#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 3.57 0.47 -5.12 0.00 -1.26 -5.07 121.76 114.35 1y8b s ALA 2 Ca 0.00 -0.49 -0.16 0.00 0.00 0.00 0.00 51.96 51.31 1y8b s ALA 2 Cb 0.00 -2.38 -0.08 0.00 0.00 0.00 0.00 23.12 20.66 1y8b s ALA 2 CO 0.00 0.19 0.92 -1.14 0.00 0.00 0.00 175.76 175.73 1y8b s GLN 3 N -3.61 3.94 -0.28 0.00 0.74 -1.26 -5.07 119.66 114.12 1y8b s GLN 3 Ca 0.45 0.85 -0.21 0.00 0.05 0.00 0.00 55.36 56.50 1y8b s GLN 3 Cb -0.11 -2.21 0.12 0.00 1.10 0.00 0.00 33.01 31.91 1y8b s GLN 3 CO 0.30 -0.17 0.93 0.99 -0.55 0.00 0.00 175.29 176.79 1y8b s THR 4 N -2.49 0.00 -0.18 -0.34 2.01 -1.26 -4.58 115.64 108.79 1y8b s THR 4 Ca 0.57 0.00 -0.03 0.00 0.31 0.00 0.00 61.69 62.54 1y8b s THR 4 Cb -0.10 -1.00 -0.02 0.00 0.01 0.00 0.00 72.50 71.39 1y8b s THR 4 CO 0.29 0.00 -0.05 -0.63 -0.69 0.00 0.00 174.62 173.53 1y8b s ILE 5 N 0.74 3.53 -0.55 1.82 -1.09 -1.19 -4.98 121.20 119.47 1y8b s ILE 5 Ca -0.02 -0.46 -0.23 0.00 -2.23 0.00 0.00 60.65 57.71 1y8b s ILE 5 Cb -0.05 -2.57 0.05 0.00 -1.58 0.00 0.00 42.46 38.32 1y8b s ILE 5 CO -0.09 0.46 0.85 0.28 -1.23 0.00 0.00 174.94 175.21 1y8b s THR 6 N 0.88 4.52 -0.20 2.92 -1.32 -1.26 -3.07 115.64 118.11 1y8b s THR 6 Ca -0.01 -0.01 -0.19 0.00 -1.21 0.00 0.00 61.69 60.27 1y8b s THR 6 Cb -0.15 -4.48 -0.03 0.00 -1.51 0.00 0.00 72.50 66.33 1y8b s THR 6 CO 0.01 -1.06 0.54 -1.10 -2.21 0.00 0.00 174.62 170.80 1y8b s GLN 7 N 3.58 4.19 3.07 7.08 -1.52 -0.52 -4.85 119.66 130.68 1y8b s GLN 7 Ca 0.25 0.44 0.00 0.00 -1.95 0.00 0.00 55.36 54.10 1y8b s GLN 7 Cb -0.15 -3.57 0.00 0.00 -0.22 0.00 0.00 33.01 29.07 1y8b s GLN 7 CO 0.16 -0.17 0.00 0.43 -0.25 0.00 0.00 175.29 175.46 1y8b n SER 8 N 4.85 0.00 0.00 5.90 7.64 -1.26 -0.39 113.62 130.36 1y8b n SER 8 Ca -0.04 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.84 1y8b n SER 8 Cb 0.50 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.70 1y8b n SER 8 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 1y8b n ARG 9 N 0.00 1.30 -4.24 1.43 3.00 -1.26 -5.05 116.66 111.84 1y8b n ARG 9 Ca 0.00 -0.97 -0.25 0.00 -0.00 0.00 0.00 57.85 56.64 1y8b n ARG 9 Cb 0.00 -0.86 -0.07 0.00 0.00 0.00 0.00 32.46 31.52 1y8b n ARG 9 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.63 177.15 1y8b s LEU 10 N -0.51 3.29 0.28 6.15 2.34 0.47 -4.81 118.68 125.89 1y8b s LEU 10 Ca 0.00 -0.50 0.06 0.00 0.06 0.00 0.00 54.13 53.74 1y8b s LEU 10 Cb 0.00 -1.87 -0.02 0.00 -0.56 0.00 0.00 46.19 43.74 1y8b s LEU 10 CO 0.00 0.04 0.41 -0.13 -1.06 0.00 0.00 176.35 175.61 1y8b s ARG 11 N -3.34 3.31 -0.08 1.48 0.52 -1.25 -1.44 118.95 118.15 1y8b s ARG 11 Ca 0.29 -0.85 -0.25 0.00 -0.52 0.00 0.00 55.73 54.40 1y8b s ARG 11 Cb -0.08 -2.86 0.06 0.00 0.52 0.00 0.00 34.95 32.59 1y8b s ARG 11 CO 0.20 0.28 0.58 0.96 0.02 0.00 0.00 175.30 177.33 1y8b s ILE 12 N -2.07 0.01 -0.07 1.52 -4.36 -1.18 -4.54 121.20 110.52 1y8b s ILE 12 Ca 0.39 -0.11 -0.30 0.00 -0.26 0.00 0.00 60.65 60.37 1y8b s ILE 12 Cb -0.09 -0.88 -0.02 0.00 1.25 0.00 0.00 42.46 42.72 1y8b s ILE 12 CO 0.30 -0.06 0.99 -1.81 0.24 0.00 0.00 174.94 174.60 1y8b s ASP 13 N -0.91 7.28 0.38 4.36 1.11 -1.26 -3.20 116.67 124.43 1y8b s ASP 13 Ca -0.09 1.56 0.21 0.00 0.18 0.00 0.00 52.55 54.41 1y8b s ASP 13 Cb -0.02 -2.56 0.56 0.00 1.07 0.00 0.00 42.92 41.97 1y8b s ASP 13 CO 0.07 -0.38 1.67 0.00 1.18 0.00 0.00 175.17 177.70 1y8b h ALA 14 N 7.00 0.90 -0.00 5.23 0.00 -1.94 -2.55 119.26 127.90 1y8b h ALA 14 Ca -0.34 -0.27 -0.14 0.00 0.00 0.00 0.00 54.91 54.15 1y8b h ALA 14 Cb 1.17 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 1y8b h ALA 14 CO 0.82 0.38 -0.69 -0.97 0.00 0.00 0.00 179.25 178.79 1y8b h ASN 15 N 0.00 0.00 0.74 0.00 -1.24 -1.91 -2.86 115.58 110.32 1y8b h ASN 15 Ca -0.00 -0.00 -0.25 0.00 0.71 0.00 0.00 56.30 56.75 1y8b h ASN 15 Cb 1.00 -0.00 -0.03 0.00 0.73 0.00 0.00 38.32 40.01 1y8b h ASN 15 CO 0.04 0.69 -1.32 0.15 -1.29 0.00 0.00 177.43 175.69 1y8b h PHE 16 N 0.00 0.06 0.00 0.67 3.04 -1.93 -3.28 116.94 115.50 1y8b h PHE 16 Ca -0.01 -0.05 -0.04 0.00 3.98 0.00 0.00 57.97 61.86 1y8b h PHE 16 Cb 1.21 -0.00 -0.01 0.00 2.56 0.00 0.00 35.95 39.71 1y8b h PHE 16 CO 0.00 1.05 -0.19 0.87 -2.02 0.00 0.00 178.31 178.02 1y8b h LYS 17 N 0.01 0.00 -0.45 1.11 6.56 -1.41 -2.45 116.57 119.94 1y8b h LYS 17 Ca -0.14 0.00 -0.12 0.00 -1.06 0.00 0.00 60.65 59.33 1y8b h LYS 17 Cb 1.89 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 33.54 1y8b h LYS 17 CO 0.12 0.19 -0.18 0.00 -2.06 0.00 0.00 179.45 177.51 1y8b h ARG 18 N 0.00 0.91 0.04 3.15 2.47 -1.56 1.14 114.38 120.53 1y8b h ARG 18 Ca -0.00 -0.38 -0.23 0.00 -1.26 0.00 0.00 59.98 58.10 1y8b h ARG 18 Cb 0.68 -0.03 -0.00 0.00 -1.65 0.00 0.00 29.97 28.97 1y8b h ARG 18 CO 0.02 1.04 -1.01 0.35 0.56 0.00 0.00 179.97 180.93 1y8b h PHE 19 N 0.75 0.49 0.16 3.04 3.57 -1.66 -1.82 116.94 121.47 1y8b h PHE 19 Ca 0.10 -0.29 -0.30 0.00 3.53 0.00 0.00 57.97 61.01 1y8b h PHE 19 Cb 0.75 -0.04 0.01 0.00 2.79 0.00 0.00 35.95 39.45 1y8b h PHE 19 CO 0.05 1.14 -1.46 0.28 -2.23 0.00 0.00 178.31 176.10 1y8b h VAL 20 N 0.15 1.10 -0.21 1.41 2.07 -1.37 -1.47 116.25 117.93 1y8b h VAL 20 Ca -0.08 -2.49 -0.17 0.00 0.82 0.00 0.00 66.70 64.77 1y8b h VAL 20 Cb 1.67 2.84 0.00 0.00 -1.52 0.00 0.00 31.29 34.29 1y8b h VAL 20 CO 0.17 0.77 -0.55 -0.78 0.02 0.00 0.00 177.57 177.20 1y8b h ASP 21 N -0.11 0.85 0.75 0.57 3.58 0.12 0.14 116.42 122.32 1y8b h ASP 21 Ca -0.29 -0.57 0.00 0.00 0.42 0.00 0.00 57.03 56.59 1y8b h ASP 21 Cb 1.92 -0.25 0.00 0.00 1.72 0.00 0.00 39.33 42.72 1y8b h ASP 21 CO 0.14 1.27 -1.15 1.21 -2.88 0.00 0.00 179.24 177.83 1y8b n GLU 22 N -4.09 0.55 -0.07 0.28 2.13 -0.68 -4.04 120.64 114.73 1y8b n GLU 22 Ca -0.06 0.05 -0.11 0.00 0.66 0.00 0.00 57.16 57.70 1y8b n GLU 22 Cb 0.63 -1.74 -0.06 0.00 0.27 0.00 0.00 31.44 30.54 1y8b n GLU 22 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 1y8b n GLU 23 N -2.48 0.31 -0.08 5.31 0.00 -0.57 -4.62 120.64 118.50 1y8b n GLU 23 Ca -0.00 0.10 -0.15 0.00 0.00 0.00 0.00 57.16 57.10 1y8b n GLU 23 Cb 0.53 -1.15 -0.10 0.00 0.00 0.00 0.00 31.44 30.72 1y8b n GLU 23 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 1y8b h VAL 24 N -0.19 1.17 -0.60 6.31 2.07 -1.08 -2.76 116.25 121.17 1y8b h VAL 24 Ca -0.31 -2.06 0.12 0.00 0.82 0.00 0.00 66.70 65.27 1y8b h VAL 24 Cb 1.39 2.40 -0.10 0.00 -1.52 0.00 0.00 31.29 33.46 1y8b h VAL 24 CO -0.11 0.40 -0.02 0.25 0.02 0.00 0.00 177.57 178.10 1y8b h LEU 25 N -1.00 -0.31 0.00 2.57 7.12 -0.90 0.61 115.31 123.40 1y8b h LEU 25 Ca -0.13 0.15 -0.00 0.00 0.13 0.00 0.00 57.88 58.03 1y8b h LEU 25 Cb 0.99 0.28 -0.00 0.00 -0.53 0.00 0.00 40.66 41.40 1y8b h LEU 25 CO -0.08 -0.12 -0.03 1.55 -0.13 0.00 0.00 178.44 179.63 1y8b h PRO 26 N 0.10 0.00 0.00 5.25 0.13 -1.74 -2.49 132.00 133.25 1y8b h PRO 26 Ca 0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.44 1y8b h PRO 26 Cb 0.49 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.62 1y8b h PRO 26 CO -0.53 0.37 0.00 0.41 -0.23 0.00 0.00 178.00 178.02 1y8b n GLY 27 N 1.71 -0.36 0.01 1.56 0.00 -1.04 -1.88 105.19 105.19 1y8b n GLY 27 Ca -0.04 -0.03 0.03 0.00 0.00 0.00 0.00 46.02 45.98 1y8b n GLY 27 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1y8b n THR 28 N -1.20 0.08 0.00 2.61 -1.04 0.20 -5.00 114.28 109.93 1y8b n THR 28 Ca 0.03 -0.21 0.00 0.00 -2.04 0.00 0.00 64.05 61.83 1y8b n THR 28 Cb 0.03 0.14 0.00 0.00 -1.82 0.00 0.00 70.33 68.68 1y8b n THR 28 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1y8b n GLY 29 N 2.11 2.69 3.16 3.41 0.00 -0.79 -4.91 105.19 110.86 1y8b n GLY 29 Ca -0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.67 -4.41 0.99 4.77 -1.10 -4.96 117.00 109.63 1y8b n LEU 30 Ca 0.00 -0.05 -0.33 0.00 -0.03 0.00 0.00 56.01 55.60 1y8b n LEU 30 Cb 0.00 -0.77 -0.14 0.00 -2.33 0.00 0.00 43.42 40.19 1y8b n LEU 30 CO 0.00 -2.95 -0.42 -1.81 -1.33 0.00 0.00 177.39 170.88 1y8b s ASP 31 N -1.47 4.23 0.00 -1.43 1.01 -1.26 -4.76 116.67 112.99 1y8b s ASP 31 Ca 0.47 -0.27 -0.24 0.00 0.71 0.00 0.00 52.55 53.22 1y8b s ASP 31 Cb -0.03 -1.65 -0.18 0.00 1.01 0.00 0.00 42.92 42.07 1y8b s ASP 31 CO 0.67 0.17 1.34 0.00 0.21 0.00 0.00 175.17 177.56 1y8b h ALA 32 N 6.67 0.05 -0.90 5.23 0.00 -1.93 0.29 119.26 128.68 1y8b h ALA 32 Ca -0.27 -0.23 0.25 0.00 0.00 0.00 0.00 54.91 54.66 1y8b h ALA 32 Cb 1.21 -0.01 -0.14 0.00 0.00 0.00 0.00 17.79 18.84 1y8b h ALA 32 CO 0.57 -0.21 0.29 0.00 0.00 0.00 0.00 179.25 179.90 1y8b h ALA 33 N 0.59 1.38 0.00 0.00 0.00 -2.01 0.30 119.26 119.52 1y8b h ALA 33 Ca 0.01 0.22 -0.13 0.00 0.00 0.00 0.00 54.91 55.01 1y8b h ALA 33 Cb 0.46 0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 1y8b h ALA 33 CO 0.01 -0.48 -0.95 0.00 0.00 0.00 0.00 179.25 177.83 1y8b h ALA 34 N 1.79 0.65 -0.27 0.00 0.00 -1.97 -3.16 119.26 116.30 1y8b h ALA 34 Ca 0.58 -0.61 0.03 0.00 0.00 0.00 0.00 54.91 54.92 1y8b h ALA 34 Cb 1.19 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 19.04 1y8b h ALA 34 CO -0.65 0.72 0.07 0.35 0.00 0.00 0.00 179.25 179.74 1y8b h PHE 35 N 0.00 0.12 0.00 0.00 3.57 0.18 -0.88 116.94 119.93 1y8b h PHE 35 Ca -0.08 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.42 1y8b h PHE 35 Cb 1.45 -0.01 -0.00 0.00 2.79 0.00 0.00 35.95 40.18 1y8b h PHE 35 CO 0.00 0.04 -0.19 0.11 -2.23 0.00 0.00 178.31 176.04 1y8b h TRP 36 N 0.18 0.00 -0.07 0.41 5.08 -1.58 -2.51 115.95 117.46 1y8b h TRP 36 Ca 0.12 0.00 -0.09 0.00 1.08 0.00 0.00 58.89 60.00 1y8b h TRP 36 Cb 0.11 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.27 1y8b h TRP 36 CO -0.15 0.08 -0.32 -0.09 -1.28 0.00 0.00 178.44 176.68 1y8b h ARG 37 N 0.00 0.34 0.00 0.12 2.43 -1.37 -2.62 114.38 113.27 1y8b h ARG 37 Ca -0.00 -0.27 -0.16 0.00 -0.81 0.00 0.00 59.98 58.73 1y8b h ARG 37 Cb 1.06 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.64 1y8b h ARG 37 CO 0.01 0.92 -0.90 -0.91 -1.51 0.00 0.00 179.97 177.58 1y8b h ASN 38 N -0.16 0.00 0.46 -3.80 4.21 -1.28 -3.24 115.58 111.77 1y8b h ASN 38 Ca -0.02 0.00 -0.02 0.00 1.21 0.00 0.00 56.30 57.47 1y8b h ASN 38 Cb 0.98 