0.41 0.35 0.00 0.15 0.00 0.00 42.46 42.41 1y8b s ILE 615 CO 0.89 0.14 1.32 0.61 -2.11 0.00 0.00 174.94 175.79 1y8b n GLY 616 N 3.00 2.86 3.59 1.50 0.00 -1.26 -4.06 105.19 110.83 1y8b n GLY 616 Ca -0.14 -0.49 -0.42 0.00 0.00 0.00 0.00 46.02 44.97 1y8b n GLY 616 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y8b s SER 618 N 1.85 5.47 -0.31 0.00 0.15 -1.26 -4.89 113.70 114.71 1y8b s SER 618 Ca 0.34 -0.70 -0.12 0.00 0.70 0.00 0.00 55.95 56.17 1y8b s SER 618 Cb -0.13 -1.97 0.19 0.00 -1.71 0.00 0.00 66.02 62.40 1y8b s SER 618 CO 0.17 -0.24 1.12 -1.59 1.20 0.00 0.00 173.24 173.91 1y8b s LYS 619 N 1.56 0.06 -0.03 5.44 -2.85 -1.26 -4.69 119.74 117.98 1y8b s LYS 619 Ca 0.03 -0.02 0.01 0.00 -1.00 0.00 0.00 55.97 54.99 1y8b s LYS 619 Cb -0.18 0.01 0.02 0.00 -2.06 0.00 0.00 37.83 35.62 1y8b s LYS 619 CO 0.05 -0.09 -0.02 0.14 0.10 0.00 0.00 175.35 175.54 1y8b s VAL 620 N 1.96 0.32 0.43 1.79 -7.23 -1.26 -5.01 120.40 111.41 1y8b s VAL 620 Ca 0.14 -0.01 -0.21 0.00 -1.81 0.00 0.00 61.98 60.09 1y8b s VAL 620 Cb 0.05 -0.37 -0.14 0.00 0.56 0.00 0.00 36.38 36.48 1y8b s VAL 620 CO -0.16 0.17 0.27 -2.65 -0.31 0.00 0.00 175.10 172.41 1y8b n PRO 621 N 3.98 0.24 0.00 4.82 -0.02 -1.26 -3.91 135.00 138.85 1y8b n PRO 621 Ca -0.25 0.09 0.00 0.00 -2.02 0.00 0.00 63.50 61.32 1y8b n PRO 621 Cb 0.51 -1.24 0.00 0.00 -0.02 0.00 0.00 33.50 32.75 1y8b n PRO 621 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1y8b n ASP 622 N 1.81 0.03 0.02 2.55 -0.08 0.25 -4.82 116.55 116.31 1y8b n ASP 622 Ca 0.11 0.00 0.12 0.00 -1.51 0.00 0.00 54.79 53.51 1y8b n ASP 622 Cb 0.41 0.00 0.51 0.00 2.34 0.00 0.00 41.12 44.39 1y8b n ASP 622 CO 0.00 0.00 0.00 2.30 0.12 0.00 0.00 177.20 179.62 1y8b n ILE 623 N 0.00 0.35 -0.68 5.18 -5.35 -1.26 -3.00 119.36 114.61 1y8b n ILE 623 Ca 0.00 0.02 0.03 0.00 -0.27 0.00 0.00 62.75 62.53 1y8b n ILE 623 Cb 0.00 -0.66 0.04 0.00 -1.74 0.00 0.00 39.64 37.28 1y8b n ILE 623 CO 0.00 0.00 0.00 1.41 -1.76 0.00 0.00 176.55 176.20 1y8b n HIS 624 N -1.66 0.00 -0.76 4.28 8.25 -1.26 -4.95 115.22 119.11 1y8b n HIS 624 Ca 0.06 -0.48 0.00 0.00 -0.26 0.00 0.00 57.72 57.04 1y8b n HIS 624 Cb 0.31 -0.07 0.00 0.00 1.12 0.00 0.00 29.99 31.36 1y8b n HIS 624 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1y8b n ASN 625 N -0.60 -0.41 -4.76 0.41 4.05 -1.16 -4.90 115.26 107.88 1y8b n ASN 625 Ca 0.04 0.00 -0.35 0.00 0.45 0.00 0.00 54.58 54.72 1y8b n ASN 625 Cb 0.45 -0.07 0.02 0.00 1.23 0.00 0.00 39.78 41.41 1y8b n ASN 625 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 1y8b s VAL 626 N -3.25 2.92 -0.29 3.44 1.01 -1.26 -4.34 120.40 118.63 1y8b s VAL 626 Ca 0.00 0.56 -0.14 0.00 0.00 0.00 0.00 61.98 62.40 1y8b s VAL 626 Cb 0.00 -3.21 -0.03 0.00 0.00 0.00 0.00 36.38 33.14 1y8b s VAL 626 CO 0.00 -0.13 0.35 0.00 0.00 0.00 0.00 175.10 175.31 1y8b s ALA 627 N -1.73 3.54 -0.03 5.51 0.00 -1.26 -0.59 121.76 127.20 1y8b s ALA 627 Ca 0.74 -0.97 -0.08 0.00 0.00 0.00 0.00 51.96 51.65 1y8b s ALA 627 Cb -0.27 -2.71 -0.05 0.00 0.00 0.00 0.00 23.12 20.09 1y8b s ALA 627 CO 0.31 -0.77 0.25 -0.51 0.00 0.00 0.00 175.76 175.04 1y8b s LEU 628 N 2.02 4.39 -0.16 0.00 2.01 -1.25 -4.88 118.68 120.81 1y8b s LEU 628 Ca 0.13 0.59 -0.02 0.00 0.01 0.00 0.00 54.13 54.84 1y8b s LEU 628 Cb -0.16 -2.48 -0.02 0.00 0.01 0.00 0.00 46.19 43.54 1y8b s LEU 628 CO 0.11 0.31 -0.08 -0.32 1.01 0.00 0.00 176.35 177.37 1y8b s MET 629 N -1.45 3.47 -0.11 1.70 -2.45 -1.26 -4.01 119.30 115.19 1y8b s MET 629 Ca 0.23 -0.62 -0.05 0.00 -1.25 0.00 0.00 55.69 54.00 1y8b s MET 629 Cb -0.13 -2.79 0.05 0.00 1.25 0.00 0.00 34.83 33.21 1y8b s MET 629 CO 0.12 0.14 0.25 -2.00 1.05 0.00 0.00 175.02 174.59 1y8b s GLU 630 