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.18 1y8b h ASN 38 CO 0.07 0.71 -0.22 -0.26 -1.29 0.00 0.00 177.43 176.43 1y8b h PHE 39 N 0.00 -0.57 -1.01 1.19 -1.00 -1.52 -2.76 116.94 111.26 1y8b h PHE 39 Ca -0.05 -0.01 0.24 0.00 2.81 0.00 0.00 57.97 60.95 1y8b h PHE 39 Cb 1.59 0.19 -0.11 0.00 3.61 0.00 0.00 35.95 41.23 1y8b h PHE 39 CO 0.00 -0.36 0.63 -0.44 -1.61 0.00 0.00 178.31 176.53 1y8b h ASP 40 N -1.13 0.61 0.54 2.17 5.19 -1.63 1.21 116.42 123.37 1y8b h ASP 40 Ca -0.06 0.11 -0.03 0.00 -0.62 0.00 0.00 57.03 56.43 1y8b h ASP 40 Cb 0.47 0.01 0.00 0.00 0.18 0.00 0.00 39.33 40.00 1y8b h ASP 40 CO 0.10 0.13 -0.26 -0.08 -3.12 0.00 0.00 179.24 176.01 1y8b h GLU 41 N 0.54 -0.70 -0.19 3.56 4.81 -1.57 -2.24 114.58 118.78 1y8b h GLU 41 Ca 0.61 0.05 -0.18 0.00 -0.13 0.00 0.00 59.36 59.71 1y8b h GLU 41 Cb 1.27 0.16 -0.00 0.00 0.63 0.00 0.00 28.75 30.80 1y8b h GLU 41 CO -0.38 -0.47 -0.60 -0.84 -0.73 0.00 0.00 179.01 175.98 1y8b h ILE 42 N -0.73 1.31 0.06 2.32 3.07 -1.12 0.20 117.51 122.62 1y8b h ILE 42 Ca -0.07 -1.85 0.02 0.00 1.55 0.00 0.00 64.86 64.51 1y8b h ILE 42 Cb 0.56 1.81 -0.05 0.00 -0.27 0.00 0.00 36.82 38.86 1y8b h ILE 42 CO 0.12 0.58 -0.42 0.58 -1.05 0.00 0.00 178.15 177.96 1y8b h VAL 43 N 0.49 0.16 0.00 0.16 2.07 0.14 2.08 116.25 121.35 1y8b h VAL 43 Ca -0.00 0.00 -0.16 0.00 0.82 0.00 0.00 66.70 67.36 1y8b h VAL 43 Cb 1.18 0.16 -0.02 0.00 -1.52 0.00 0.00 31.29 31.08 1y8b h VAL 43 CO 0.12 0.00 -0.85 -0.74 0.02 0.00 0.00 177.57 176.12 1y8b h HIS 44 N -0.61 0.00 0.17 1.57 -0.00 -1.47 -1.03 115.15 113.77 1y8b h HIS 44 Ca 0.03 0.00 -0.32 0.00 -0.00 0.00 0.00 60.37 60.09 1y8b h HIS 44 Cb 0.67 0.00 0.01 0.00 -0.00 0.00 0.00 27.41 28.08 1y8b h HIS 44 CO -0.39 0.71 -1.51 0.22 -0.00 0.00 0.00 177.93 176.95 1y8b h ASP 45 N 0.00 0.55 0.77 3.26 3.58 -0.65 -3.35 116.42 120.59 1y8b h ASP 45 Ca -0.04 -0.69 -0.22 0.00 0.42 0.00 0.00 57.03 56.50 1y8b h ASP 45 Cb 1.58 -0.18 -0.04 0.00 1.72 0.00 0.00 39.33 42.41 1y8b h ASP 45 CO 0.09 1.56 -1.34 0.25 -2.88 0.00 0.00 179.24 176.92 1y8b h LEU 46 N 0.10 0.00 -0.09 2.28 6.46 0.33 -3.38 115.31 121.01 1y8b h LEU 46 Ca -0.25 0.00 0.04 0.00 -0.12 0.00 0.00 57.88 57.55 1y8b h LEU 46 Cb 2.06 0.00 -0.06 0.00 -0.73 0.00 0.00 40.66 41.93 1y8b h LEU 46 CO 0.20 0.83 -0.45 0.00 -0.62 0.00 0.00 178.44 178.40 1y8b h ALA 47 N 1.17 -0.69 -0.47 1.25 0.00 -1.09 -0.56 119.26 118.86 1y8b h ALA 47 Ca -0.16 -0.03 0.14 0.00 0.00 0.00 0.00 54.91 54.85 1y8b h ALA 47 Cb 1.78 0.83 -0.02 0.00 0.00 0.00 0.00 17.79 20.38 1y8b h ALA 47 CO 0.08 -0.98 0.74 -1.00 0.00 0.00 0.00 179.25 178.09 1y8b h PRO 48 N -0.55 0.00 -0.28 0.00 0.13 -1.73 0.47 132.00 130.04 1y8b h PRO 48 Ca 0.06 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.15 1y8b h PRO 48 Cb 0.65 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.77 1y8b h PRO 48 CO -0.38 0.00 0.02 1.49 -0.23 0.00 0.00 178.00 178.90 1y8b h GLU 49 N 0.00 0.48 -0.23 0.86 4.22 -1.31 -2.34 114.58 116.25 1y8b h GLU 49 Ca 0.23 -0.14 -0.12 0.00 0.08 0.00 0.00 59.36 59.41 1y8b h GLU 49 Cb 1.70 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.89 1y8b h GLU 49 CO -0.00 0.61 -0.34 -0.91 -2.18 0.00 0.00 179.01 176.19 1y8b h ASN 50 N 0.27 0.52 0.12 1.04 2.35 -0.98 -2.31 115.58 116.59 1y8b h ASN 50 Ca 0.08 -0.21 0.01 0.00 -0.55 0.00 0.00 56.30 55.64 1y8b h ASN 50 Cb 0.39 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 38.58 1y8b h ASN 50 CO 0.01 0.83 -0.22 -0.09 -1.65 0.00 0.00 177.43 176.31 1y8b h ARG 51 N 0.43 -0.39 -0.94 0.81 2.43 -1.27 0.16 114.38 115.60 1y8b h ARG 51 Ca 0.05 0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.24 1y8b h ARG 51 Cb 0.81 0.09 -0.05 0.00 -0.42 0.00 0.00 29.97 30.40 1y8b h ARG 51 CO 0.07 -0.26 0.58 0.37 -1.51 0.00 0.00 179.97 179.21 1y8b h GLN 52 N -0.41 1.27 -0.76 0.20 -0.00 -1.36 -1.62 115.11 112.44 1y8b h GLN 52 Ca 0.03 -0.11 0.05 0.00 -0.00 0.00 0.00 58.65 58.62 1y8b h GLN 52 Cb 0.43 -0.27 -0.05 0.00 0.00 0.00 0.00 27.48 27.58 1y8b h GLN 52 CO -0.12 0.88 0.46 1.25 0.00 0.00 0.00 178.83 181.30 1y8b h LEU 53 N 1.30 0.72 -0.81 -2.39 7.12 -0.72 0.36 115.31 120.90 1y8b h LEU 53 Ca 0.34 0.01 0.01 0.00 0.13 0.00 0.00 57.88 58.38 1y8b h LEU 53 Cb -0.07 -0.14 -0.04 0.00 -0.53 0.00 0.00 40.66 39.88 1y8b h LEU 53 CO -0.07 0.48 0.53 -0.07 -0.13 0.00 0.00 178.44 179.19 1y8b h LEU 54 N 0.86 0.92 -0.74 2.25 -0.00 0.24 0.45 115.31 119.28 1y8b h LEU 54 Ca 0.32 -0.02 0.00 0.00 -0.00 0.00 0.00 57.88 58.18 1y8b h LEU 54 Cb 0.12 -0.23 0.00 0.00 -0.00 0.00 0.00 40.66 40.55 1y8b h LEU 54 CO -0.15 0.66 0.00 0.00 -0.00 0.00 0.00 178.44 178.95 1y8b h ALA 55 N 1.30 1.00 0.19 1.53 0.00 -0.70 -2.90 119.26 119.68 1y8b h ALA 55 Ca 0.30 0.00 -0.32 0.00 0.00 0.00 0.00 54.91 54.89 1y8b h ALA 55 Cb -0.11 0.00 0.01 0.00 0.00 0.00 0.00 17.79 17.69 1y8b h ALA 55 CO -0.07 0.00 -1.58 1.49 0.00 0.00 0.00 179.25 179.09 1y8b h GLU 56 N 0.00 0.39 -0.85 0.00 4.81 0.14 -3.01 114.58 116.06 1y8b h GLU 56 Ca 0.00 -0.67 -0.01 0.00 -0.13 0.00 0.00 59.36 58.55 1y8b h GLU 56 Cb 0.73 0.25 -0.04 0.00 0.63 0.00 0.00 28.75 30.32 1y8b h GLU 56 CO 0.00 1.32 0.49 0.00 -0.73 0.00 0.00 179.01 180.09 1y8b h ARG 57 N 0.01 1.18 0.00 1.92 3.08 -0.17 0.45 114.38 120.85 1y8b h ARG 57 Ca -0.31 -0.12 -0.07 0.00 0.07 0.00 0.00 59.98 59.55 1y8b h ARG 57 Cb 2.02 -0.24 -0.01 0.00 0.08 0.00 0.00 29.97 31.83 1y8b h ARG 57 CO 0.17 0.85 -0.32 -0.44 -1.07 0.00 0.00 179.97 179.16 1y8b h ASP 58 N 1.18 0.00 0.07 7.04 5.19 -1.62 -1.45 116.42 126.83 1y8b h ASP 58 Ca 0.30 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.71 1y8b h ASP 58 Cb -0.01 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.50 1y8b h ASP 58 CO -0.05 0.32 -0.04 -0.09 -3.12 0.00 0.00 179.24 176.27 1y8b h ARG 59 N 0.00 -0.10 -0.58 3.56 1.12 -1.07 0.20 114.38 117.51 1y8b h ARG 59 Ca -0.00 0.01 0.07 0.00 -1.11 0.00 0.00 59.98 58.95 1y8b h ARG 59 Cb 0.68 0.02 -0.06 0.00 -0.01 0.00 0.00 29.97 30.60 1y8b h ARG 59 CO 0.04 0.46 0.25 0.82 -3.11 0.00 0.00 179.97 178.43 1y8b h ILE 60 N -0.87 0.86 -0.20 1.20 2.04 -0.92 0.25 117.51 119.86 1y8b h ILE 60 Ca -0.01 -0.16 -0.06 0.00 1.00 0.00 0.00 64.86 65.63 1y8b h ILE 60 Cb 0.60 0.35 -0.00 0.00 -0.74 0.00 0.00 36.82 37.02 1y8b h ILE 60 CO 0.02 0.09 -0.12 -0.61 0.00 0.00 0.00 178.15 177.52 1y8b h GLN 61 N 0.47 0.43 -0.63 2.37 4.15 -1.33 -1.62 115.11 118.95 1y8b h GLN 61 Ca 0.28 -0.20 0.07 0.00 0.77 0.00 0.00 58.65 59.57 1y8b h GLN 61 Cb 0.27 -0.01 -0.06 0.00 0.21 0.00 0.00 27.48 27.90 1y8b h GLN 61 CO -0.24 0.74 0.32 0.00 -1.93 0.00 0.00 178.83 177.72 1y8b h ALA 62 N 0.69 0.84 -0.36 3.38 0.00 0.13 0.41 119.26 124.35 1y8b h ALA 62 Ca 0.04 0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 1y8b h ALA 62 Cb 0.62 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1y8b h ALA 62 CO 0.03 -0.04 -0.08 0.00 0.00 0.00 0.00 179.25 179.17 1y8b h ALA 63 N 1.36 1.21 0.00 0.00 0.00 -0.44 -2.12 119.26 119.27 1y8b h ALA 63 Ca 0.29 -0.26 -0.13 0.00 0.00 0.00 0.00 54.91 54.81 1y8b h ALA 63 Cb 0.24 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1y8b h ALA 63 CO -0.21 0.51 -0.63 -0.07 0.00 0.00 0.00 179.25 178.85 1y8b h LEU 64 N 0.55 0.00 -1.82 0.00 3.38 -0.10 -2.68 115.31 114.65 1y8b h LEU 64 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1y8b h LEU 64 Cb 0.47 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1y8b h LEU 64 CO 0.02 0.63 0.00 -0.78 0.09 0.00 0.00 178.44 178.40 1y8b h ASP 65 N 0.00 0.00 0.13 -0.43 3.58 0.43 -2.34 116.42 117.78 1y8b h ASP 65 Ca -0.01 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.43 1y8b h ASP 65 Cb 1.14 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.18 1y8b h ASP 65 CO 0.08 0.00 -0.06 -0.33 -2.88 0.00 0.00 179.24 176.05 1y8b h GLU 66 N 0.00 0.00 -0.17 0.28 4.39 -1.26 -1.81 114.58 116.01 1y8b h GLU 66 Ca 0.00 0.00 0.05 0.00 0.34 0.00 0.00 59.36 59.75 1y8b h GLU 66 Cb 0.37 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.02 1y8b h GLU 66 CO 0.00 0.06 0.52 -1.49 -1.16 0.00 0.00 179.01 176.94 1y8b h TRP 67 N 0.00 0.00 -0.96 4.33 -0.00 -1.59 -1.81 115.95 115.92 1y8b h TRP 67 Ca -0.00 0.00 0.23 0.00 -0.00 0.00 0.00 58.89 59.12 1y8b h TRP 67 Cb 0.14 0.00 -0.18 0.00 -0.00 0.00 0.00 29.16 29.12 1y8b h TRP 67 CO 0.00 0.00 -0.10 1.25 -0.00 0.00 0.00 178.44 179.59 1y8b h HIS 68 N 0.00 -0.27 -0.74 0.49 2.76 -1.56 3.55 115.15 119.38 1y8b h HIS 68 Ca 0.08 0.08 0.17 0.00 -2.20 0.00 0.00 60.37 58.50 1y8b h HIS 68 Cb 1.12 0.27 -0.13 0.00 1.55 0.00 0.00 27.41 30.22 1y8b h HIS 68 CO 0.00 -0.41 0.00 -0.09 -1.30 0.00 0.00 177.93 176.13 1y8b h ARG 69 N 0.01 0.10 0.00 5.26 1.12 -1.60 -1.89 114.38 117.39 1y8b h ARG 69 Ca 0.52 -0.01 -0.16 0.00 -1.11 0.00 0.00 59.98 59.23 1y8b h ARG 69 Cb 0.94 -0.02 -0.03 0.00 -0.01 0.00 0.00 29.97 30.85 1y8b h ARG 69 CO -0.93 0.07 -1.92 0.45 -3.11 0.00 0.00 179.97 174.52 1y8b n SER 70 N -5.34 0.26 -1.75 -3.80 2.88 0.28 -5.08 113.62 101.07 1y8b n SER 70 Ca 0.13 0.11 0.00 0.00 -1.33 0.00 0.00 58.87 57.78 1y8b n SER 70 Cb 0.46 1.15 0.00 0.00 -0.75 0.00 0.00 64.21 65.07 1y8b n SER 70 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1y8b n ASN 71 N -2.59 -8.24 0.00 -3.46 4.13 1.11 -4.97 115.26 101.23 1y8b n ASN 71 Ca -0.14 1.18 0.00 0.00 1.68 0.00 0.00 54.58 57.30 1y8b n ASN 71 Cb 0.82 -4.40 0.00 0.00 -1.54 0.00 0.00 39.78 34.66 1y8b n ASN 71 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 1y8b n PRO 72 N 1.06 0.00 0.00 3.52 -0.04 -1.26 -4.99 135.00 133.29 1y8b n PRO 72 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1y8b n PRO 72 Cb 0.00 -0.61 0.00 0.00 -0.04 0.00 0.00 33.50 32.85 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 1.80 0.14 3.43 0.55 0.00 -1.26 -4.63 105.19 105.22 1y8b n GLY 73 Ca 0.00 -0.99 -0.49 0.00 0.00 0.00 0.00 46.02 44.55 1y8b n GLY 73 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1y8b n PRO 74 N 0.00 0.63 -1.87 1.61 -0.02 -1.26 -4.88 135.00 129.21 1y8b n PRO 74 Ca 0.00 0.13 -0.39 0.00 -2.02 0.00 0.00 63.50 61.22 1y8b n PRO 74 Cb 0.00 -2.19 0.02 0.00 -0.02 0.00 0.00 33.50 31.30 1y8b n PRO 74 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1y8b s VAL 75 N 8.06 2.23 0.26 -1.45 1.01 -1.26 -4.90 120.40 124.34 1y8b s VAL 75 Ca 1.16 0.19 0.00 0.00 0.00 0.00 0.00 61.98 63.33 1y8b s VAL 75 Cb -0.98 -3.11 0.00 0.00 0.00 0.00 0.00 36.38 32.29 1y8b s VAL 75 CO 0.49 0.02 0.00 1.17 0.00 0.00 0.00 175.10 176.78 1y8b n LYS 76 N -0.38 0.00 -1.83 2.72 0.00 -1.26 -4.92 118.16 112.50 1y8b n LYS 76 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 58.31 57.96 1y8b n LYS 76 Cb 0.43 0.00 -0.01 0.00 0.00 0.00 0.00 35.03 35.46 1y8b n LYS 76 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1y8b n ASP 77 N -3.32 5.84 -0.38 3.14 9.92 -1.26 -4.73 116.55 125.76 1y8b n ASP 77 Ca 0.00 -2.89 0.30 0.00 -0.53 0.00 0.00 54.79 51.67 1y8b n ASP 77 Cb 0.00 -1.55 0.60 0.00 -0.64 0.00 0.00 41.12 39.53 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 5.52 0.22 -0.86 -1.24 -0.00 -1.92 0.61 116.57 118.90 1y8b h LYS 78 Ca 0.61 -0.01 0.04 0.00 -0.00 0.00 0.00 60.65 61.29 1y8b h LYS 78 Cb 0.51 -0.05 -0.05 0.00 -0.00 0.00 0.00 32.23 32.64 1y8b h LYS 78 CO 1.75 0.14 0.54 0.00 -0.00 0.00 0.00 179.45 181.88 1y8b h ALA 79 N 1.58 1.15 0.19 0.07 0.00 -1.97 2.05 119.26 122.33 1y8b h ALA 79 Ca 0.69 -0.03 -0.29 0.00 0.00 0.00 0.00 54.91 55.28 1y8b h ALA 79 Cb 2.05 -0.27 0.02 0.00 0.00 0.00 0.00 17.79 19.59 1y8b h ALA 79 CO -0.31 0.35 -1.31 0.00 0.00 0.00 0.00 179.25 177.98 1y8b h ALA 80 N 1.37 -0.05 -0.08 0.00 0.00 -0.27 -2.41 119.26 117.82 1y8b h ALA 80 Ca 0.35 -0.88 -0.09 0.00 0.00 0.00 0.00 54.91 54.29 1y8b h ALA 80 Cb 0.06 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1y8b h ALA 80 CO -0.14 0.66 -0.32 1.88 0.00 0.00 0.00 179.25 181.34 1y8b h TYR 81 N -0.08 0.46 -0.44 0.00 0.05 -0.77 -3.13 116.97 113.07 1y8b h TYR 81 Ca -0.24 -0.20 -0.09 0.00 0.05 0.00 0.00 58.73 58.25 1y8b h TYR 81 Cb 1.95 -0.07 -0.02 0.00 1.01 0.00 0.00 36.73 39.59 1y8b h TYR 81 CO 0.15 0.93 -0.10 -0.22 -1.05 0.00 0.00 178.16 177.87 1y8b h LYS 82 N -0.13 0.77 -0.18 4.88 3.64 0.32 -1.77 116.57 124.10 1y8b h LYS 82 Ca -0.02 -0.25 0.04 0.00 -1.27 0.00 0.00 60.65 59.15 1y8b h LYS 82 Cb 0.96 -0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 32.67 1y8b h LYS 82 CO 0.07 0.85 -0.08 0.66 -2.27 0.00 0.00 179.45 178.68 1y8b h SER 83 N 0.70 -0.26 -0.14 4.20 4.64 -1.45 0.48 113.55 121.72 1y8b h SER 83 Ca 0.12 0.07 -0.15 0.00 -0.47 0.00 0.00 61.79 61.36 1y8b h SER 83 Cb 0.57 0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 62.80 1y8b h SER 83 CO 0.04 -0.10 -0.42 0.15 -0.87 0.00 0.00 176.83 175.63 1y8b h PHE 84 N -0.05 0.82 0.59 4.77 3.57 -1.48 -2.48 116.94 122.68 1y8b h PHE 84 Ca 0.09 -0.25 -0.03 0.00 3.53 0.00 0.00 57.97 61.32 1y8b h PHE 84 Cb 0.19 -0.17 0.01 0.00 2.79 0.00 0.00 35.95 38.77 1y8b h PHE 84 CO -0.23 0.99 -0.28 1.25 -2.23 0.00 0.00 178.31 177.81 1y8b h LEU 85 N 0.56 -0.67 -1.32 0.59 6.46 -0.61 0.61 115.31 120.93 1y8b h LEU 85 Ca 0.04 -0.02 0.06 0.00 -0.12 0.00 0.00 57.88 57.84 1y8b h LEU 85 Cb 0.96 0.17 -0.05 0.00 -0.73 0.00 0.00 40.66 41.01 1y8b h LEU 85 CO 0.09 -0.39 0.50 0.08 -0.62 0.00 0.00 178.44 178.10 1y8b h ARG 86 N -0.93 0.81 0.00 1.25 -0.00 -0.11 4.72 114.38 120.13 1y8b h ARG 86 Ca -0.08 -0.05 0.00 0.00 -0.00 0.00 0.00 59.98 59.85 1y8b h ARG 86 Cb 0.65 -0.18 0.00 0.00 -0.00 0.00 0.00 29.97 30.44 1y8b h ARG 86 CO 0.13 0.54 -0.28 0.39 -0.00 0.00 0.00 179.97 180.75 1y8b n GLU 87 N -4.48 0.21 -0.01 0.08 1.02 -0.94 -3.03 120.64 113.49 1y8b n GLU 87 Ca 0.11 0.11 -0.01 0.00 -0.02 0.00 0.00 57.16 57.36 1y8b n GLU 87 Cb 0.20 -1.69 -0.02 0.00 -0.02 0.00 0.00 31.44 29.92 1y8b n GLU 87 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 1y8b n LEU 88 N -2.02 0.01 -1.30 -4.62 -0.00 0.21 -4.64 117.00 104.64 1y8b n LEU 88 Ca 0.05 -0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.06 1y8b n LEU 88 Cb 0.41 0.05 0.00 0.00 -0.00 0.00 0.00 43.42 43.88 1y8b n LEU 88 CO 0.33 0.05 0.53 0.61 -0.00 0.00 0.00 177.39 178.91 1y8b n GLY 89 N 2.87 1.69 3.60 -3.96 0.00 1.53 -4.76 105.19 106.16 1y8b n GLY 89 Ca -0.03 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.78 1y8b n GLY 89 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1y8b n TYR 90 N 1.11 -2.23 -3.90 1.61 4.02 -1.26 -4.94 117.16 111.57 1y8b n TYR 90 Ca 0.00 0.81 -0.35 0.00 -0.01 0.00 0.00 57.90 58.35 1y8b n TYR 90 Cb 0.36 -3.22 -0.14 0.00 -0.02 0.00 0.00 39.34 36.33 1y8b n TYR 90 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 1y8b s LEU 91 N -5.07 3.18 0.08 7.72 2.96 -1.17 -5.09 118.68 121.29 1y8b s LEU 91 Ca 0.10 -0.62 0.04 0.00 -0.22 0.00 0.00 54.13 53.43 1y8b s LEU 91 Cb -0.04 -1.74 -0.03 0.00 0.50 0.00 0.00 46.19 44.88 1y8b s LEU 91 CO 0.86 -0.09 -0.12 0.68 -1.32 0.00 0.00 176.35 176.36 1y8b s VAL 92 N 1.43 0.98 0.25 1.68 -7.23 -1.26 -4.87 120.40 111.38 1y8b s VAL 92 Ca 0.03 -1.45 -0.31 0.00 -1.81 0.00 0.00 61.98 58.45 1y8b s VAL 92 Cb -0.16 -1.16 -0.13 0.00 0.56 0.00 0.00 36.38 35.49 1y8b s VAL 92 CO -0.03 -0.40 1.38 -0.81 -0.31 0.00 0.00 175.10 174.93 1y8b n PRO 93 N 0.94 2.01 -4.12 4.82 -0.04 -1.26 -5.01 135.00 132.34 1y8b n PRO 93 Ca -0.19 0.71 -0.13 0.00 -0.04 0.00 0.00 63.50 63.85 1y8b n PRO 93 Cb 0.56 -2.35 -0.11 0.00 -0.04 0.00 0.00 33.50 31.56 1y8b n PRO 93 CO 0.00 0.00 0.00 1.14 -0.04 0.00 0.00 175.50 176.60 1y8b s GLN 94 N -0.61 0.69 -0.56 0.54 0.00 -1.26 -4.98 119.66 113.49 1y8b s GLN 94 Ca 0.66 -0.98 -0.26 0.00 -0.00 0.00 0.00 55.36 54.78 1y8b s GLN 94 Cb -0.65 -0.39 -0.09 0.00 0.00 0.00 0.00 33.01 31.88 1y8b s GLN 94 CO 0.51 0.06 2.42 -0.35 0.00 0.00 0.00 175.29 177.94 1y8b n PRO 95 N 0.95 0.93 0.00 9.60 -0.04 -1.26 -4.86 135.00 140.32 1y8b n PRO 95 Ca -0.19 -0.18 0.00 0.00 -0.04 0.00 0.00 63.50 63.09 1y8b n PRO 95 Cb 0.56 -3.48 0.00 0.00 -0.04 0.00 0.00 33.50 30.55 1y8b n PRO 95 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1y8b n GLU 96 N 8.96 0.00 -1.55 0.54 2.13 -1.26 -4.50 120.64 124.95 1y8b n GLU 96 Ca 0.39 0.44 -0.36 0.00 0.66 0.00 0.00 57.16 58.29 1y8b n GLU 96 Cb 0.52 -1.21 -0.03 0.00 0.27 0.00 0.00 31.44 30.99 1y8b n GLU 96 CO 0.00 0.00 0.00 -2.13 -0.41 0.00 0.00 177.13 174.59 1y8b n ARG 97 N -1.82 1.04 -3.63 5.31 0.63 -1.26 -4.88 116.66 112.05 1y8b n ARG 97 Ca 0.00 -0.01 -0.15 0.00 -0.92 0.00 0.00 57.85 56.77 1y8b n ARG 97 Cb 0.00 -3.45 -0.07 0.00 0.45 0.00 0.00 32.46 29.39 1y8b n ARG 97 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 1y8b s VAL 98 N 12.28 0.03 0.26 5.15 1.01 -1.26 -5.17 120.40 132.69 1y8b s VAL 98 Ca 0.98 -0.25 0.07 0.00 0.00 0.00 0.00 61.98 62.78 1y8b s VAL 98 Cb -0.18 -0.85 -0.05 0.00 0.00 0.00 0.00 36.38 35.30 1y8b s VAL 98 CO 0.26 -0.14 -0.09 0.42 0.00 0.00 0.00 175.10 175.56 1y8b s THR 99 N -1.55 1.69 0.16 3.92 -4.23 -1.26 -5.00 115.64 109.36 1y8b s THR 99 Ca -0.11 -2.16 -0.30 0.00 -1.18 0.00 0.00 61.69 57.95 1y8b s THR 99 Cb -0.02 -2.33 -0.07 0.00 1.34 0.00 0.00 72.50 71.42 1y8b s THR 99 CO 0.05 -0.39 1.03 -0.69 -0.54 0.00 0.00 174.62 174.09 1y8b s VAL 100 N -2.99 4.14 -0.15 2.29 1.01 -1.26 -4.76 120.40 118.68 1y8b s VAL 100 Ca 0.28 1.84 -0.02 0.00 0.00 0.00 0.00 61.98 64.07 1y8b s VAL 100 Cb 0.02 -4.17 0.05 0.00 0.00 0.00 0.00 36.38 32.28 1y8b s VAL 100 CO 0.11 0.31 0.02 -1.83 0.00 0.00 0.00 175.10 173.71 1y8b s GLU 101 N -0.28 0.68 0.26 2.72 -1.05 -1.24 -5.07 118.70 114.71 1y8b s GLU 101 Ca 0.48 -0.26 -0.11 0.00 -0.15 0.00 0.00 54.97 54.93 1y8b s GLU 101 Cb -0.27 -1.75 -0.00 0.00 -0.44 0.00 0.00 34.13 31.67 1y8b s GLU 101 CO 0.33 -0.52 0.48 0.95 0.95 0.00 0.00 175.26 177.45 1y8b s THR 102 N 1.89 0.00 0.20 1.83 -4.23 -1.26 -4.19 115.64 109.88 1y8b s THR 102 Ca 0.01 -1.43 0.08 0.00 -1.18 0.00 0.00 61.69 59.18 1y8b s THR 102 Cb -0.15 -2.29 -0.05 0.00 1.34 0.00 0.00 72.50 71.35 1y8b s THR 102 CO -0.07 0.00 -0.16 -0.89 -0.54 0.00 0.00 174.62 172.96 1y8b s THR 103 N -3.83 1.82 -0.86 3.99 2.01 -1.26 -4.67 115.64 112.83 1y8b s THR 103 Ca 0.23 -2.15 -0.01 0.00 0.31 0.00 0.00 61.69 60.07 1y8b s THR 103 Cb -0.01 -2.01 0.01 0.00 0.01 0.00 0.00 72.50 70.50 1y8b s THR 103 CO 0.11 -0.51 0.07 0.61 -0.69 0.00 0.00 174.62 174.20 1y8b n GLY 104 N -0.23 -0.50 3.35 4.40 0.00 -1.26 -4.70 105.19 106.25 1y8b n GLY 104 Ca -0.09 0.01 -0.33 0.00 0.00 0.00 0.00 46.02 45.61 1y8b n GLY 104 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1y8b n ILE 105 N -3.27 0.00 -3.52 -0.61 3.06 -1.26 -4.79 119.36 108.96 1y8b n ILE 105 Ca -0.10 -0.23 -0.38 0.00 -2.50 0.00 0.00 62.75 59.55 1y8b n ILE 105 Cb 0.58 -0.56 -0.09 0.00 0.54 0.00 0.00 39.64 40.10 1y8b n ILE 105 CO 0.00 0.00 0.00 -0.62 -2.50 0.00 0.00 176.55 173.43 1y8b s ASP 106 N -1.90 6.20 0.62 9.51 2.15 -1.26 -4.94 116.67 127.05 1y8b s ASP 106 Ca 0.55 0.22 0.29 0.00 0.43 0.00 0.00 52.55 54.04 1y8b s ASP 106 Cb -0.19 -2.16 1.59 0.00 -0.30 0.00 0.00 42.92 41.86 1y8b s ASP 106 CO 0.68 -0.05 1.95 0.77 -0.17 0.00 0.00 175.17 178.36 1y8b h SER 107 N 7.82 0.00 -1.16 -0.34 4.64 -1.91 -2.35 113.55 120.25 1y8b h SER 107 Ca -0.35 0.00 0.36 0.00 -0.47 0.00 0.00 61.79 61.33 1y8b h SER 107 Cb 1.17 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 63.14 1y8b h SER 107 CO 0.64 0.00 0.72 -0.33 -0.87 0.00 0.00 176.83 177.00 1y8b h GLU 108 N 0.00 0.22 0.00 4.77 4.39 -1.91 0.30 114.58 122.35 1y8b h GLU 108 Ca 0.11 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.79 1y8b h GLU 108 Cb 0.84 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.44 1y8b h GLU 108 CO -0.00 0.15 -1.23 -0.89 -1.16 0.00 0.00 179.01 175.87 1y8b n ILE 109 N -4.77 0.00 -0.08 3.13 5.41 -0.89 -3.85 119.36 118.31 1y8b n ILE 109 Ca 0.33 -0.25 -0.23 0.00 1.00 0.00 0.00 62.75 63.60 1y8b n ILE 109 Cb 1.16 0.45 -0.12 0.00 -0.71 0.00 0.00 39.64 40.42 1y8b n ILE 109 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 1y8b n THR 110 N -1.71 1.60 0.21 1.39 -2.24 -0.63 -4.38 114.28 108.51 1y8b n THR 110 Ca -0.01 -0.32 0.03 0.00 -2.27 0.00 0.00 64.05 61.47 1y8b n THR 110 Cb 0.25 -1.86 0.02 0.00 -2.10 0.00 0.00 70.33 66.64 1y8b n THR 110 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1y8b