N 0.57 0.19 0.00 4.11 2.56 -1.26 -4.89 118.70 119.98 1y8b s GLU 630 Ca -0.06 0.60 0.00 0.00 0.00 0.00 0.00 54.97 55.51 1y8b s GLU 630 Cb -0.15 -0.10 0.00 0.00 2.00 0.00 0.00 34.13 35.88 1y8b s GLU 630 CO 0.03 -0.20 0.00 -0.25 -0.56 0.00 0.00 175.26 174.28 1y8b n ASP 631 N 4.55 1.64 0.00 -1.70 9.92 -1.26 -4.50 116.55 125.21 1y8b n ASP 631 Ca -0.20 -0.34 0.00 0.00 -0.53 0.00 0.00 54.79 53.72 1y8b n ASP 631 Cb 0.52 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.00 1y8b n ASP 631 CO 0.00 0.00 0.00 -1.14 0.13 0.00 0.00 177.20 176.19 1y8b n ARG 632 N -0.06 0.00 -0.30 -1.24 0.63 -1.26 -0.27 116.66 114.16 1y8b n ARG 632 Ca 0.00 0.30 0.34 0.00 -0.92 0.00 0.00 57.85 57.58 1y8b n ARG 632 Cb 0.00 -0.98 0.66 0.00 0.45 0.00 0.00 32.46 32.59 1y8b n ARG 632 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1y8b h ALA 633 N -2.00 3.06 0.00 5.13 0.00 -1.93 2.48 119.26 125.99 1y8b h ALA 633 Ca 0.00 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.73 1y8b h ALA 633 Cb 0.00 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1y8b h ALA 633 CO 0.00 -1.63 -0.95 1.15 0.00 0.00 0.00 179.25 177.82 1y8b h THR 634 N 0.00 0.72 -0.01 0.00 2.02 -1.95 -3.28 112.91 110.41 1y8b h THR 634 Ca 0.56 -2.15 -0.16 0.00 0.77 0.00 0.00 66.41 65.43 1y8b h THR 634 Cb 2.61 2.25 -0.02 0.00 -1.74 0.00 0.00 68.15 71.25 1y8b h THR 634 CO -0.01 0.41 -0.73 0.25 0.37 0.00 0.00 175.52 175.81 1y8b h LEU 635 N 0.00 0.07 -0.31 2.58 6.46 0.74 -1.75 115.31 123.09 1y8b h LEU 635 Ca -0.08 -0.05 -0.10 0.00 -0.12 0.00 0.00 57.88 57.54 1y8b h LEU 635 Cb 1.49 -0.02 -0.01 0.00 -0.73 0.00 0.00 40.66 41.39 1y8b h LEU 635 CO 0.06 0.77 -0.19 -0.09 -0.62 0.00 0.00 178.44 178.37 1y8b h ARG 636 N 0.03 0.67 0.00 1.25 9.65 -1.35 -1.31 114.38 123.32 1y8b h ARG 636 Ca -0.01 -0.31 0.00 0.00 -1.10 0.00 0.00 59.98 58.56 1y8b h ARG 636 Cb 1.29 -0.01 0.00 0.00 -1.39 0.00 0.00 29.97 29.86 1y8b h ARG 636 CO 0.10 0.91 0.00 0.97 2.80 0.00 0.00 179.97 184.75 1y8b h ILE 637 N 0.42 0.00 0.00 1.20 2.10 -1.61 -2.55 117.51 117.08 1y8b h ILE 637 Ca 0.06 -0.61 -0.07 0.00 1.08 0.00 0.00 64.86 65.33 1y8b h ILE 637 Cb 0.73 1.61 -0.01 0.00 -1.09 0.00 0.00 36.82 38.05 1y8b h ILE 637 CO 0.05 0.00 -0.38 0.28 -1.08 0.00 0.00 178.15 177.02 1y8b h SER 638 N 0.00 0.00 0.88 2.19 0.02 -1.11 -2.61 113.55 112.92 1y8b h SER 638 Ca 0.00 -0.77 -0.06 0.00 -0.84 0.00 0.00 61.79 60.13 1y8b h SER 638 Cb 0.80 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.33 1y8b h SER 638 CO 0.00 1.10 -0.27 0.28 -1.14 0.00 0.00 176.83 176.80 1y8b h SER 639 N -1.00 0.00 1.11 3.07 0.02 -1.34 -2.84 113.55 112.57 1y8b h SER 639 Ca -0.10 0.00 -0.18 0.00 -0.84 0.00 0.00 61.79 60.67 1y8b h SER 639 Cb 1.01 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.53 1y8b h SER 639 CO -0.06 0.27 -0.92 1.56 -1.14 0.00 0.00 176.83 176.54 1y8b h GLN 640 N 0.00 0.00 -0.13 3.45 4.20 -1.57 -1.93 115.11 119.12 1y8b h GLN 640 Ca -0.00 0.00 -0.12 0.00 0.06 0.00 0.00 58.65 58.59 1y8b h GLN 640 Cb 0.78 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.57 1y8b h GLN 640 CO 0.04 0.72 -0.37 0.45 -0.67 0.00 0.00 178.83 178.99 1y8b h HIS 641 N 0.00 0.63 0.00 2.96 3.86 -1.23 -2.76 115.15 118.61 1y8b h HIS 641 Ca -0.04 -0.25 -0.10 0.00 -1.16 0.00 0.00 60.37 58.82 1y8b h HIS 641 Cb 1.64 -0.11 -0.01 0.00 1.06 0.00 0.00 27.41 29.98 1y8b h HIS 641 CO 0.00 0.99 -0.55 -0.84 0.86 0.00 0.00 177.93 178.39 1y8b h ILE 642 N 0.09 0.74 0.00 2.45 3.07 -1.61 -3.24 117.51 119.01 1y8b h ILE 642 Ca -0.01 -2.07 -0.06 0.00 1.55 0.00 0.00 64.86 64.27 1y8b h ILE 642 Cb 0.99 2.34 -0.01 0.00 -0.27 0.00 0.00 36.82 39.87 1y8b h ILE 642 CO 0.08 0.42 -0.29 0.00 -1.05 0.00 0.00 178.15 