n SER 111 N -4.02 1.43 -4.49 3.42 3.41 0.31 -4.29 113.62 109.39 1y8b n SER 111 Ca -0.38 -1.22 -0.25 0.00 -0.26 0.00 0.00 58.87 56.76 1y8b n SER 111 Cb 0.85 -0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.70 1y8b n SER 111 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 1y8b s GLN 112 N -0.43 1.77 0.00 4.33 0.74 0.81 -4.62 119.66 122.26 1y8b s GLN 112 Ca 0.06 -1.61 0.00 0.00 0.05 0.00 0.00 55.36 53.86 1y8b s GLN 112 Cb 0.04 -1.89 0.00 0.00 1.10 0.00 0.00 33.01 32.27 1y8b s GLN 112 CO 0.06 0.36 0.00 0.00 -0.55 0.00 0.00 175.29 175.17 1y8b n ALA 113 N -0.37 0.00 -3.00 1.58 0.00 -1.26 -4.36 120.51 113.11 1y8b n ALA 113 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1y8b n ALA 113 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.03 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 0.00 1.24 3.39 0.00 0.00 -1.26 -4.54 105.19 104.02 1y8b n GLY 114 Ca 0.00 -0.81 -0.36 0.00 0.00 0.00 0.00 46.02 44.85 1y8b n GLY 114 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1y8b n PRO 115 N 0.00 0.21 -4.36 1.61 -0.02 -1.26 -4.74 135.00 126.44 1y8b n PRO 115 Ca 0.00 0.10 -0.25 0.00 -2.02 0.00 0.00 63.50 61.34 1y8b n PRO 115 Cb 0.00 -1.65 -0.17 0.00 -0.02 0.00 0.00 33.50 31.66 1y8b n PRO 115 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1y8b s GLN 116 N -2.50 1.57 0.33 -0.52 -0.21 -1.21 -3.26 119.66 113.86 1y8b s GLN 116 Ca 0.62 -0.34 -0.08 0.00 0.02 0.00 0.00 55.36 55.58 1y8b s GLN 116 Cb -0.35 -1.40 -0.06 0.00 1.00 0.00 0.00 33.01 32.21 1y8b s GLN 116 CO 0.62 -0.06 0.64 -1.17 -2.12 0.00 0.00 175.29 173.20 1y8b s LEU 117 N 0.97 3.97 -0.13 2.90 1.98 0.59 -1.66 118.68 127.30 1y8b s LEU 117 Ca -0.09 0.90 -0.01 0.00 -2.89 0.00 0.00 54.13 52.05 1y8b s LEU 117 Cb -0.15 -3.74 0.03 0.00 0.66 0.00 0.00 46.19 42.99 1y8b s LEU 117 CO 0.00 -0.27 -0.06 -0.69 -1.89 0.00 0.00 176.35 173.44 1y8b s VAL 118 N -2.18 0.98 -0.47 1.68 1.01 -0.67 -2.44 120.40 118.30 1y8b s VAL 118 Ca 0.47 -0.35 -0.04 0.00 0.00 0.00 0.00 61.98 62.06 1y8b s VAL 118 Cb -0.11 -1.06 0.12 0.00 0.00 0.00 0.00 36.38 35.33 1y8b s VAL 118 CO 0.30 0.28 0.29 0.68 0.00 0.00 0.00 175.10 176.64 1y8b s VAL 119 N 1.72 3.57 -0.21 2.92 -7.23 -1.21 -4.37 120.40 115.58 1y8b s VAL 119 Ca 0.04 -2.21 -0.27 0.00 -1.81 0.00 0.00 61.98 57.73 1y8b s VAL 119 Cb -0.13 -3.40 -0.00 0.00 0.56 0.00 0.00 36.38 33.40 1y8b s VAL 119 CO -0.08 -0.75 0.92 -2.16 -0.31 0.00 0.00 175.10 172.72 1y8b s PRO 120 N 0.91 4.25 -0.34 4.82 0.04 -1.26 -2.80 135.00 140.62 1y8b s PRO 120 Ca 0.10 1.14 -0.11 0.00 0.04 0.00 0.00 61.00 62.17 1y8b s PRO 120 Cb -0.23 -3.62 0.01 0.00 0.04 0.00 0.00 34.50 30.71 1y8b s PRO 120 CO -0.03 -0.51 0.43 0.00 0.04 0.00 0.00 177.00 176.93 1y8b n ALA 121 N 5.91 -3.06 0.00 8.56 0.00 -1.25 -4.58 120.51 126.08 1y8b n ALA 121 Ca 0.08 0.90 0.00 0.00 0.00 0.00 0.00 53.44 54.42 1y8b n ALA 121 Cb 0.47 -2.84 0.00 0.00 0.00 0.00 0.00 19.45 17.08 1y8b n ALA 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1y8b n MET 122 N -0.23 0.00 -2.96 0.00 0.00 -1.26 -4.69 117.12 107.98 1y8b n MET 122 Ca 0.09 0.00 -0.18 0.00 0.00 0.00 0.00 57.70 57.61 1y8b n MET 122 Cb 0.33 -1.46 0.02 0.00 0.00 0.00 0.00 33.22 32.11 1y8b n MET 122 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 175.97 177.18 1y8b s ASN 123 N 2.64 5.58 0.45 3.17 3.84 -1.26 -4.83 114.94 124.53 1y8b s ASN 123 Ca 0.00 -0.38 0.00 0.00 0.21 0.00 0.00 52.86 52.69 1y8b s ASN 123 Cb 0.00 -0.65 0.00 0.00 -0.55 0.00 0.00 41.25 40.05 1y8b s ASN 123 CO 0.00 -0.84 0.00 0.00 -2.79 0.00 0.00 177.10 173.47 1y8b n ALA 124 N -1.94 -3.39 0.22 1.71 0.00 -1.26 -3.43 120.51 112.42 1y8b n ALA 124 Ca 0.08 0.67 0.07 0.00 0.00 0.00 0.00 53.44 54.27 1y8b n ALA 124 Cb 0.59 -1.34 0.50 0.00 0.00 0.00 0.00 19.45 19.21 1y8b n ALA 124 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1y8b h ARG 125 N -1.35 0.00 -1.13 0.00 1.12 -1.93 -2.69 114.38 108.41 1y8b h ARG 125 Ca -0.12 0.00 0.33 0.00 -1.11 0.00 0.00 59.98 59.08 1y8b h ARG 125 Cb 1.22 0.00 -0.05 0.00 -0.01 0.00 0.00 29.97 31.13 1y8b h ARG 125 CO 0.05 0.26 0.94 -0.92 -3.11 0.00 0.00 179.97 177.19 1y8b h TYR 126 N 0.00 0.00 -0.11 2.20 3.20 -1.81 0.64 116.97 121.09 1y8b h TYR 126 Ca -0.00 0.00 -0.05 0.00 3.14 0.00 0.00 58.73 61.82 1y8b h TYR 126 Cb 0.57 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.84 1y8b h TYR 126 CO 0.00 0.00 -0.13 0.00 -1.64 0.00 0.00 178.16 176.39 1y8b h ALA 127 N 1.19 0.16 -0.52 1.82 0.00 -1.50 -0.46 119.26 119.95 1y8b h ALA 127 Ca 0.54 -0.32 0.03 0.00 0.00 0.00 0.00 54.91 55.16 1y8b h ALA 127 Cb 2.41 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 20.13 1y8b h ALA 127 CO -0.01 0.03 0.30 1.25 0.00 0.00 0.00 179.25 180.83 1y8b h LEU 128 N -0.14 0.48 -0.77 0.00 6.46 0.08 -1.81 115.31 119.62 1y8b h LEU 128 Ca 0.01 0.01 -0.08 0.00 -0.12 0.00 0.00 57.88 57.70 1y8b h LEU 128 Cb 0.67 -0.09 -0.02 0.00 -0.73 0.00 0.00 40.66 40.48 1y8b h LEU 128 CO 0.03 0.34 0.05 -1.13 -0.62 0.00 0.00 178.44 177.11 1y8b h ASN 129 N 0.60 0.95 -0.24 1.25 -0.73 -1.34 -2.59 115.58 113.47 1y8b h ASN 129 Ca 0.21 -0.23 0.06 0.00 1.87 0.00 0.00 56.30 58.21 1y8b h ASN 129 Cb 0.04 -0.25 -0.06 0.00 0.27 0.00 0.00 38.32 38.32 1y8b h ASN 129 CO -0.11 0.97 -0.16 0.00 -0.37 0.00 0.00 177.43 177.77 1y8b h ALA 130 N 1.13 0.02 -0.60 1.57 0.00 -0.24 0.80 119.26 121.94 1y8b h ALA 130 Ca 0.18 0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.19 1y8b h ALA 130 Cb 0.46 0.36 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 1y8b h ALA 130 CO 0.02 -0.57 0.38 0.00 0.00 0.00 0.00 179.25 179.08 1y8b h ALA 131 N 1.01 0.77 0.00 0.00 0.00 -1.27 0.67 119.26 120.45 1y8b h ALA 131 Ca 0.14 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1y8b h ALA 131 Cb 0.35 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1y8b h ALA 131 CO -0.33 0.15 0.00 0.09 0.00 0.00 0.00 179.25 179.16 1y8b n ASN 132 N -4.70 0.39 -0.30 0.00 3.02 -0.52 -1.87 115.26 111.28 1y8b n ASN 132 Ca 0.05 -1.87 0.07 0.00 -0.03 0.00 0.00 54.58 52.81 1y8b n ASN 132 Cb 0.05 -0.19 0.32 0.00 -0.61 0.00 0.00 39.78 39.34 1y8b n ASN 132 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1y8b n ALA 133 N -0.28 2.53 0.04 5.41 0.00 0.23 -3.78 120.51 124.66 1y8b n ALA 133 Ca 0.00 -0.32 -0.22 0.00 0.00 0.00 0.00 53.44 52.90 1y8b n ALA 133 Cb 0.10 -1.12 -0.14 0.00 0.00 0.00 0.00 19.45 18.29 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 1.10 0.32 -4.97 0.00 2.43 -1.75 -3.38 114.38 108.13 1y8b h ARG 134 Ca 0.00 -0.55 -0.69 0.00 -0.81 0.00 0.00 59.98 57.93 1y8b h ARG 134 Cb 0.24 0.20 -0.18 0.00 -0.42 0.00 0.00 29.97 29.82 1y8b h ARG 134 CO 0.00 1.26 0.67 -1.58 -1.51 0.00 0.00 179.97 178.81 1y8b s TRP 135 N -2.52 3.09 0.06 2.20 0.52 -1.25 -2.81 118.94 118.24 1y8b s TRP 135 Ca -0.17 -1.27 -0.04 0.00 0.02 0.00 0.00 56.10 54.64 1y8b s TRP 135 Cb 0.04 -4.22 -0.02 0.00 -1.15 0.00 0.00 33.47 28.12 1y8b s TRP 135 CO 0.81 -1.46 0.05 0.20 0.02 0.00 0.00 176.95 176.58 1y8b s GLY 136 N 3.53 0.32 0.05 0.98 0.00 -1.26 -5.07 107.32 105.86 1y8b s GLY 136 Ca 0.28 -0.96 -0.14 0.00 0.00 0.00 0.00 44.72 43.90 1y8b s GLY 136 CO -0.05 -1.09 0.45 -0.45 0.00 0.00 0.00 173.10 171.96 1y8b s SER 137 N -2.82 6.82 0.26 1.64 0.15 -1.26 -3.15 113.70 115.34 1y8b s SER 137 Ca 0.05 0.99 -0.05 0.00 0.70 0.00 0.00 55.95 57.65 1y8b s SER 137 Cb 0.06 -2.26 0.32 0.00 -1.71 0.00 0.00 66.02 62.43 1y8b s SER 137 CO -0.10 0.26 1.92 -0.07 1.20 0.00 0.00 173.24 176.45 1y8b h LEU 138 N 4.32 1.06 0.26 3.45 3.38 0.81 0.56 115.31 129.15 1y8b h LEU 138 Ca -0.50 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.42 1y8b h LEU 138 Cb 1.21 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.67 1y8b h LEU 138 CO 0.63 0.80 -0.25 0.22 0.09 0.00 0.00 178.44 179.93 1y8b h TYR 139 N 1.24 -0.67 0.00 1.13 3.20 -1.94 -1.66 116.97 118.26 1y8b h TYR 139 Ca 0.33 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.20 1y8b h TYR 139 Cb -0.08 0.26 0.00 0.00 1.54 0.00 0.00 36.73 38.45 1y8b h TYR 139 CO 0.00 -0.37 0.00 0.38 -1.64 0.00 0.00 178.16 176.53 1y8b h ASP 140 N -0.54 0.00 0.21 -2.11 3.04 -1.83 -2.70 116.42 112.49 1y8b h ASP 140 Ca -0.01 0.00 -0.01 0.00 -3.24 0.00 0.00 57.03 53.77 1y8b h ASP 140 Cb 0.50 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.79 1y8b h ASP 140 CO -0.05 0.00 -0.10 0.00 -2.04 0.00 0.00 179.24 177.05 1y8b h ALA 141 N 2.14 -0.28 0.00 4.15 0.00 0.11 -3.04 119.26 122.34 1y8b h ALA 141 Ca 0.00 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 1y8b h ALA 141 Cb 0.64 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.53 1y8b h ALA 141 CO 0.00 -0.65 -0.64 -0.07 0.00 0.00 0.00 179.25 177.89 1y8b h LEU 142 N -0.31 0.00 -0.94 0.00 3.38 -1.55 -3.35 115.31 112.55 1y8b h LEU 142 Ca -0.03 0.00 0.27 0.00 0.09 0.00 0.00 57.88 58.21 1y8b h LEU 142 Cb 0.23 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 40.84 1y8b h LEU 142 CO 0.05 0.11 0.37 0.22 0.09 0.00 0.00 178.44 179.28 1y8b h TYR 143 N 0.00 0.59 -0.74 1.13 3.20 -1.35 0.59 116.97 120.39 1y8b h TYR 143 Ca -0.02 0.05 -0.50 0.00 3.14 0.00 0.00 58.73 61.40 1y8b h TYR 143 Cb 1.10 -0.11 -0.21 0.00 1.54 0.00 0.00 36.73 39.04 1y8b h TYR 143 CO 0.00 -0.20 0.65 0.41 -1.64 0.00 0.00 178.16 177.38 1y8b n GLY 144 N -1.34 4.98 3.42 1.82 0.00 -1.25 -4.10 105.19 108.72 1y8b n GLY 144 Ca 0.26 -1.69 -0.21 0.00 0.00 0.00 0.00 46.02 44.38 1y8b n GLY 144 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1y8b s SER 145 N -0.82 2.06 -0.11 1.61 0.01 0.21 -4.84 113.70 111.81 1y8b s SER 145 Ca 0.48 -1.43 0.16 0.00 1.31 0.00 0.00 55.95 56.47 1y8b s SER 145 Cb 0.38 0.08 0.65 0.00 0.21 0.00 0.00 66.02 67.34 1y8b s SER 145 CO -0.01 -0.70 1.54 -0.67 0.41 0.00 0.00 173.24 173.81 1y8b n ASP 146 N -0.71 4.33 -0.16 2.44 2.03 -1.26 -4.13 116.55 119.09 1y8b n ASP 146 Ca -0.02 -2.42 -0.06 0.00 0.52 0.00 0.00 54.79 52.81 1y8b n ASP 146 Cb 0.66 -0.55 0.11 0.00 -0.72 0.00 0.00 41.12 40.62 1y8b n ASP 146 CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 1y8b h ILE 147 N 3.63 1.25 0.00 5.18 2.04 -1.91 -3.35 