177.31 1y8b h ALA 643 N 1.54 0.91 0.00 0.16 0.00 -1.36 -3.14 119.26 117.37 1y8b h ALA 643 Ca -0.02 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.55 1y8b h ALA 643 Cb 1.36 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 1y8b h ALA 643 CO 0.06 0.36 -0.89 -2.95 0.00 0.00 0.00 179.25 175.82 1y8b h ASN 644 N 0.00 0.00 0.07 0.00 7.08 -1.52 -3.36 115.58 117.85 1y8b h ASN 644 Ca -0.00 0.00 -0.00 0.00 -3.08 0.00 0.00 56.30 53.21 1y8b h ASN 644 Cb 0.96 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.20 1y8b h ASN 644 CO 0.04 0.30 -0.03 -0.50 -2.08 0.00 0.00 177.43 175.16 1y8b h TRP 645 N 0.00 -0.08 -0.23 4.14 -0.00 -1.57 -2.80 115.95 115.41 1y8b h TRP 645 Ca -0.06 -0.00 0.07 0.00 -0.00 0.00 0.00 58.89 58.90 1y8b h TRP 645 Cb 1.28 0.03 -0.01 0.00 -0.00 0.00 0.00 29.16 30.46 1y8b h TRP 645 CO 0.00 0.32 1.02 1.25 -0.00 0.00 0.00 178.44 181.03 1y8b h LEU 646 N -0.50 0.00 -0.37 -4.49 6.46 -1.71 2.21 115.31 116.90 1y8b h LEU 646 Ca -0.01 0.00 -0.10 0.00 -0.12 0.00 0.00 57.88 57.65 1y8b h LEU 646 Cb 0.44 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.35 1y8b h LEU 646 CO 0.01 0.00 -0.46 0.03 -0.62 0.00 0.00 178.44 177.40 1y8b h ARG 647 N 0.00 0.00 -0.00 1.25 3.08 -1.70 -3.05 114.38 113.96 1y8b h ARG 647 Ca 0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.16 1y8b h ARG 647 Cb 2.14 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.19 1y8b h ARG 647 CO -0.00 0.46 -0.00 0.72 -1.07 0.00 0.00 179.97 180.08 1y8b n HIS 648 N -3.33 0.00 -1.82 3.04 8.25 0.75 -4.89 115.22 117.21 1y8b n HIS 648 Ca 0.01 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.42 1y8b n HIS 648 Cb 0.65 -0.10 -0.01 0.00 1.12 0.00 0.00 29.99 31.66 1y8b n HIS 648 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1y8b n GLY 649 N 1.10 0.34 0.08 -1.41 0.00 -1.15 -4.92 105.19 99.22 1y8b n GLY 649 Ca 0.21 -0.73 -0.00 0.00 0.00 0.00 0.00 46.02 45.50 1y8b n GLY 649 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1y8b n ILE 650 N -3.67 0.95 -4.96 -0.61 -0.00 -1.26 -4.86 119.36 104.94 1y8b n ILE 650 Ca -0.06 -0.70 -0.31 0.00 -0.00 0.00 0.00 62.75 61.69 1y8b n ILE 650 Cb 0.43 -0.46 -0.17 0.00 -0.00 0.00 0.00 39.64 39.44 1y8b n ILE 650 CO 0.00 0.00 0.00 -0.76 -0.00 0.00 0.00 176.55 175.79 1y8b s LEU 651 N -5.37 1.99 0.09 7.28 1.43 -1.26 -5.09 118.68 117.76 1y8b s LEU 651 Ca -0.06 -0.52 -0.23 0.00 -1.03 0.00 0.00 54.13 52.29 1y8b s LEU 651 Cb 0.09 -1.30 -0.07 0.00 0.03 0.00 0.00 46.19 44.95 1y8b s LEU 651 CO 0.84 0.11 0.71 0.28 0.23 0.00 0.00 176.35 178.52 1y8b s THR 652 N 0.53 4.60 0.50 5.49 -1.32 -1.26 -4.79 115.64 119.39 1y8b s THR 652 Ca -0.15 1.53 0.38 0.00 -1.21 0.00 0.00 61.69 62.24 1y8b s THR 652 Cb -0.17 -4.06 0.59 0.00 -1.51 0.00 0.00 72.50 67.36 1y8b s THR 652 CO 0.05 0.48 1.64 0.11 -2.21 0.00 0.00 174.62 174.70 1y8b h LYS 653 N 4.86 0.05 -0.33 7.08 1.57 -1.99 0.42 116.57 128.22 1y8b h LYS 653 Ca -0.47 -0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.24 1y8b h LYS 653 Cb 1.21 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.50 1y8b h LYS 653 CO 0.67 0.03 -0.08 1.05 -0.57 0.00 0.00 179.45 180.55 1y8b h GLU 654 N 0.05 0.64 0.77 3.15 4.11 -1.98 -1.80 114.58 119.52 1y8b h GLU 654 Ca 0.81 -0.25 -0.04 0.00 0.07 0.00 0.00 59.36 59.96 1y8b h GLU 654 Cb 2.93 -0.04 0.01 0.00 0.50 0.00 0.00 28.75 32.15 1y8b h GLU 654 CO -0.19 0.81 -0.37 0.37 0.07 0.00 0.00 179.01 179.71 1y8b h GLN 655 N 0.42 -0.99 0.05 1.06 -0.00 -0.54 -1.12 115.11 113.99 1y8b h GLN 655 Ca 0.08 0.07 0.01 0.00 -0.00 0.00 0.00 58.65 58.82 1y8b h GLN 655 Cb 0.58 0.23 -0.04 0.00 0.00 0.00 0.00 27.48 28.24 1y8b h GLN 655 CO 0.03 -0.66 -0.45 0.28 0.00 0.00 0.00 178.83 178.04 1y8b h VAL 656 N -1.24 0.00 -1.07 2.39 2.07 -1.57 0.27 116.25 117.10 1y8b h VAL 656 Ca -0.11 0.00 0.30 0.00 0.82 0.00 0.00 66.70 67.72 1y8b h VAL 656 Cb 0.79 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.51 1y8b h VAL 656 CO 0.17 0.00 0.76 -0.61 0.02 0.00 0.00 177.57 177.91 1y8b h GLN 657 N -0.59 0.07 -0.00 1.57 4.15 -1.39 0.73 115.11 119.65 1y8b h GLN 657 Ca 0.00 -0.00 -0.16 0.00 0.77 0.00 0.00 58.65 59.26 1y8b h GLN 657 Cb 0.62 -0.02 0.01 0.00 0.21 0.00 0.00 27.48 28.30 1y8b h GLN 657 CO -0.27 0.05 -0.61 0.00 -1.93 0.00 0.00 178.83 176.06 1y8b h ALA 658 N 1.49 0.07 -0.60 3.38 0.00 0.62 -3.11 119.26 121.11 1y8b h ALA 658 Ca 0.53 -0.57 0.08 0.00 0.00 0.00 0.00 54.91 54.95 1y8b h ALA 658 Cb 1.96 0.03 -0.10 0.00 0.00 0.00 0.00 17.79 19.68 1y8b h ALA 658 CO -0.06 0.36 -0.48 1.03 0.00 0.00 0.00 179.25 180.10 1y8b h SER 659 N -0.09 -1.66 -0.99 0.00 0.87 0.19 0.36 113.55 112.23 1y8b h SER 659 Ca -0.08 0.26 0.07 0.00 -1.23 0.00 0.00 61.79 60.81 1y8b h SER 659 Cb 1.33 0.73 -0.07 0.00 -0.44 0.00 0.00 62.40 63.95 1y8b h SER 659 CO 0.12 -0.34 0.64 -0.07 -0.53 0.00 0.00 176.83 176.65 1y8b h LEU 660 N -0.23 1.02 -0.66 2.23 4.07 -1.64 0.28 115.31 120.37 1y8b h LEU 660 Ca 0.16 0.01 0.14 0.00 0.08 0.00 0.00 57.88 58.27 1y8b h LEU 660 Cb 0.56 -0.21 -0.10 0.00 1.08 0.00 0.00 40.66 41.99 1y8b h LEU 660 CO -0.71 0.65 0.10 -0.08 -1.08 0.00 0.00 178.44 177.33 1y8b h GLU 661 N 1.15 0.21 0.00 1.13 4.22 -0.24 1.26 114.58 122.32 1y8b h GLU 661 Ca 0.43 -0.01 -0.02 0.00 0.08 0.00 0.00 59.36 59.84 1y8b h GLU 661 Cb 0.17 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.38 1y8b h GLU 661 CO -0.17 0.14 -0.13 -0.97 -2.18 0.00 0.00 179.01 175.69 1y8b h ASN 662 N 0.21 0.00 -0.44 1.04 -0.73 -0.46 -3.32 115.58 111.88 1y8b h ASN 662 Ca 0.36 -0.44 0.08 0.00 1.87 0.00 0.00 56.30 58.17 1y8b h ASN 662 Cb 0.58 0.00 -0.07 0.00 0.27 0.00 0.00 38.32 39.10 1y8b h ASN 662 CO -0.49 0.80 -0.01 0.24 -0.37 0.00 0.00 177.43 177.60 1y8b h MET 663 N -1.00 0.10 -1.03 6.67 2.86 -0.30 0.04 114.93 122.27 1y8b h MET 663 Ca -0.03 -0.01 0.34 0.00 -2.06 0.00 0.00 59.70 57.95 1y8b h MET 663 Cb 0.54 -0.02 -0.15 0.00 0.06 0.00 0.00 31.60 32.03 1y8b h MET 663 CO -0.02 0.07 0.59 0.00 1.06 0.00 0.00 176.91 178.61 1y8b h ALA 664 N 1.39 2.06 0.00 6.32 0.00 0.15 2.21 119.26 131.39 1y8b h ALA 664 Ca 0.22 0.19 -0.03 0.00 0.00 0.00 0.00 54.91 55.29 1y8b h ALA 664 Cb 0.32 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 1y8b h ALA 664 CO -0.37 -0.69 -0.15 -0.22 0.00 0.00 0.00 179.25 177.81 1y8b h LYS 665 N 0.26 0.00 -0.01 0.00 3.64 -1.09 -3.02 116.57 116.35 1y8b h LYS 665 Ca 0.76 0.00 -0.17 0.00 -1.27 0.00 0.00 60.65 59.96 1y8b h LYS 665 Cb 1.83 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.63 1y8b h LYS 665 CO -0.61 0.15 -0.78 0.28 -2.27 0.00 0.00 179.45 176.22 1y8b h VAL 666 N 0.00 1.50 0.00 2.00 2.07 0.40 -3.06 116.25 119.15 1y8b h VAL 666 Ca -0.00 -2.51 -0.10 0.00 0.82 0.00 0.00 66.70 64.91 1y8b h VAL 666 Cb 0.86 2.37 -0.01 0.00 -1.52 0.00 0.00 31.29 32.98 1y8b h VAL 666 CO 0.02 0.73 -0.46 0.58 0.02 0.00 0.00 177.57 178.45 1y8b h VAL 667 N 0.07 0.96 -0.00 2.57 2.07 -1.22 -3.03 116.25 117.67 1y8b h VAL 667 Ca -0.02 -1.86 -0.08 0.00 0.82 0.00 0.00 66.70 65.56 1y8b h VAL 667 Cb 1.37 2.13 -0.01 0.00 -1.52 0.00 0.00 31.29 33.26 1y8b h VAL 667 CO 0.11 0.45 -0.39 -0.78 0.02 0.00 0.00 177.57 176.98 1y8b h ASP 668 N 0.00 0.00 -0.82 0.57 3.58 -1.48 -3.06 116.42 115.21 1y8b h ASP 668 Ca -0.00 -0.00 0.20 0.00 0.42 0.00 0.00 57.03 57.64 1y8b h ASP 668 Cb 1.09 -0.00 -0.14 0.00 1.72 0.00 0.00 39.33 42.00 1y8b h ASP 668 CO 0.06 0.39 0.05 1.56 -2.88 0.00 0.00 179.24 178.42 1y8b