117.51 124.35 1y8b h ILE 147 Ca 0.00 -1.04 0.00 0.00 1.00 0.00 0.00 64.86 64.82 1y8b h ILE 147 Cb 1.35 0.80 0.00 0.00 -0.74 0.00 0.00 36.82 38.23 1y8b h ILE 147 CO 0.22 0.38 0.00 -0.38 0.00 0.00 0.00 178.15 178.37 1y8b n ILE 148 N -4.21 0.00 -1.26 -0.67 5.41 -1.26 -4.83 119.36 112.54 1y8b n ILE 148 Ca 0.03 0.00 -0.30 0.00 1.00 0.00 0.00 62.75 63.48 1y8b n ILE 148 Cb 0.31 -0.05 0.22 0.00 -0.71 0.00 0.00 39.64 39.41 1y8b n ILE 148 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 1y8b s PRO 149 N -2.00 -0.74 0.00 0.38 0.04 -1.26 -5.03 135.00 126.39 1y8b s PRO 149 Ca 0.00 -0.11 0.00 0.00 0.04 0.00 0.00 61.00 60.93 1y8b s PRO 149 Cb 0.00 -1.66 0.00 0.00 0.04 0.00 0.00 34.50 32.88 1y8b s PRO 149 CO 0.00 -3.38 0.00 0.94 0.04 0.00 0.00 177.00 174.60 1y8b n GLN 150 N -4.52 1.62 -3.35 4.56 7.27 -1.26 -4.44 117.38 117.26 1y8b n GLN 150 Ca 0.13 0.00 -0.18 0.00 0.07 0.00 0.00 57.00 57.02 1y8b n GLN 150 Cb 0.59 -0.75 0.06 0.00 2.41 0.00 0.00 30.24 32.55 1y8b n GLN 150 CO 0.00 0.00 0.00 -1.91 0.07 0.00 0.00 177.06 175.22 1y8b n GLU 151 N -1.41 -1.88 -0.06 3.69 2.13 -1.26 -4.86 120.64 117.00 1y8b n GLU 151 Ca 0.00 0.82 -0.09 0.00 0.66 0.00 0.00 57.16 58.55 1y8b n GLU 151 Cb 0.25 -5.33 -0.02 0.00 0.27 0.00 0.00 31.44 26.62 1y8b n GLU 151 CO 0.00 0.00 0.00 0.78 -0.41 0.00 0.00 177.13 177.50 1y8b h GLY 152 N -1.13 0.32 -3.72 8.31 0.00 -1.97 -3.43 103.07 101.44 1y8b h GLY 152 Ca -0.57 -0.09 -0.60 0.00 0.00 0.00 0.00 47.33 46.08 1y8b h GLY 152 CO 0.44 0.08 -0.62 0.00 0.00 0.00 0.00 176.54 176.43 1y8b n ALA 153 N -2.20 -1.87 0.76 3.60 0.00 -1.26 -4.80 120.51 114.73 1y8b n ALA 153 Ca -0.02 0.05 0.11 0.00 0.00 0.00 0.00 53.44 53.57 1y8b n ALA 153 Cb 0.06 -1.68 0.47 0.00 0.00 0.00 0.00 19.45 18.29 1y8b n ALA 153 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1y8b n MET 154 N 0.65 0.00 0.00 0.00 0.00 -1.26 -4.32 117.12 112.20 1y8b n MET 154 Ca 0.11 0.12 0.00 0.00 0.00 0.00 0.00 57.70 57.93 1y8b n MET 154 Cb 0.44 -1.50 0.00 0.00 0.00 0.00 0.00 33.22 32.16 1y8b n MET 154 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 175.97 177.30 1y8b n VAL 155 N -1.50 0.00 0.00 2.03 0.24 -1.26 -4.70 118.33 113.14 1y8b n VAL 155 Ca 0.05 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.35 1y8b n VAL 155 Cb 0.25 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.62 1y8b n VAL 155 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 1y8b n SER 156 N -0.77 0.00 -1.29 -1.34 2.88 -1.26 -5.16 113.62 106.68 1y8b n SER 156 Ca 0.00 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.53 1y8b n SER 156 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1y8b n SER 156 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1y8b n GLY 157 N -0.01 1.56 3.52 0.46 0.00 -1.26 -4.74 105.19 104.72 1y8b n GLY 157 Ca 0.00 -1.01 -0.41 0.00 0.00 0.00 0.00 46.02 44.60 1y8b n GLY 157 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1y8b s TYR 158 N -6.89 3.20 -0.38 1.61 1.51 -1.26 -4.99 117.35 110.15 1y8b s TYR 158 Ca 0.03 -0.15 0.03 0.00 -1.01 0.00 0.00 57.07 55.97 1y8b s TYR 158 Cb -0.01 -2.71 0.16 0.00 -0.11 0.00 0.00 41.96 39.29 1y8b s TYR 158 CO 0.01 -0.50 0.38 -0.51 -1.11 0.00 0.00 175.55 173.82 1y8b s ASP 159 N 1.75 1.23 -0.10 2.29 1.01 -1.26 -5.03 116.67 116.55 1y8b s ASP 159 Ca 0.11 -1.80 -0.13 0.00 0.71 0.00 0.00 52.55 51.44 1y8b s ASP 159 Cb -0.17 0.45 -0.11 0.00 1.01 0.00 0.00 42.92 44.09 1y8b s ASP 159 CO 0.12 -0.24 0.41 1.55 0.21 0.00 0.00 175.17 177.21 1y8b h PRO 160 N 6.80 -0.05 -1.33 8.23 0.13 -1.97 -2.69 132.00 141.12 1y8b h PRO 160 Ca 0.07 0.00 0.39 0.00 -0.87 0.00 0.00 66.00 65.59 1y8b h PRO 160 Cb 1.04 0.01 -0.07 0.00 0.13 0.00 0.00 31.00 32.11 1y8b h PRO 160 CO 0.21 0.35 0.93 0.37 -0.23 0.00 0.00 178.00 179.63 1y8b h GLN 161 N -0.99 0.07 0.03 0.86 4.15 -1.98 1.12 115.11 118.37 1y8b h GLN 161 Ca -0.01 -0.00 -0.05 0.00 0.77 0.00 0.00 58.65 59.36 1y8b h GLN 161 Cb 0.43 -0.02 0.01 0.00 0.21 0.00 0.00 27.48 28.10 1y8b h GLN 161 CO 0.01 0.05 -0.21 0.00 -1.93 0.00 0.00 178.83 176.74 1y8b h ARG 162 N 0.07 0.09 0.00 1.69 2.47 -1.96 -3.25 114.38 113.50 1y8b h ARG 162 Ca 0.67 -0.14 -0.03 0.00 -1.26 0.00 0.00 59.98 59.22 1y8b h ARG 162 Cb 2.46 0.05 -0.00 0.00 -1.65 0.00 0.00 29.97 30.83 1y8b h ARG 162 CO -0.11 1.01 -0.13 0.78 0.56 0.00 0.00 179.97 182.08 1y8b h GLY 163 N -0.75 0.00 1.01 0.04 0.00 -0.20 -2.73 103.07 100.44 1y8b h GLY 163 Ca -0.03 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.27 1y8b h GLY 163 CO 0.04 0.00 0.31 -2.09 0.00 0.00 0.00 176.54 174.80 1y8b h GLU 164 N 0.00 0.99 0.00 4.80 4.81 0.11 -1.07 114.58 124.21 1y8b h GLU 164 Ca -0.00 -0.15 -0.00 0.00 -0.13 0.00 0.00 59.36 59.07 1y8b h GLU 164 Cb 0.46 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 29.66 1y8b h GLU 164 CO 0.02 0.79 -0.00 1.96 -0.73 0.00 0.00 179.01 181.05 1y8b h GLN 165 N 0.95 0.00 0.15 1.92 4.20 -1.53 -3.25 115.11 117.54 1y8b h GLN 165 Ca 0.23 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.93 1y8b h GLN 165 Cb 0.14 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.92 1y8b h GLN 165 CO -0.03 0.00 -0.07 0.28 -0.67 0.00 0.00 178.83 178.35 1y8b h VAL 166 N 0.00 0.82 -0.57 -0.54 2.07 -1.10 -2.36 116.25 114.57 1y8b h VAL 166 Ca -0.00 -1.19 0.16 0.00 0.82 0.00 0.00 66.70 66.49 1y8b h VAL 166 Cb 0.73 1.41 -0.02 0.00 -1.52 0.00 0.00 31.29 31.88 1y8b h VAL 166 CO 0.00 0.22 0.50 0.16 0.02 0.00 0.00 177.57 178.48 1y8b h ILE 167 N -0.89 0.47 0.00 4.57 -0.00 -1.33 0.69 117.51 121.01 1y8b h ILE 167 Ca -0.02 0.00 -0.08 0.00 -0.00 0.00 0.00 64.86 64.76 1y8b h ILE 167 Cb 0.52 0.62 -0.01 0.00 -0.00 0.00 0.00 36.82 37.95 1y8b h ILE 167 CO 0.03 0.00 -0.62 0.00 -0.00 0.00 0.00 178.15 177.56 1y8b h ALA 168 N 1.53 0.72 0.02 0.16 0.00 -1.58 -2.73 119.26 117.38 1y8b h ALA 168 Ca 0.27 -0.35 -0.23 0.00 0.00 0.00 0.00 54.91 54.60 1y8b h ALA 168 Cb 1.27 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 19.05 1y8b h ALA 168 CO -0.00 0.44 -1.12 2.35 0.00 0.00 0.00 179.25 180.92 1y8b h TRP 169 N 0.00 0.08 0.00 0.00 2.91 0.89 -3.13 115.95 116.70 1y8b h TRP 169 Ca -0.03 -0.06 -0.00 0.00 1.13 0.00 0.00 58.89 59.93 1y8b h TRP 169 Cb 1.27 -0.00 -0.00 0.00 -0.51 0.00 0.00 29.16 29.92 1y8b h TRP 169 CO 0.00 1.05 -0.08 0.28 -1.03 0.00 0.00 178.44 178.66 1y8b h VAL 170 N 0.01 0.14 -0.59 2.65 2.07 -1.26 -2.96 116.25 116.32 1y8b h VAL 170 Ca -0.06 -1.11 0.17 0.00 0.82 0.00 0.00 66.70 66.52 1y8b h VAL 170 Cb 1.83 0.28 -0.02 0.00 -1.52 0.00 0.00 31.29 31.85 1y8b h VAL 170 CO 0.14 0.05 0.69 0.03 0.02 0.00 0.00 177.57 178.49 1y8b h ARG 171 N -1.00 0.00 0.00 1.57 -0.00 -1.65 1.50 114.38 114.79 1y8b h ARG 171 Ca -0.00 0.00 -0.05 0.00 -0.50 0.00 0.00 59.98 59.42 1y8b h ARG 171 Cb 0.15 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 30.11 1y8b h ARG 171 CO -0.00 0.00 -0.53 0.00 0.00 0.00 0.00 179.97 179.44 1y8b h ARG 172 N 0.00 0.00 0.13 0.04 2.47 -1.61 -2.62 114.38 112.80 1y8b h ARG 172 Ca 0.28 0.00 -0.32 0.00 -1.26 0.00 0.00 59.98 58.68 1y8b h ARG 172 Cb 1.66 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.97 1y8b h ARG 172 CO -0.00 0.18 -1.64 0.74 0.56 0.00 0.00 179.97 179.81 1y8b h PHE 173 N 0.00 0.50 0.00 3.04 -1.00 0.22 -3.33 116.94 116.38 1y8b h PHE 173 Ca -0.02 -0.37 0.00 0.00 2.81 0.00 0.00 57.97 60.39 1y8b h PHE 173 Cb 1.19 -0.02 0.00 0.00 3.61 0.00 0.00 35.95 40.73 1y8b h PHE 173 CO 0.00 1.48 -0.22 -0.07 -1.61 0.00 0.00 178.31 177.89 1y8b h LEU 174 N 0.08 0.00 -0.63 1.54 3.38 -1.32 -3.28 115.31 115.08 1y8b h LEU 174 Ca -0.29 -0.03 0.13 0.00 0.09 0.00 0.00 57.88 57.78 1y8b h LEU 174 Cb 2.04 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 42.67 1y8b h LEU 174 CO 0.16 0.02 -0.14 0.44 0.09 0.00 0.00 178.44 179.00 1y8b h ASP 175 N 0.00 -0.55 0.70 -0.43 3.32 -1.57 -1.02 116.42 116.86 1y8b h ASP 175 Ca 0.00 0.19 0.00 0.00 0.02 0.00 0.00 57.03 57.24 1y8b h ASP 175 Cb 0.88 0.38 0.00 0.00 0.22 0.00 0.00 39.33 40.81 1y8b h ASP 175 CO 0.00 -0.20 -0.96 1.21 -1.72 0.00 0.00 179.24 177.57 1y8b n GLU 176 N -5.42 0.40 0.22 3.56 4.07 -1.26 -3.92 120.64 118.30 1y8b n GLU 176 Ca 0.08 0.05 0.05 0.00 -0.06 0.00 0.00 57.16 57.28 1y8b n GLU 176 Cb 0.33 -1.69 0.48 0.00 -0.06 0.00 0.00 31.44 30.50 1y8b n GLU 176 CO 0.00 0.00 0.00 0.77 -0.06 0.00 0.00 177.13 177.84 1y8b h SER 177 N 0.00 0.00 -2.36 4.31 0.02 -1.26 -3.30 113.55 110.96 1y8b h SER 177 Ca 0.00 0.00 -0.59 0.00 -0.84 0.00 0.00 61.79 60.36 1y8b h SER 177 Cb 0.83 0.00 -0.39 0.00 0.14 0.00 0.00 62.40 62.98 1y8b h SER 177 CO 0.00 0.24 -0.91 0.18 -1.14 0.00 0.00 176.83 175.20 1y8b n LEU 178 N -4.18 0.78 0.00 5.07 4.32 -0.89 -4.95 117.00 117.15 1y8b n LEU 178 Ca -0.02 -4.73 0.01 0.00 -0.02 0.00 0.00 56.01 51.24 1y8b n LEU 178 Cb 0.30 0.22 0.03 0.00 -1.62 0.00 0.00 43.42 42.34 1y8b n LEU 178 CO 0.36 1.93 0.32 -2.65 -1.22 0.00 0.00 177.39 176.13 1y8b n PRO 179 N 2.04 0.03 0.00 3.23 -0.02 -1.25 -4.65 135.00 134.39 1y8b n PRO 179 Ca 0.26 0.09 0.00 0.00 -2.02 0.00 0.00 63.50 61.83 1y8b n PRO 179 Cb 0.46 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.44 1y8b n PRO 179 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1y8b n LEU 180 N -1.09 0.00 -0.04 2.45 4.77 -1.26 -1.72 117.00 120.10 1y8b n LEU 180 Ca 0.01 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.89 1y8b n LEU 180 Cb 0.01 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.01 1y8b n LEU 180 CO 0.01 -0.42 0.29 -0.08 -1.33 0.00 0.00 177.39 175.85 1y8b h GLU 181 N 0.00 -0.04 0.00 3.23 4.81 -1.59 -3.37 114.58 117.62 1y8b h GLU 181 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1y8b h GLU 181 Cb 0.00 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.39 1y8b h GLU 181 CO 0.00 0.55 -1.39 0.09 -0.73 0.00 0.00 179.01 177.53 1y8b n ASN 182 N -4.73 0.47 0.00 1.04 4.13 -1.26 -4.98 115.26 109.93 1y8b n ASN 182 Ca -0.07 0.04 0.00 0.00 1.68 0.00 0.00 54.58 56.24 1y8b n ASN 182 Cb 0.30 1.13 0.00 0.00 -1.54 0.00 0.00 39.78 39.67 1y8b n ASN 182 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1y8b n GLY 183 N 1.26 -1.50 