h GLN 669 N 0.00 0.11 -0.20 0.28 4.20 -1.56 0.17 115.11 118.11 1y8b h GLN 669 Ca -0.00 -0.01 -0.16 0.00 0.06 0.00 0.00 58.65 58.54 1y8b h GLN 669 Cb 0.69 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.45 1y8b h GLN 669 CO 0.05 0.07 -0.51 0.37 -0.67 0.00 0.00 178.83 178.14 1y8b h GLN 670 N 0.11 0.70 0.00 1.46 4.15 -1.74 -2.74 115.11 117.06 1y8b h GLN 670 Ca 0.47 -0.49 0.00 0.00 0.77 0.00 0.00 58.65 59.40 1y8b h GLN 670 Cb 0.88 0.07 0.00 0.00 0.21 0.00 0.00 27.48 28.64 1y8b h GLN 670 CO -0.71 1.11 0.04 -0.91 -1.93 0.00 0.00 178.83 176.43 1y8b h ASN 671 N 0.41 0.00 -3.46 -0.69 -0.26 -0.77 -3.23 115.58 107.58 1y8b h ASN 671 Ca -0.01 0.00 -0.75 0.00 -0.56 0.00 0.00 56.30 54.98 1y8b h ASN 671 Cb 1.13 0.00 -0.31 0.00 -1.06 0.00 0.00 38.32 38.07 1y8b h ASN 671 CO 0.11 0.00 0.19 0.00 -1.06 0.00 0.00 177.43 176.67 1y8b s ALA 672 N -3.71 4.50 -2.00 -0.83 0.00 -0.09 -4.85 121.76 114.77 1y8b s ALA 672 Ca -0.03 -3.83 0.01 0.00 0.00 0.00 0.00 51.96 48.10 1y8b s ALA 672 Cb 0.08 -3.21 0.03 0.00 0.00 0.00 0.00 23.12 20.02 1y8b s ALA 672 CO 0.25 -2.18 0.51 0.41 0.00 0.00 0.00 175.76 174.75 1y8b n GLY 673 N 2.55 -0.02 3.46 0.00 0.00 -1.22 -4.57 105.19 105.38 1y8b n GLY 673 Ca 0.22 -0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.01 1y8b n GLY 673 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1y8b s ASP 674 N -2.00 3.09 0.05 1.61 1.11 -1.26 -5.06 116.67 114.20 1y8b s ASP 674 Ca 0.01 -1.17 -0.09 0.00 0.18 0.00 0.00 52.55 51.48 1y8b s ASP 674 Cb 0.00 -0.23 -0.02 0.00 1.07 0.00 0.00 42.92 43.75 1y8b s ASP 674 CO 0.01 -0.27 1.08 -2.65 1.18 0.00 0.00 175.17 174.51 1y8b n PRO 675 N -0.64 -0.13 -0.45 8.23 -0.02 -1.26 -3.93 135.00 136.81 1y8b n PRO 675 Ca -0.05 1.07 0.00 0.00 -2.02 0.00 0.00 63.50 62.50 1y8b n PRO 675 Cb 0.63 -1.59 0.00 0.00 -0.02 0.00 0.00 33.50 32.52 1y8b n PRO 675 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1y8b n ALA 676 N -3.04 1.92 -1.55 3.55 0.00 -1.26 -5.04 120.51 115.09 1y8b n ALA 676 Ca 0.01 -0.99 -0.37 0.00 0.00 0.00 0.00 53.44 52.09 1y8b n ALA 676 Cb 0.07 -0.45 -0.04 0.00 0.00 0.00 0.00 19.45 19.03 1y8b n ALA 676 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 1y8b n TYR 677 N -0.03 1.39 -3.51 0.00 9.36 -1.25 -4.90 117.16 118.22 1y8b n TYR 677 Ca 0.00 0.13 -0.42 0.00 3.32 0.00 0.00 57.90 60.93 1y8b n TYR 677 Cb 0.68 -2.63 -0.09 0.00 -0.63 0.00 0.00 39.34 36.67 1y8b n TYR 677 CO 0.00 0.00 0.00 1.03 0.22 0.00 0.00 176.86 178.11 1y8b s ARG 678 N 8.28 2.82 0.68 2.98 3.00 -1.26 -4.80 118.95 130.66 1y8b s ARG 678 Ca 1.01 -1.30 -0.11 0.00 0.00 0.00 0.00 55.73 55.32 1y8b s ARG 678 Cb -0.25 -3.92 0.00 0.00 0.00 0.00 0.00 34.95 30.79 1y8b s ARG 678 CO 0.28 -0.91 1.07 -1.25 0.00 0.00 0.00 175.30 174.49 1y8b s PRO 679 N 1.55 3.02 0.20 3.54 0.04 -1.26 -4.96 135.00 137.13 1y8b s PRO 679 Ca 0.03 0.49 0.26 0.00 0.04 0.00 0.00 61.00 61.82 1y8b s PRO 679 Cb -0.22 -2.05 0.88 0.00 0.04 0.00 0.00 34.50 33.15 1y8b s PRO 679 CO 0.05 -0.91 1.77 0.00 0.04 0.00 0.00 177.00 177.95 1y8b n MET 680 N -2.92 0.22 -1.18 4.56 0.00 -1.26 -3.33 117.12 113.20 1y8b n MET 680 Ca 0.07 0.24 -0.28 0.00 0.00 0.00 0.00 57.70 57.73 1y8b n MET 680 Cb 0.56 -1.79 0.06 0.00 0.00 0.00 0.00 33.22 32.06 1y8b n MET 680 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1y8b n ALA 681 N -1.75 5.87 -2.65 3.17 0.00 -1.26 -4.40 120.51 119.49 1y8b n ALA 681 Ca 0.05 -2.77 -0.03 0.00 0.00 0.00 0.00 53.44 50.69 1y8b n ALA 681 Cb 0.37 -1.64 0.11 0.00 0.00 0.00 0.00 19.45 18.30 1y8b n ALA 681 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1y8b n GLY 682 N -0.37 -1.80 0.00 0.00 0.00 -1.21 -5.01 105.19 96.81 1y8b n GLY 682 Ca 0.49 0.99 0.03 