0.00 7.41 0.00 -0.70 -5.06 105.19 106.60 1y8b n GLY 183 Ca -0.01 -1.31 0.00 0.00 0.00 0.00 0.00 46.02 44.70 1y8b n GLY 183 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1y8b n SER 184 N -0.77 0.00 -0.30 1.61 2.88 -1.26 -5.01 113.62 110.77 1y8b n SER 184 Ca 0.00 0.00 0.12 0.00 -1.33 0.00 0.00 58.87 57.66 1y8b n SER 184 Cb 0.00 0.00 0.29 0.00 -0.75 0.00 0.00 64.21 63.75 1y8b n SER 184 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 1y8b h TYR 185 N 0.00 0.52 0.00 0.66 3.20 -1.84 0.47 116.97 119.98 1y8b h TYR 185 Ca 0.00 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.91 1y8b h TYR 185 Cb 0.00 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 38.18 1y8b h TYR 185 CO 0.00 -0.10 0.00 1.96 -1.64 0.00 0.00 178.16 178.38 1y8b h GLN 186 N 0.33 0.00 -0.37 1.82 4.20 -1.93 -2.60 115.11 116.55 1y8b h GLN 186 Ca 0.54 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.25 1y8b h GLN 186 Cb 1.03 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.81 1y8b h GLN 186 CO -0.56 0.00 0.00 -0.25 -0.67 0.00 0.00 178.83 177.35 1y8b n ASP 187 N -2.95 2.89 -4.58 1.46 9.92 0.16 -4.94 116.55 118.51 1y8b n ASP 187 Ca 0.01 -1.92 -0.29 0.00 -0.53 0.00 0.00 54.79 52.06 1y8b n ASP 187 Cb 0.33 -0.24 0.21 0.00 -0.64 0.00 0.00 41.12 40.78 1y8b n ASP 187 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1y8b s VAL 188 N -1.52 2.12 0.00 2.53 1.01 -0.88 0.33 120.40 123.99 1y8b s VAL 188 Ca 0.37 0.04 0.00 0.00 0.00 0.00 0.00 61.98 62.39 1y8b s VAL 188 Cb 0.21 -2.24 0.00 0.00 0.00 0.00 0.00 36.38 34.35 1y8b s VAL 188 CO 0.29 -0.05 0.00 1.33 0.00 0.00 0.00 175.10 176.67 1y8b n VAL 189 N -4.57 0.00 -3.92 2.92 0.24 -0.74 -4.43 118.33 107.83 1y8b n VAL 189 Ca 0.05 0.00 -0.01 0.00 -2.04 0.00 0.00 64.34 62.34 1y8b n VAL 189 Cb 0.55 0.00 0.02 0.00 -1.47 0.00 0.00 33.84 32.93 1y8b n VAL 189 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1y8b n ALA 190 N -0.39 -2.88 -3.12 2.33 0.00 -1.26 -4.19 120.51 110.99 1y8b n ALA 190 Ca 0.00 -0.92 -0.12 0.00 0.00 0.00 0.00 53.44 52.40 1y8b n ALA 190 Cb 0.00 0.42 -0.06 0.00 0.00 0.00 0.00 19.45 19.81 1y8b n ALA 190 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1y8b s PHE 191 N -2.18 -0.25 0.07 0.00 0.40 -1.26 -3.04 117.98 111.72 1y8b s PHE 191 Ca 0.24 0.14 -0.06 0.00 -0.60 0.00 0.00 56.93 56.66 1y8b s PHE 191 Cb -0.02 0.23 -0.01 0.00 0.51 0.00 0.00 43.02 43.73 1y8b s PHE 191 CO 0.03 -0.61 0.12 0.15 0.70 0.00 0.00 175.22 175.61 1y8b s LYS 192 N -2.82 0.74 -0.53 0.44 1.02 -1.23 -4.78 119.74 112.58 1y8b s LYS 192 Ca -0.03 -0.99 -0.21 0.00 0.02 0.00 0.00 55.97 54.76 1y8b s LYS 192 Cb -0.00 0.29 0.06 0.00 -0.52 0.00 0.00 37.83 37.66 1y8b s LYS 192 CO -0.05 -0.21 0.73 0.08 -0.92 0.00 0.00 175.35 174.99 1y8b s VAL 193 N -3.66 4.72 0.10 3.17 1.01 -0.79 -1.63 120.40 123.31 1y8b s VAL 193 Ca 0.04 -0.33 0.05 0.00 0.00 0.00 0.00 61.98 61.74 1y8b s VAL 193 Cb 0.05 -4.39 -0.04 0.00 0.00 0.00 0.00 36.38 31.99 1y8b s VAL 193 CO -0.10 -0.94 0.03 -0.69 0.00 0.00 0.00 175.10 173.41 1y8b s VAL 194 N 3.05 4.17 -0.72 2.92 1.01 -0.66 -4.82 120.40 125.34 1y8b s VAL 194 Ca 0.19 -0.98 0.00 0.00 0.00 0.00 0.00 61.98 61.19 1y8b s VAL 194 Cb -0.18 -3.02 0.00 0.00 0.00 0.00 0.00 36.38 33.18 1y8b s VAL 194 CO 0.13 0.08 0.00 -0.90 0.00 0.00 0.00 175.10 174.41 1y8b n ASP 195 N 0.38 0.00 0.02 3.32 5.75 -1.26 -1.83 116.55 122.93 1y8b n ASP 195 Ca -0.10 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.68 1y8b n ASP 195 Cb 0.52 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.61 1y8b n ASP 195 CO 0.00 0.00 0.00 2.29 -0.11 0.00 0.00 177.20 179.38 1y8b n LYS 196 N 0.36 0.00 0.00 0.11 2.85 -1.26 -5.17 118.16 115.05 1y8b n LYS 196 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1y8b n LYS 196 Cb 0.00 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.38 1y8b n LYS 196 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1y8b n GLN 197 N -2.60 0.00 -2.36 -1.58 10.64 -0.76 -5.12 117.38 115.61 1y8b n GLN 197 Ca 0.00 0.00 -0.42 0.00 -1.83 0.00 0.00 57.00 54.75 1y8b n GLN 197 Cb 0.00 0.00 -0.03 0.00 -0.86 0.00 0.00 30.24 29.35 1y8b n GLN 197 CO 0.00 0.00 0.00 -1.17 -1.83 0.00 0.00 177.06 174.06 1y8b s LEU 198 N 0.00 4.32 -1.05 2.61 2.96 -1.26 -1.66 118.68 124.61 1y8b s LEU 198 Ca 0.00 1.99 -0.16 0.00 -0.22 0.00 0.00 54.13 55.75 1y8b s LEU 198 Cb 0.00 -3.57 0.16 0.00 0.50 0.00 0.00 46.19 43.29 1y8b s LEU 198 CO 0.00 -0.60 1.23 -0.13 -1.32 0.00 0.00 176.35 175.53 1y8b s ARG 199 N 1.90 3.84 -0.00 1.98 0.52 -0.65 -4.80 118.95 121.73 1y8b s ARG 199 Ca 0.60 -2.25 -0.30 0.00 -0.52 0.00 0.00 55.73 53.25 1y8b s ARG 199 Cb -0.29 -4.92 -0.03 0.00 0.52 0.00 0.00 34.95 30.23 1y8b s ARG 199 CO 0.26 -1.70 1.02 0.42 0.02 0.00 0.00 175.30 175.32 1y8b s ILE 200 N 1.77 4.73 0.00 1.52 1.09 -1.26 -3.54 121.20 125.51 1y8b s ILE 200 Ca 0.36 1.96 0.02 0.00 -1.10 0.00 0.00 60.65 61.88 1y8b s ILE 200 Cb -0.05 -4.26 -0.04 0.00 -1.06 0.00 0.00 42.46 37.06 1y8b s ILE 200 CO -0.05 0.13 0.00 -1.10 -0.10 0.00 0.00 174.94 173.82 1y8b s GLN 201 N 1.15 2.78 0.32 2.79 -0.21 -1.17 -2.16 119.66 123.15 1y8b s GLN 201 Ca 0.53 -0.62 0.07 0.00 0.02 0.00 0.00 55.36 55.36 1y8b s GLN 201 Cb -0.22 -2.67 -0.02 0.00 1.00 0.00 0.00 33.01 31.10 1y8b s GLN 201 CO 0.27 0.62 0.34 -0.51 -2.12 0.00 0.00 175.29 173.89 1y8b s LEU 202 N -1.57 3.79 0.00 2.90 1.43 -0.86 -1.79 118.68 122.58 1y8b s LEU 202 Ca 0.20 -0.33 0.00 0.00 -1.03 0.00 0.00 54.13 52.97 1y8b s LEU 202 Cb -0.12 -2.44 0.00 0.00 0.03 0.00 0.00 46.19 43.66 1y8b s LEU 202 CO 0.10 -0.32 0.64 1.17 0.23 0.00 0.00 176.35 178.18 1y8b n LYS 203 N -1.43 0.00 0.00 1.70 4.81 1.00 -0.66 118.16 123.58 1y8b n LYS 203 Ca -0.03 0.15 0.12 0.00 -0.87 0.00 0.00 58.31 57.69 1y8b n LYS 203 Cb 0.59 -1.51 0.14 0.00 0.02 0.00 0.00 35.03 34.28 1y8b n LYS 203 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1y8b n ASN 204 N -1.14 2.68 -0.81 3.14 4.13 -1.26 -4.95 115.26 117.06 1y8b n ASN 204 Ca 0.00 -1.87 -0.03 0.00 1.68 0.00 0.00 54.58 54.36 1y8b n ASN 204 Cb 0.01 0.06 0.01 0.00 -1.54 0.00 0.00 39.78 38.31 1y8b n ASN 204 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1y8b n GLY 205 N 1.34 0.67 3.32 7.41 0.00 0.17 -5.06 105.19 113.04 1y8b n GLY 205 Ca 0.14 -0.59 -0.20 0.00 0.00 0.00 0.00 46.02 45.36 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 -4.99 1.24 -0.11 1.61 2.47 -1.26 -4.95 119.74 113.75 1y8b s LYS 206 Ca 0.06 -1.41 -0.04 0.00 -1.56 0.00 0.00 55.97 53.02 1y8b s LYS 206 Cb -0.03 -1.21 -0.04 0.00 -1.46 0.00 0.00 37.83 35.10 1y8b s LYS 206 CO 0.08 0.23 0.06 -1.21 0.16 0.00 0.00 175.35 174.67 1y8b s GLU 207 N -2.94 3.25 0.40 4.03 2.02 -1.26 -2.02 118.70 122.18 1y8b s GLU 207 Ca 0.16 -0.30 0.04 0.00 0.02 0.00 0.00 54.97 54.88 1y8b s GLU 207 Cb -0.05 -2.98 -0.04 0.00 0.10 0.00 0.00 34.13 31.17 1y8b s GLU 207 CO 0.06 0.68 0.08 -0.08 0.02 0.00 0.00 175.26 176.02 1y8b s THR 208 N -0.80 0.97 0.22 3.63 -1.32 -0.92 -5.02 115.64 112.40 1y8b s THR 208 Ca 0.13 -2.00 0.01 0.00 -1.21 0.00 0.00 61.69 58.62 1y8b s THR 208 Cb -0.12 -2.51 -0.05 0.00 -1.51 0.00 0.00 72.50 68.32 1y8b s THR 208 CO 0.03 0.00 0.07 0.28 -2.21 0.00 0.00 174.62 172.79 1y8b s THR 209 N -3.16 0.49 -0.08 5.08 -1.32 -1.26 -4.06 115.64 111.33 1y8b s THR 209 Ca 0.26 -1.99 -0.22 0.00 -1.21 0.00 0.00 61.69 58.53 1y8b s THR 209 Cb 0.05 -2.44 -0.04 0.00 -1.51 0.00 0.00 72.50 68.56 1y8b s THR 209 CO 0.13 -0.16 0.66 -0.76 -2.21 0.00 0.00 174.62 172.28 1y8b s LEU 210 N -3.24 4.30 0.24 9.08 1.43 -1.26 -1.45 118.68 127.78 1y8b s LEU 210 Ca 0.33 1.11 -0.07 0.00 -1.03 0.00 0.00 54.13 54.48 1y8b s LEU 210 Cb 0.07 -3.01 0.24 0.00 0.03 0.00 0.00 46.19 43.52 1y8b s LEU 210 CO 0.10 -0.10 1.91 0.08 0.23 0.00 0.00 176.35 178.57 1y8b h ARG 211 N 6.78 1.28 -4.47 1.70 0.11 -1.94 -3.37 114.38 114.47 1y8b h ARG 211 Ca -0.41 -0.09 -0.72 0.00 0.10 0.00 0.00 59.98 58.87 1y8b h ARG 211 Cb 1.19 -0.28 -0.27 0.00 1.11 0.00 0.00 29.97 31.72 1y8b h ARG 211 CO 0.76 0.86 -0.47 0.95 0.10 0.00 0.00 179.97 182.16 1y8b s THR 212 N -6.07 4.31 0.59 0.08 -4.23 -1.26 -4.95 115.64 104.10 1y8b s THR 212 Ca -0.13 -1.30 0.30 0.00 -1.18 0.00 0.00 61.69 59.37 1y8b s THR 212 Cb 0.17 -3.60 0.42 0.00 1.34 0.00 0.00 72.50 70.83 1y8b s THR 212 CO 0.82 -0.46 1.75 -0.65 -0.54 0.00 0.00 174.62 175.54 1y8b h PRO 213 N 8.42 0.00 0.00 3.99 0.11 -1.98 0.78 132.00 143.32 1y8b h PRO 213 Ca -0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.88 1y8b h PRO 213 Cb 1.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1y8b h PRO 213 CO 0.75 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.54 1y8b n ALA 214 N -2.40 2.27 0.09 -0.75 0.00 -1.26 -2.68 120.51 115.77 1y8b n ALA 214 Ca 0.15 -0.11 -0.04 0.00 0.00 0.00 0.00 53.44 53.44 1y8b n ALA 214 Cb 0.96 -1.28 -0.03 0.00 0.00 0.00 0.00 19.45 19.10 1y8b n ALA 214 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1y8b h GLN 215 N 0.00 0.00 -4.52 0.00 5.75 0.40 -3.40 115.11 113.34 1y8b h GLN 215 Ca 0.00 0.00 -0.71 0.00 -0.15 0.00 0.00 58.65 57.79 1y8b h GLN 215 Cb 0.00 0.00 -0.24 0.00 1.07 0.00 0.00 27.48 28.31 1y8b h GLN 215 CO 0.00 0.83 -0.47 -0.59 -2.65 0.00 0.00 178.83 175.95 1y8b s PHE 216 N -2.94 3.25 0.00 3.99 -0.71 -1.09 -0.10 117.98 120.39 1y8b s PHE 216 Ca 0.01 -0.95 0.00 0.00 -1.04 0.00 0.00 56.93 54.95 1y8b s PHE 216 Cb 0.10 -2.60 0.00 0.00 -1.21 0.00 0.00 43.02 39.31 1y8b s PHE 216 CO 0.79 -0.68 0.00 0.28 -1.34 0.00 0.00 175.22 174.28 1y8b n VAL 217 N 5.04 0.00 -2.74 -2.49 0.31 -1.17 -4.91 118.33 112.37 1y8b n VAL 217 Ca -0.11 0.48 0.00 0.00 -0.01 0.00 0.00 64.34 64.70 1y8b n VAL 217 Cb 0.46 -1.47 0.00 0.00 -0.91 0.00 0.00 33.84 31.92 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 1.78 4.29 3.90 2.92 0.00 -1.26 -2.48 105.19 114.34 1y8b n GLY 218 Ca 0.00 -1.21 -0.02 0.00 0.00 0.00 0.00 46.02 44.79 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 -2.00 0.06 0.08 1.61 -0.85 -1.05 -2.70 117.35 112.50 1y8b s TYR 219 Ca 0.00 -0.41 0.01 0.00 -0.52 0.00 0.00 57.07 56.15 1y8b s TYR 219 Cb 0.00 0.67 -0.04 0.00 0.38 