0.00 0.00 0.00 0.00 46.02 47.54 1y8b n GLY 682 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1y8b n ASN 683 N 0.65 1.72 0.27 1.61 5.03 -1.26 -4.54 115.26 118.74 1y8b n ASN 683 Ca -0.06 -0.36 0.06 0.00 0.87 0.00 0.00 54.58 55.09 1y8b n ASN 683 Cb 0.76 1.15 0.31 0.00 -1.02 0.00 0.00 39.78 40.97 1y8b n ASN 683 CO 0.00 0.00 0.00 2.19 -1.83 0.00 0.00 177.26 177.62 1y8b h PHE 684 N 0.00 0.00 -0.05 3.10 -5.15 -1.94 1.03 116.94 113.93 1y8b h PHE 684 Ca 0.00 0.00 -0.05 0.00 -0.20 0.00 0.00 57.97 57.72 1y8b h PHE 684 Cb 0.23 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 36.39 1y8b h PHE 684 CO 0.00 0.00 -0.22 0.00 -2.00 0.00 0.00 178.31 176.09 1y8b h ALA 685 N 0.62 1.55 0.00 12.09 0.00 -1.86 -3.27 119.26 128.39 1y8b h ALA 685 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1y8b h ALA 685 Cb 1.26 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1y8b h ALA 685 CO 0.00 0.33 -0.11 0.27 0.00 0.00 0.00 179.25 179.75 1y8b n ASN 686 N -4.25 0.29 -4.72 0.00 0.23 0.31 -4.09 115.26 103.03 1y8b n ASN 686 Ca -0.02 -1.39 -0.35 0.00 -0.53 0.00 0.00 54.58 52.30 1y8b n ASN 686 Cb 0.30 -0.06 -0.09 0.00 -2.08 0.00 0.00 39.78 37.85 1y8b n ASN 686 CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 1y8b s SER 687 N -0.42 5.43 0.39 0.53 0.15 0.12 -4.96 113.70 114.94 1y8b s SER 687 Ca 0.01 0.18 0.31 0.00 0.70 0.00 0.00 55.95 57.15 1y8b s SER 687 Cb 0.01 -1.56 1.30 0.00 -1.71 0.00 0.00 66.02 64.06 1y8b s SER 687 CO 0.00 0.37 1.31 0.00 1.20 0.00 0.00 173.24 176.12 1y8b h ALA 689 N 1.21 1.80 0.00 0.00 0.00 -1.92 0.75 119.26 121.10 1y8b h ALA 689 Ca 0.75 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.66 1y8b h ALA 689 Cb 2.57 0.01 0.00 0.00 0.00 0.00 0.00 17.79 20.37 1y8b h ALA 689 CO -0.30 -0.77 0.00 0.27 0.00 0.00 0.00 179.25 178.45 1y8b h PHE 690 N 0.00 0.00 0.00 0.00 -5.15 0.11 -0.90 116.94 111.00 1y8b h PHE 690 Ca 0.04 0.00 -0.01 0.00 -0.20 0.00 0.00 57.97 57.80 1y8b h PHE 690 Cb 1.49 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 37.66 1y8b h PHE 690 CO 0.00 0.00 -0.05 1.57 -2.00 0.00 0.00 178.31 177.83 1y8b h LYS 691 N 0.00 0.00 -0.22 6.09 5.09 0.30 -1.99 116.57 125.84 1y8b h LYS 691 Ca 0.00 0.00 0.02 0.00 0.09 0.00 0.00 60.65 60.76 1y8b h LYS 691 Cb 0.02 0.00 -0.02 0.00 0.10 0.00 0.00 32.23 32.33 1y8b h LYS 691 CO 0.00 0.05 0.08 0.00 -2.09 0.00 0.00 179.45 177.48 1y8b h ALA 692 N 1.95 0.25 0.00 0.07 0.00 -1.37 1.08 119.26 121.24 1y8b h ALA 692 Ca -0.00 0.02 -0.19 0.00 0.00 0.00 0.00 54.91 54.74 1y8b h ALA 692 Cb 0.19 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 1y8b h ALA 692 CO 0.01 -0.34 -0.96 0.00 0.00 0.00 0.00 179.25 177.95 1y8b h ALA 693 N 1.14 0.48 0.15 0.00 0.00 -1.68 -3.20 119.26 116.15 1y8b h ALA 693 Ca 0.10 -0.85 -0.01 0.00 0.00 0.00 0.00 54.91 54.15 1y8b h ALA 693 Cb 0.06 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1y8b h ALA 693 CO -0.10 1.12 -0.07 0.66 0.00 0.00 0.00 179.25 180.86 1y8b h SER 694 N 0.00 -0.17 -1.11 0.00 4.64 -0.98 -3.22 113.55 112.70 1y8b h SER 694 Ca -0.04 -0.26 0.31 0.00 -0.47 0.00 0.00 61.79 61.32 1y8b h SER 694 Cb 1.69 0.04 -0.09 0.00 -0.31 0.00 0.00 62.40 63.74 1y8b h SER 694 CO 0.11 0.40 0.73 0.44 -0.87 0.00 0.00 176.83 177.64 1y8b h ASP 695 N -0.98 0.33 -1.30 4.97 5.19 0.11 0.38 116.42 125.11 1y8b h ASP 695 Ca -0.02 0.08 0.39 0.00 -0.62 0.00 0.00 57.03 56.85 1y8b h ASP 695 Cb 0.43 0.03 -0.09 0.00 0.18 0.00 0.00 39.33 39.87 1y8b h ASP 695 CO 0.03 0.03 0.88 0.25 -3.12 0.00 0.00 179.24 177.32 1y8b h LEU 696 N 0.27 0.20 0.03 1.55 6.46 -1.56 1.15 115.31 123.41 1y8b h LEU 696 Ca 0.62 0.07 -0.24 0.00 -0.12 0.00 0.00 57.88 58.21 1y8b h LEU 696 Cb 1.82 0.05 -0.02 0.00 -0.73 0.00 0.00 40.66 41.77 1y8b h LEU 696 CO -0.26 -0.04 -1.18 0.40 -0.62 0.00 0.00 178.44 176.74 1y8b h ILE 697 N 0.13 1.52 0.43 4.05 2.04 -0.40 -2.88 117.51 122.40 1y8b h ILE 697 Ca 0.71 -3.22 -0.02 0.00 1.00 0.00 0.00 64.86 63.33 1y8b h ILE 697 Cb 2.38 2.81 0.00 0.00 -0.74 0.00 0.00 36.82 41.28 1y8b h ILE 697 CO -0.22 0.89 -0.21 -0.26 0.00 0.00 0.00 178.15 178.35 1y8b h PHE 698 N 0.02 -0.53 0.00 1.37 -1.00 0.13 -2.87 116.94 114.06 1y8b h PHE 698 Ca -0.09 -0.01 0.00 0.00 2.81 0.00 0.00 57.97 60.68 1y8b h PHE 698 Cb 1.86 0.18 0.00 0.00 3.61 0.00 0.00 35.95 41.59 1y8b h PHE 698 CO 0.02 -0.33 0.00 1.47 -1.61 0.00 0.00 178.31 177.86 1y8b n LEU 699 N -4.61 0.00 -0.05 1.54 -0.00 -0.25 -3.06 117.00 110.57 1y8b n LEU 699 Ca -0.07 0.00 -0.15 0.00 -0.00 0.00 0.00 56.01 55.79 1y8b n LEU 699 Cb 0.23 0.00 -0.07 0.00 -0.00 0.00 0.00 43.42 43.58 1y8b n LEU 699 CO 0.17 0.00 0.43 1.23 -0.00 0.00 0.00 177.39 179.22 1y8b h GLY 700 N 2.90 0.67 0.60 1.47 0.00 -1.27 -1.66 103.07 105.78 1y8b h GLY 700 Ca 0.00 -0.85 -0.06 0.00 0.00 0.00 0.00 47.33 46.42 1y8b h GLY 700 CO 0.00 0.76 -0.19 -0.39 0.00 0.00 0.00 176.54 176.71 1y8b h VAL 701 N 0.28 1.44 0.00 4.60 -1.51 -1.69 -2.68 116.25 116.69 1y8b h VAL 701 Ca -0.01 -1.59 0.00 0.00 -1.23 0.00 0.00 66.70 63.88 1y8b h VAL 701 Cb 1.07 2.31 0.00 0.00 -2.13 0.00 0.00 31.29 32.54 1y8b h VAL 701 CO 0.10 0.44 0.00 0.29 -1.23 0.00 0.00 177.57 177.17 1y8b n LYS 702 N -4.56 0.70 -1.81 5.19 4.01 -1.24 -4.78 118.16 115.68 1y8b n LYS 702 Ca -0.08 0.00 -0.42 0.00 -0.51 0.00 0.00 58.31 57.30 1y8b n LYS 702 Cb 0.42 -1.09 -0.03 0.00 -0.51 0.00 0.00 35.03 33.83 1y8b n LYS 702 CO 0.00 0.00 0.00 -1.14 -1.11 0.00 0.00 177.40 175.15 1y8b s GLN 703 N -2.00 4.16 0.86 1.97 0.74 -0.62 -4.94 119.66 119.82 1y8b s GLN 703 Ca 0.06 2.45 -0.17 0.00 0.05 0.00 0.00 55.36 57.75 1y8b s GLN 703 Cb 0.03 -4.03 -0.07 0.00 1.10 0.00 0.00 33.01 30.04 1y8b s GLN 703 CO 0.05 -0.90 -0.73 -2.30 -0.55 0.00 0.00 175.29 170.86 1y8b n PRO 704 N 7.14 -0.42 -0.09 1.67 -0.02 -1.24 -4.95 135.00 137.09 1y8b n PRO 704 Ca 0.19 -0.12 -0.20 0.00 -2.02 0.00 0.00 63.50 61.34 1y8b n PRO 704 Cb 0.41 -1.12 -0.12 0.00 -0.02 0.00 0.00 33.50 32.64 1y8b n PRO 704 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 1y8b n ASN 705 N 2.28 2.02 -1.02 2.55 6.94 -1.26 -4.28 115.26 122.49 1y8b n ASN 705 Ca -0.00 0.03 0.11 0.00 -0.02 0.00 0.00 54.58 54.70 1y8b n ASN 705 Cb 0.47 -0.61 0.26 0.00 -2.36 0.00 0.00 39.78 37.55 1y8b n ASN 705 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1y8b n GLY 706 N 2.06 1.46 2.49 4.83 0.00 -1.26 -4.60 105.19 110.17 1y8b n GLY 706 Ca -0.42 -0.64 -0.25 0.00 0.00 0.00 0.00 46.02 44.71 1y8b n GLY 706 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1y8b s TYR 707 N -1.45 0.60 0.00 1.61 5.04 -1.26 -4.95 117.35 116.93 1y8b s TYR 707 Ca 0.38 -1.80 0.00 0.00 -2.44 0.00 0.00 57.07 53.21 1y8b s TYR 707 Cb 0.21 -0.76 0.00 0.00 0.35 0.00 0.00 41.96 41.76 1y8b s TYR 707 CO 0.29 -0.88 0.00 0.25 -1.34 0.00 0.00 175.55 173.87 1y8b n THR 708 N 3.40 0.00 -0.12 4.34 -2.24 -1.26 -3.60 114.28 114.79 1y8b n THR 708 Ca 0.21 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.87 1y8b n THR 708 Cb 0.45 -0.86 -0.02 0.00 -2.10 0.00 0.00 70.33 67.79 1y8b n THR 708 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1y8b h GLU 709 N 0.00 0.83 0.00 -0.78 5.08 -1.95 -3.09 114.58 114.67 1y8b h GLU 709 Ca 0.00 -0.40 0.00 0.00 -1.00 0.00 0.00 59.36 57.96 1y8b h GLU 709 Cb 0.94 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.18 1y8b h GLU 709 CO 0.00 1.04 0.32 -2.30 -1.00 0.00 0.00 179.01 177.06 1y8b n PRO 710 N -4.20 0.08 -0.33 2.33 -0.02 -1.26 -2.63 135.00 128.97 1y8b n PRO 710 Ca -0.02 0.54 0.17 0.00 -2.02 0.00 0.00 63.50 62.17 1y8b n PRO 710 Cb 0.47 -2.07 0.37 0.00 -0.02 0.00 0.00 33.50 32.26 1y8b n PRO 710 CO 0.00 0.00 0.00 1.37 1.98 0.00 0.00 175.50 178.85 1y8b h LEU 711 N 0.00 0.52 -0.03 2.45 8.10 -1.85 0.17 115.31 124.67 1y8b h LEU 711 Ca 0.00 0.15 -0.03 0.00 0.11 0.00 0.00 57.88 58.12 1y8b h LEU 711 Cb 0.63 0.09 0.00 0.00 -0.44 0.00 0.00 40.66 40.94 1y8b h LEU 711 CO 0.00 0.02 -0.08 -0.07 -4.11 0.00 0.00 178.44 174.20 1y8b h LEU 712 N 0.47 0.12 -2.10 0.17 3.38 -1.79 -2.83 115.31 112.72 1y8b h LEU 712 Ca 0.63 -0.61 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1y8b h LEU 712 Cb 1.25 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.97 1y8b h LEU 712 CO -0.52 0.71 0.23 0.45 0.09 0.00 0.00 178.44 179.39 1y8b h HIS 713 N -0.46 0.00 0.00 1.13 3.86 -1.28 1.23 115.15 119.64 1y8b h HIS 713 Ca -0.00 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1y8b h HIS 713 Cb 0.69 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.16 1y8b h HIS 713 CO 0.13 0.00 -0.00 0.00 0.86 0.00 0.00 177.93 178.92 1y8b h ALA 714 N 1.53 -0.01 0.00 2.45 0.00 -0.80 -3.20 119.26 119.23 1y8b h ALA 714 Ca 0.00 -0.43 -0.10 0.00 0.00 0.00 0.00 54.91 54.38 1y8b h ALA 714 Cb 0.45 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1y8b h ALA 714 CO 0.00 -0.02 -0.82 2.35 0.00 0.00 0.00 179.25 180.75 1y8b h TRP 715 N -0.97 0.00 0.31 0.00 7.01 -1.17 -3.07 115.95 118.07 1y8b h TRP 715 Ca -0.00 0.00 -0.01 0.00 2.11 0.00 0.00 58.89 60.98 1y8b h TRP 715 Cb 0.86 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.92 1y8b h TRP 715 CO 0.24 0.38 -0.15 -0.09 -2.79 0.00 0.00 178.44 176.03 1y8b h ARG 716 N 0.00 -0.40 -0.02 2.65 9.65 0.14 -1.15 114.38 125.24 1y8b h ARG 716 Ca -0.06 0.03 -0.00 0.00 -1.10 0.00 0.00 59.98 58.85 1y8b h ARG 716 Cb 1.34 0.09 -0.00 0.00 -1.39 0.00 0.00 29.97 30.01 1y8b h ARG 716 CO 0.04 -0.17 -0.00 -0.07 2.80 0.00 0.00 179.97 182.57 1y8b h LEU 717 N -0.56 0.05 -1.05 3.80 4.07 -1.69 -1.69 115.31 118.24 1y8b h LEU 717 Ca -0.04 -0.35 0.25 0.00 0.08 0.00 0.00 57.88 57.82 1y8b h LEU 717 Cb 0.41 -0.01 -0.12 0.00 1.08 0.00 0.00 40.66 42.02 1y8b h LEU 717 CO 0.07 0.38 0.61 -0.09 -1.08 0.00 0.00 178.44 178.33 1y8b h ARG 718 N -0.29 0.54 -0.19 1.13 9.65 -1.53 0.51 114.38 124.20 1y8b h ARG 718 Ca 0.01 -0.03 -0.21 0.00 -1.10 0.00 0.00 59.98 58.65 1y8b h ARG 718 Cb 0.36 -0.12 0.01 0.00 -1.39 0.00 0.00 29.97 28.82 1y8b h ARG 718 CO 0.00 0.36 -0.70 0.93 2.80 0.00 0.00 179.97 183.36 1y8b h GLU 719 N 0.55 0.77 -0.14 0.20 5.08 -0.97 -0.74 114.58 119.33 1y8b h GLU 719 Ca 0.64 -0.58 -0.03 0.00 -1.00 0.00 0.00 59.36 58.39 1y8b h GLU 719 Cb 1.27 0.10 -0.00 0.00 0.50 0.00 0.00 28.75 30.62 1y8b h GLU 719 CO -0.45 1.20 -0.04 -0.22 -1.00 0.00 0.00 179.01 178.49 1y8b h LYS 720 N 0.55 0.28 0.69 2.33 3.11 0.42 1.41 116.57 125.36 1y8b h LYS 720 Ca -0.03 -0.11 -0.03 0.00 -2.81 0.00 0.00 60.65 57.66 1y8b h LYS 720 Cb 1.31 -0.01 0.01 0.00 -1.00 0.00 0.00 32.23 32.54 1y8b h LYS 720 CO 0.14 0.58 -0.33 1.49 -2.81 0.00 0.00 179.45 178.52 1y8b h GLU 721 N -0.03 -0.90 0.00 1.90 4.81 -0.21 -2.79 114.58 117.37 1y8b h GLU 721 Ca 0.04 0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.33 1y8b h GLU 721 Cb 0.48 0.20 0.00 0.00 0.63 0.00 0.00 28.75 30.06 1y8b h GLU 721 CO 0.02 -0.57 0.00 1.03 -0.73 0.00 0.00 179.01 178.76 1y8b h SER 722 N -1.13 0.00 0.00 1.04 0.87 -1.19 -3.51 113.55 109.62 1y8b h SER 722 Ca -0.10 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.46 1y8b h SER 722 Cb 0.74 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.70 1y8b h SER 722 CO 0.16 0.00 0.00 1.57 -0.53 0.00 0.00 176.83 178.03