0.00 0.00 41.96 42.97 1y8b s TYR 219 CO 0.00 -0.80 -0.05 0.50 -1.52 0.00 0.00 175.55 173.68 1y8b s ARG 220 N -2.15 0.74 0.98 -3.49 3.52 -1.19 -3.13 118.95 114.24 1y8b s ARG 220 Ca 0.23 -1.28 0.00 0.00 -0.13 0.00 0.00 55.73 54.55 1y8b s ARG 220 Cb -0.02 -0.06 0.00 0.00 -1.56 0.00 0.00 34.95 33.31 1y8b s ARG 220 CO 0.04 -0.05 0.00 0.41 -0.81 0.00 0.00 175.30 174.89 1y8b n GLY 221 N 0.05 -1.79 3.89 8.12 0.00 -1.26 -2.73 105.19 111.47 1y8b n GLY 221 Ca -0.13 -1.61 -0.29 0.00 0.00 0.00 0.00 46.02 43.99 1y8b n GLY 221 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1y8b s ASP 222 N -4.00 5.92 0.42 1.61 2.15 -1.06 -4.87 116.67 116.85 1y8b s ASP 222 Ca 0.00 1.12 0.10 0.00 0.43 0.00 0.00 52.55 54.20 1y8b s ASP 222 Cb 0.00 -2.15 0.90 0.00 -0.30 0.00 0.00 42.92 41.37 1y8b s ASP 222 CO 0.00 -0.97 2.00 0.00 -0.17 0.00 0.00 175.17 176.04 1y8b h ALA 223 N -0.27 1.66 -0.56 3.66 0.00 -1.91 -0.89 119.26 120.96 1y8b h ALA 223 Ca -0.45 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1y8b h ALA 223 Cb 1.22 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1y8b h ALA 223 CO 0.62 0.26 0.00 0.00 0.00 0.00 0.00 179.25 180.13 1y8b n ALA 224 N -2.50 2.41 -2.90 0.00 0.00 -1.26 -1.88 120.51 114.38 1y8b n ALA 224 Ca -0.00 -1.02 -0.14 0.00 0.00 0.00 0.00 53.44 52.28 1y8b n ALA 224 Cb 0.17 -0.95 0.01 0.00 0.00 0.00 0.00 19.45 18.68 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 1.25 -0.02 -2.30 0.00 0.00 -0.35 -5.06 120.51 114.02 1y8b n ALA 225 Ca 0.20 -2.11 -0.37 0.00 0.00 0.00 0.00 53.44 51.16 1y8b n ALA 225 Cb 0.51 -1.14 -0.04 0.00 0.00 0.00 0.00 19.45 18.78 1y8b n ALA 225 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1y8b s PRO 226 N -0.05 2.99 0.15 0.00 0.02 -1.12 -2.55 135.00 134.44 1y8b s PRO 226 Ca 0.33 -0.29 -0.26 0.00 0.02 0.00 0.00 61.00 60.79 1y8b s PRO 226 Cb 0.22 -4.79 -0.00 0.00 0.02 0.00 0.00 34.50 29.95 1y8b s PRO 226 CO -0.18 -2.64 1.60 0.00 -0.33 0.00 0.00 177.00 175.45 1y8b h THR 227 N 6.77 0.22 -2.77 0.99 1.03 -1.82 -3.42 112.91 113.91 1y8b h THR 227 Ca -0.04 0.00 -0.47 0.00 -0.01 0.00 0.00 66.41 65.89 1y8b h THR 227 Cb 1.05 0.22 -0.14 0.00 -1.07 0.00 0.00 68.15 68.21 1y8b h THR 227 CO 1.29 0.00 -0.70 0.00 -0.01 0.00 0.00 175.52 176.10 1y8b s ILE 229 N -3.01 0.70 -0.18 0.00 1.01 -0.97 -3.16 121.20 115.59 1y8b s ILE 229 Ca 0.26 -0.86 -0.03 0.00 0.00 0.00 0.00 60.65 60.02 1y8b s ILE 229 Cb 0.02 -0.68 -0.02 0.00 0.01 0.00 0.00 42.46 41.79 1y8b s ILE 229 CO 0.10 -0.14 -0.05 -0.22 0.00 0.00 0.00 174.94 174.62 1y8b s LEU 230 N -1.11 3.05 0.15 2.97 2.96 -1.10 -2.76 118.68 122.84 1y8b s LEU 230 Ca -0.03 -0.26 0.09 0.00 -0.22 0.00 0.00 54.13 53.71 1y8b s LEU 230 Cb -0.07 -1.75 -0.04 0.00 0.50 0.00 0.00 46.19 44.83 1y8b s LEU 230 CO 0.01 0.09 -0.21 -0.76 -1.32 0.00 0.00 176.35 174.16 1y8b s LEU 231 N 0.83 2.39 -0.11 -0.68 1.43 -0.57 -3.07 118.68 118.90 1y8b s LEU 231 Ca -0.01 -0.80 0.02 0.00 -1.03 0.00 0.00 54.13 52.30 1y8b s LEU 231 Cb -0.15 -0.93 0.01 0.00 0.03 0.00 0.00 46.19 45.16 1y8b s LEU 231 CO 0.01 0.03 -0.16 -0.75 0.23 0.00 0.00 176.35 175.72 1y8b s LYS 232 N -2.46 2.30 -0.11 1.70 2.36 0.86 -0.73 119.74 123.66 1y8b s LYS 232 Ca 0.14 -0.59 -0.05 0.00 -2.55 0.00 0.00 55.97 52.92 1y8b s LYS 232 Cb -0.08 -1.95 0.05 0.00 -1.05 0.00 0.00 37.83 34.80 1y8b s LYS 232 CO 0.06 -0.06 0.25 0.54 1.55 0.00 0.00 175.35 177.69 1y8b s ASN 233 N 0.99 -0.11 -1.47 1.43 4.22 0.22 -4.31 114.94 115.90 1y8b s ASN 233 Ca -0.06 0.54 -0.11 0.00 -2.14 0.00 0.00 52.86 51.08 1y8b s ASN 233 Cb -0.15 0.47 0.06 0.00 1.28 0.00 0.00 41.25 42.91 1y8b s ASN 233 CO -0.02 -0.18 0.80 -3.20 -2.04 0.00 0.00 177.10 172.45 1y8b n ASN 234 N 4.49 -4.86 0.00 3.54 4.05 -1.26 0.38 115.26 121.60 1y8b n ASN 234 Ca -0.21 -0.57 0.00 0.00 0.45 0.00 0.00 54.58 54.25 1y8b n ASN 234 Cb 0.52 -3.92 0.00 0.00 1.23 0.00 0.00 39.78 37.61 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 -1.54 2.25 3.78 8.20 0.00 -1.26 -4.60 105.19 112.02 1y8b n GLY 235 Ca -0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1y8b n GLY 235 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1y8b s LEU 236 N 0.00 4.58 0.13 0.99 1.98 0.16 -4.64 118.68 121.89 1y8b s LEU 236 Ca 0.00 1.60 0.04 0.00 -2.89 0.00 0.00 54.13 52.87 1y8b s LEU 236 Cb 0.00 -3.25 -0.04 0.00 0.66 0.00 0.00 46.19 43.56 1y8b s LEU 236 CO 0.00 0.21 0.14 -1.00 -1.89 0.00 0.00 176.35 173.81 1y8b s HIS 237 N -1.09 3.22 0.16 5.38 3.76 -1.26 0.70 115.29 126.15 1y8b s HIS 237 Ca 0.35 0.04 0.07 0.00 -0.15 0.00 0.00 55.06 55.37 1y8b s HIS 237 Cb -0.23 -1.57 -0.04 0.00 1.11 0.00 0.00 32.58 31.85 1y8b s HIS 237 CO 0.25 0.52 -0.14 0.42 -0.85 0.00 0.00 174.74 174.94 1y8b s ILE 238 N -1.62 1.53 -0.13 0.60 1.09 0.09 -3.34 121.20 119.42 1y8b s ILE 238 Ca 0.31 -1.95 -0.03 0.00 -1.10 0.00 0.00 60.65 57.88 1y8b s ILE 238 Cb -0.11 -1.79 0.05 0.00 -1.06 0.00 0.00 42.46 39.55 1y8b s ILE 238 CO 0.24 -0.49 0.05 -0.70 -0.10 0.00 0.00 174.94 173.94 1y8b s GLU 239 N -3.13 0.29 -0.34 2.79 2.12 0.14 -1.51 118.70 119.06 1y8b s GLU 239 Ca 0.15 -0.03 -0.14 0.00 0.36 0.00 0.00 54.97 55.31 1y8b s GLU 239 Cb -0.03 -1.44 -0.01 0.00 0.26 0.00 0.00 34.13 32.91 1y8b s GLU 239 CO 0.05 -0.51 0.32 -0.51 -0.54 0.00 0.00 175.26 174.06 1y8b s LEU 240 N 2.04 4.46 -0.74 2.70 1.43 -1.11 -2.58 118.68 124.88 1y8b s LEU 240 Ca 0.03 -0.29 -0.19 0.00 -1.03 0.00 0.00 54.13 52.64 1y8b s LEU 240 Cb -0.15 -2.27 0.12 0.00 0.03 0.00 0.00 46.19 43.92 1y8b s LEU 240 CO -0.07 -0.30 0.91 -1.58 0.23 0.00 0.00 176.35 175.54 1y8b s GLN 241 N 1.92 3.29 -0.05 1.70 -0.44 -1.25 -2.28 119.66 122.54 1y8b s GLN 241 Ca 0.10 -1.46 -0.30 0.00 -2.50 0.00 0.00 55.36 51.20 1y8b s GLN 241 Cb -0.17 -4.48 -0.04 0.00 -1.64 0.00 0.00 33.01 26.69 1y8b s GLN 241 CO 0.11 -1.66 1.27 0.42 0.50 0.00 0.00 175.29 175.94 1y8b s ILE 242 N 2.75 4.11 -0.27 -2.34 -1.09 0.43 -2.89 121.20 121.90 1y8b s ILE 242 Ca 0.21 1.44 -0.05 0.00 -2.23 0.00 0.00 60.65 60.02 1y8b s ILE 242 Cb -0.15 -3.92 0.14 0.00 -1.58 0.00 0.00 42.46 36.95 1y8b s ILE 242 CO 0.01 -0.02 0.55 -0.62 -1.23 0.00 0.00 174.94 173.63 1y8b s ASP 243 N 1.68 -0.87 0.56 3.58 -1.08 -1.15 -4.77 116.67 114.63 1y8b s ASP 243 Ca 0.58 1.04 0.32 0.00 -0.52 0.00 0.00 52.55 53.96 1y8b s ASP 243 Cb -0.26 1.92 1.69 0.00 -1.46 0.00 0.00 42.92 44.81 1y8b s ASP 243 CO 0.22 -0.25 2.15 0.00 0.52 0.00 0.00 175.17 177.82 1y8b h ALA 244 N 8.06 1.25 0.00 3.66 0.00 -1.94 -2.45 119.26 127.84 1y8b h ALA 244 Ca -0.20 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1y8b h ALA 244 Cb 1.13 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1y8b h ALA 244 CO 0.18 0.08 0.38 -1.71 0.00 0.00 0.00 179.25 178.19 1y8b n ASN 245 N -3.53 0.16 -4.78 0.00 5.15 -1.26 -4.45 115.26 106.55 1y8b n ASN 245 Ca -0.02 0.38 -0.37 0.00 -0.60 0.00 0.00 54.58 53.97 1y8b n ASN 245 Cb 0.18 -0.30 -0.05 0.00 -0.53 0.00 0.00 39.78 39.08 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 -2.76 2.78 0.15 8.20 0.00 -0.92 -4.95 107.32 109.81 1y8b s GLY 246 Ca -0.01 0.66 0.07 0.00 0.00 0.00 0.00 44.72 45.45 1y8b s GLY 246 CO 0.06 1.11 1.34 0.07 0.00 0.00 0.00 173.10 175.68 1y8b h ARG 247 N 2.80 0.01 0.10 2.90 -0.00 -1.92 -3.21 114.38 115.06 1y8b h ARG 247 Ca -0.48 -0.02 -0.15 0.00 -0.00 0.00 0.00 59.98 59.33 1y8b h ARG 247 Cb 1.21 0.01 0.01 0.00 -0.00 0.00 0.00 29.97 31.20 1y8b h ARG 247 CO 0.63 0.93 -0.67 0.97 -0.00 0.00 0.00 179.97 181.84 1y8b h ILE 248 N 0.01 1.54 -0.82 0.08 6.09 -1.92 -3.26 117.51 119.22 1y8b h ILE 248 Ca -0.01 -2.48 0.23 0.00 -1.37 0.00 0.00 64.86 61.24 1y8b h ILE 248 Cb 1.64 3.20 -0.03 0.00 0.47 0.00 0.00 36.82 42.09 1y8b h ILE 248 CO 0.12 0.68 0.59 1.23 -3.07 0.00 0.00 178.15 177.70 1y8b h GLY 249 N -0.51 0.06 0.71 8.18 0.00 -1.79 0.82 103.07 110.54 1y8b h GLY 249 Ca -0.12 -0.01 -0.01 0.00 0.00 0.00 0.00 47.33 47.19 1y8b h GLY 249 CO 0.10 -0.00 -0.00 1.70 0.00 0.00 0.00 176.54 178.34 1y8b h LYS 250 N 0.03 0.07 0.13 4.80 3.64 -1.59 -3.24 116.57 120.40 1y8b h LYS 250 Ca 0.39 -0.02 -0.29 0.00 -1.27 0.00 0.00 60.65 59.46 1y8b h LYS 250 Cb 1.54 -0.01 0.02 0.00 -0.41 0.00 0.00 32.23 33.37 1y8b h LYS 250 CO -0.02 0.36 -1.25 0.22 -2.27 0.00 0.00 179.45 176.49 1y8b h ASP 251 N -0.23 0.77 -3.45 4.20 1.82 -1.11 -3.44 116.42 114.98 1y8b h ASP 251 Ca 0.01 -0.73 -0.54 0.00 -0.39 0.00 0.00 57.03 55.38 1y8b h ASP 251 Cb 0.33 -0.24 -0.03 0.00 0.68 0.00 0.00 39.33 40.06 1y8b h ASP 251 CO 0.00 1.55 0.06 -1.81 -1.61 0.00 0.00 179.24 177.43 1y8b s ASP 252 N -7.38 7.09 0.00 2.28 1.01 0.27 -4.95 116.67 114.99 1y8b s ASP 252 Ca -0.08 1.38 0.19 0.00 0.71 0.00 0.00 52.55 54.75 1y8b s ASP 252 Cb 0.06 -2.40 0.87 0.00 1.01 0.00 0.00 42.92 42.46 1y8b s ASP 252 CO 0.92 0.13 1.61 -0.81 0.21 0.00 0.00 175.17 177.23 1y8b n PRO 253 N 1.13 0.10 0.22 8.23 -0.04 -1.26 -3.01 135.00 140.37 1y8b n PRO 253 Ca -0.05 0.15 0.08 0.00 -0.04 0.00 0.00 63.50 63.64 1y8b n PRO 253 Cb 0.51 -1.50 0.51 0.00 -0.04 0.00 0.00 33.50 32.97 1y8b n PRO 253 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1y8b h ALA 254 N 2.75 1.21 0.00 0.55 0.00 -1.78 -3.40 119.26 118.60 1y8b h ALA 254 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1y8b h ALA 254 Cb 0.27 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1y8b h ALA 254 CO 0.00 0.32 0.00 0.72 0.00 0.00 0.00 179.25 180.29 1y8b n HIS 255 N -3.70 0.00 -2.25 0.00 8.25 -1.16 -4.70 115.22 111.65 1y8b n HIS 255 Ca -0.01 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.02 1y8b n HIS 255 Cb 0.37 -1.33 -0.02 0.00 1.12 0.00 0.00 29.99 30.12 1y8b n HIS 255 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1y8b s ILE 256 N -0.75 3.81 0.15 1.59 1.01 -1.26 -2.91 121.20 122.84 1y8b s ILE 256 Ca 0.00 0.86 0.30 0.00 0.00 0.00 0.00 60.65 61.80 1y8b s ILE 256 Cb 0.00 -4.00 0.33 0.00 0.01 0.00 0.00 42.46 38.80 1y8b s ILE 256 CO 0.00 -0.57 1.94 -1.13 0.00 0.00 0.00 174.94 175.18 1y8b h ASN 257 N 10.97 0.00 -3.81 3.58 -0.00 -1.69 -3.40 115.58 121.22 1y8b h ASN 257 Ca -0.30 0.00 0.17 0.00 -0.00 0.00 0.00 56.30 56.17 1y8b h ASN 257 Cb 1.13 0.00 -0.23 0.00 -0.00 0.00 0.00 38.32 39.21 1y8b h ASN 257 CO 1.05 0.09 0.73 1.51 -0.00 0.00 0.00 177.43 180.82 1y8b s ASP 258 N -5.91 -0.21 -0.29 1.15 -4.77 -1.26 -4.95 116.67 100.42 1y8b s ASP 258 Ca 0.00 0.19 -0.11 0.00 -3.30 0.00 0.00 52.55 49.33 1y8b s ASP 258 Cb 0.10 0.18 -0.04 0.00 -1.09 0.00 0.00 42.92 42.07 1y8b s ASP 258 CO 0.58 -0.23 0.20 -0.69 0.70 0.00 0.00 175.17 175.73 1y8b s VAL 259 N -1.39 5.26 -0.05 2.11 1.01 -1.26 -3.88 120.40 122.20 1y8b s VAL 259 Ca 0.04 0.07 0.05 0.00 0.00 0.00 0.00 61.98 62.14 1y8b s VAL 259 Cb -0.01 -3.55 -0.02 0.00 0.00 0.00 0.00 36.38 32.81 1y8b s VAL 259 CO -0.03 0.20 -0.20 -0.63 0.00 0.00 0.00 175.10 174.43 1y8b s ILE 260 N 1.75 2.51 0.02 2.22 1.09 -1.07 0.14 121.20 127.85 1y8b s ILE 260 Ca 0.07 -0.91 -0.10 0.00 -1.10 0.00 0.00 60.65 58.60 1y8b s ILE 260 Cb -0.16 -1.95 0.01 0.00 -1.06 0.00 0.00 42.46 39.30 1y8b s ILE 260 CO 0.11 0.58 0.21 0.68 -0.10 0.00 0.00 174.94 176.42 1y8b s VAL 261 N -0.42 0.09 -0.63 2.92 -7.23 -1.19 -0.69 120.40 113.25 1y8b s VAL 261 Ca 0.04 -0.71 -0.27 0.00 -1.81 0.00 0.00 61.98 59.23 1y8b s VAL 261 Cb -0.12 -0.69 0.01 0.00 0.56 0.00 0.00 36.38 36.13 1y8b s VAL 261 CO 0.02 -0.39 1.51 -1.61 -0.31 0.00 0.00 175.10 174.31 1y8b s GLU 262 N -1.90 3.07 -0.01 4.82 8.01 -1.21 -4.23 118.70 127.25 1y8b s GLU 262 Ca -0.10 0.30 -0.26 0.00 0.01 0.00 0.00 54.97 54.92 1y8b s GLU 262 Cb -0.04 -4.22 -0.20 0.00 -4.31 0.00 0.00 34.13 25.36 1y8b s GLU 262 CO -0.00 -2.23 1.29 0.00 0.01 0.00 0.00 175.26 174.33 1y8b h ALA 263 N 11.88 -0.02 -2.53 5.21 0.00 -1.76 -3.38 119.26 128.67 1y8b h ALA 263 Ca -0.27 -0.23 -0.78 0.00 0.00 0.00 0.00 54.91 53.64 1y8b h ALA 263 Cb 1.10 0.01 -0.25 0.00 0.00 0.00 0.00 17.79 18.64 1y8b h ALA 263 CO 1.22 -0.28 -0.04 0.00 0.00 0.00 0.00 179.25 180.15 1y8b s ALA 264 N -4.38 3.90 -0.89 0.00 0.00 -1.26 -4.14 121.76 114.98 1y8b s ALA 264 Ca -0.16 -3.00 0.25 0.00 0.00 0.00 0.00 51.96 49.06 1y8b s ALA 264 Cb 0.02 -3.41 0.53 0.00 0.00 0.00 0.00 23.12 20.27 1y8b s ALA 264 CO 0.66 -2.17 1.44 1.51 0.00 0.00 0.00 175.76 177.20 1y8b n ILE 265 N 4.49 0.11 -3.75 0.00 3.06 -1.25 -4.31 119.36 117.71 1y8b n ILE 265 Ca 0.02 -0.08 -0.13 0.00 -2.50 0.00 0.00 62.75 60.06 1y8b n ILE 265 Cb 0.44 0.06 -0.14 0.00 0.54 0.00 0.00 39.64 40.54 1y8b n ILE 265 CO 0.00 0.00 0.00 -0.55 -2.50 0.00 0.00 176.55 173.50 1y8b s SER 266 N -3.37 -0.16 -0.05 9.51 0.15 -1.20 -4.31 113.70 114.26 1y8b s SER 266 Ca 0.10 0.37 -0.04 0.00 0.70 0.00 0.00 55.95 57.08 1y8b s SER 266 Cb 0.16 0.27 0.02 0.00 -1.71 0.00 0.00 66.02 64.76 1y8b s SER 266 CO 0.69 -0.14 0.13 -0.89 1.20 0.00 0.00 173.24 174.23 1y8b s THR 267 N 1.06 -0.02 -0.28 6.45 2.01 -1.23 0.22 115.64 123.86 1y8b s THR 267 Ca -0.08 0.06 -0.11 0.00 0.31 0.00 0.00 61.69 61.87 1y8b s THR 267 Cb -0.10 -0.20 -0.05 0.00 0.01 0.00 0.00 72.50 72.16 1y8b s THR 267 CO -0.06 0.03 0.20 0.27 -0.69 0.00 0.00 174.62 174.37 1y8b s ILE 268 N 0.46 5.31 -0.77 1.82 -4.36 -1.02 -2.04 121.20 120.59 1y8b s ILE 268 Ca -0.03 0.19 -0.25 0.00 -0.26 0.00 0.00 60.65 60.30 1y8b s ILE 268 Cb -0.05 -3.54 0.05 0.00 1.25 0.00 0.00 42.46 40.17 1y8b s ILE 268 CO -0.02 0.25 1.23 -0.76 0.24 0.00 0.00 174.94 175.88 1y8b s LEU 269 N 1.75 3.57 -1.14 0.37 1.43 0.14 -3.34 118.68 121.46 1y8b s LEU 269 Ca 0.07 -0.79 -0.23 0.00 -1.03 0.00 0.00 54.13 52.16 1y8b s LEU 269 Cb -0.16 -2.52 -0.10 0.00 0.03 0.00 0.00 46.19 43.44 1y8b s LEU 269 CO 0.11 -1.67 1.93 0.47 0.23 0.00 0.00 176.35 177.42 1y8b n ASP 270 N 8.81 3.00 0.07 2.29 8.00 -1.12 -3.78 116.55 133.81 1y8b n ASP 270 Ca 0.07 -2.69 0.12 0.00 0.71 0.00 0.00 54.79 52.99 1y8b n ASP 270 Cb 0.48 -1.68 0.46 0.00 -0.02 0.00 0.00 41.12 40.37 1y8b n ASP 270 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1y8b n GLU 272 N -1.95 0.00 -0.06 0.00 4.07 -1.26 -4.94 120.64 116.51 1y8b n GLU 272 Ca 0.04 0.00 -0.11 0.00 -0.06 0.00 0.00 57.16 57.04 1y8b n GLU 272 Cb 0.30 0.00 -0.10 0.00 -0.06 0.00 0.00 31.44 31.59 1y8b n GLU 272 CO 0.00 0.00 0.00 0.38 -0.06 0.00 0.00 177.13 177.45 1y8b h ASP 273 N 0.00 -0.01 -0.86 4.31 3.04 -1.79 -3.32 116.42 117.79 1y8b h ASP 273 Ca 0.00 -0.73 -0.41 0.00 -3.24 0.00 0.00 57.03 52.65 1y8b h ASP 273 Cb 0.03 0.00 -0.25 0.00 -1.04 0.00 0.00 39.33 38.07 1y8b h ASP 273 CO 0.00 0.83 0.53 -0.24 -2.04 0.00 0.00 179.24 178.32 1y8b n SER 274 N -4.68 3.88 -4.57 4.15 2.88 -1.26 -4.82 113.62 109.20 1y8b n SER 274 Ca -0.08 -3.38 -0.25 0.00 -1.33 0.00 0.00 58.87 53.83 1y8b n SER 274 Cb 0.36 -0.79 -0.09 0.00 -0.75 0.00 0.00 64.21 62.94 1y8b n SER 274 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1y8b s VAL 275 N -2.94 3.08 0.71 2.46 1.01 -1.25 -3.84 120.40 119.63 1y8b s VAL 275 Ca 0.51 -1.93 -0.11 0.00 0.00 0.00 0.00 61.98 60.46 1y8b s VAL 275 Cb 0.43 -2.59 0.03 0.00 0.00 0.00 0.00 36.38 34.25 1y8b s VAL 275 CO 0.11 -0.27 1.08 0.00 0.00 0.00 0.00 175.10 176.02 1y8b s ALA 276 N -2.09 2.92 0.21 5.51 0.00 -1.26 -4.89 121.76 122.15 1y8b s ALA 276 Ca 0.28 -0.47 -0.32 0.00 0.00 0.00 0.00 51.96 51.45 1y8b s ALA 276 Cb -0.07 -2.94 -0.13 0.00 0.00 0.00 0.00 23.12 19.98 1y8b s ALA 276 CO 0.16 -1.20 1.50 0.00 0.00 0.00 0.00 175.76 176.22 1y8b n ALA 277 N -3.01 1.35 -3.15 0.00 0.00 -1.26 -4.88 120.51 109.56 1y8b n ALA 277 Ca 0.07 0.42 0.04 0.00 0.00 0.00 0.00 53.44 53.97 1y8b n ALA 277 Cb 0.58 -2.32 -0.00 0.00 0.00 0.00 0.00 19.45 17.71 1y8b n ALA 277 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1y8b s VAL 278 N 0.35 -0.97 1.31 0.00 0.11 -1.26 -4.39 120.40 115.55 1y8b s VAL 278 Ca 0.72 0.00 -0.20 0.00 -2.93 0.00 0.00 61.98 59.57 1y8b s VAL 278 Cb -0.65 -0.86 0.33 0.00 -1.53 0.00 0.00 36.38 33.67 1y8b s VAL 278 CO 0.45 0.00 1.00 -1.81 -3.33 0.00 0.00 175.10 171.40 1y8b s ASP 279 N 2.73 -0.11 0.38 3.54 1.01 -1.26 -4.57 116.67 118.39 1y8b s ASP 279 Ca 0.11 0.90 0.00 0.00 0.71 0.00 0.00 52.55 54.27 1y8b s ASP 279 Cb -0.09 -1.31 0.00 0.00 1.01 0.00 0.00 42.92 42.53 1y8b s ASP 279 CO -0.24 -4.79 0.79 0.00 0.21 0.00 0.00 175.17 171.15 1y8b n ALA 280 N -5.24 0.00 0.09 5.23 0.00 -1.26 -2.42 120.51 116.91 1y8b n ALA 280 Ca 0.11 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.43 1y8b n ALA 280 Cb 0.59 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.97 1y8b n ALA 280 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1y8b h GLU 281 N 0.00 -0.54 0.00 0.00 5.08 -2.02 -3.17 114.58 113.93 1y8b h GLU 281 Ca 0.00 0.04 -0.24 0.00 -1.00 0.00 0.00 59.36 58.15 1y8b h GLU 281 Cb 1.58 0.12 -0.04 0.00 0.50 0.00 0.00 28.75 30.91 1y8b h GLU 281 CO 0.00 -0.36 -1.40 0.38 -1.00 0.00 0.00 179.01 176.63 1y8b h ASP 282 N -0.56 0.00 -1.26 1.42 2.03 -1.77 -3.36 116.42 112.91 1y8b h ASP 282 Ca -0.01 0.00 0.46 0.00 -0.73 0.00 0.00 57.03 56.75 1y8b h ASP 282 Cb 0.55 0.00 -0.15 0.00 -0.83 0.00 0.00 39.33 38.90 1y8b h ASP 282 CO -0.19 0.92 0.78 0.29 -1.03 0.00 0.00 179.24 180.01 1y8b n LYS 283 N -3.12 -0.04 -0.16 4.15 4.76 -1.20 0.63 118.16 123.18 1y8b n LYS 283 Ca -0.10 1.29 -0.03 0.00 -2.87 0.00 0.00 58.31 56.61 1y8b n LYS 283 Cb 0.98 -2.48 0.04 0.00 -1.84 0.00 0.00 35.03 31.73 1y8b n LYS 283 CO 0.00 0.00 0.00 0.82 -1.37 0.00 0.00 177.40 176.85 1y8b h ILE 284 N 0.00 0.54 0.07 -0.18 5.03 -1.72 0.59 117.51 121.84 1y8b h ILE 284 Ca 0.87 -0.01 -0.24 0.00 -0.12 0.00 0.00 64.86 65.36 1y8b h ILE 284 Cb 2.66 0.50 -0.01 0.00 -3.03 0.00 0.00 36.82 36.94 1y8b h ILE 284 CO -0.56 0.01 -1.12 -0.07 -0.68 0.00 0.00 178.15 175.73 1y8b h LEU 285 N 0.03 0.23 0.46 1.44 3.38 -0.09 -3.00 115.31 117.76 1y8b h LEU 285 Ca 0.24 -0.25 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 1y8b h LEU 285 Cb 0.37 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1y8b h LEU 285 CO -0.48 1.18 -0.22 0.25 0.09 0.00 0.00 178.44 179.27 1y8b h LEU 286 N 0.04 -0.52 -2.31 1.67 6.46 -0.14 -3.06 115.31 117.45 1y8b h LEU 286 Ca -0.08 0.02 0.03 0.00 -0.12 0.00 0.00 57.88 57.74 1y8b h LEU 286 Cb 1.86 0.13 -0.00 0.00 -0.73 0.00 0.00 40.66 41.92 1y8b h LEU 286 CO 0.17 -0.17 0.20 0.22 -0.62 0.00 0.00 178.44 178.25 1y8b h TYR 287 N -1.03 0.00 -0.70 1.25 5.03 -0.02 -1.74 116.97 119.77 1y8b h TYR 287 Ca -0.06 0.00 0.15 0.00 2.58 0.00 0.00 58.73 61.40 1y8b h TYR 287 Cb 0.47 0.00 -0.11 0.00 1.55 0.00 0.00 36.73 38.64 1y8b h TYR 287 CO 0.02 0.00 0.09 -0.09 -1.32 0.00 0.00 178.16 176.86 1y8b h ARG 288 N 0.00 0.19 -0.06 1.82 2.43 -1.41 -0.60 114.38 116.74 1y8b h ARG 288 Ca 0.05 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.19 1y8b h ARG 288 Cb 0.46 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 29.97 1y8b h ARG 288 CO -0.00 0.12 -0.04 -0.91 -1.51 0.00 0.00 179.97 177.64 1y8b h ASN 289 N 0.19 0.13 -0.56 -3.80 -0.26 -1.42 0.39 115.58 110.25 1y8b h ASN 289 Ca 0.39 -0.44 0.07 0.00 -0.56 0.00 0.00 56.30 55.76 1y8b h ASN 289 Cb 0.66 -0.04 -0.10 0.00 -1.06 0.00 0.00 38.32 37.78 1y8b h ASN 289 CO -0.54 0.54 -0.52 0.25 -1.06 0.00 0.00 177.43 176.10 1y8b h LEU 290 N -0.28 -1.78 -1.50 1.61 7.12 -1.22 1.64 115.31 120.90 1y8b h LEU 290 Ca 0.01 0.26 -0.00 0.00 0.13 0.00 0.00 57.88 58.28 1y8b h LEU 290 Cb 0.49 0.76 -0.00 0.00 -0.53 0.00 0.00 40.66 41.39 1y8b h LEU 290 CO 0.01 -0.35 -0.01 -0.07 -0.13 0.00 0.00 178.44 177.89 1y8b h LEU 291 N -0.28 0.00 0.00 2.25 3.38 -1.19 -3.05 115.31 116.42 1y8b h LEU 291 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1y8b h LEU 291 Cb 0.56 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.31 1y8b h LEU 291 CO -0.68 0.01 -0.10 1.23 0.09 0.00 0.00 178.44 178.98 1y8b h GLY 292 N 1.98 0.00 0.93 0.83 0.00 0.31 -3.17 103.07 103.95 1y8b h GLY 292 Ca -0.00 0.00 0.06 0.00 0.00 0.00 0.00 47.33 47.39 1y8b h GLY 292 CO 0.00 0.00 0.48 0.17 0.00 0.00 0.00 176.54 177.19 1y8b h LEU 293 N -0.74 0.00 -0.03 3.11 8.10 0.18 0.38 115.31 126.32 1y8b h LEU 293 Ca 0.00 0.00 -0.26 0.00 0.11 0.00 0.00 57.88 57.73 1y8b h LEU 293 Cb 0.10 0.00 0.01 0.00 -0.44 0.00 0.00 40.66 40.33 1y8b h LEU 293 CO 0.00 0.00 -1.08 -0.03 -4.11 0.00 0.00 178.44 173.22 1y8b h MET 294 N 0.00 0.47 0.24 0.17 4.05 -1.64 -3.33 114.93 114.89 1y8b h MET 294 Ca 0.10 -0.58 -0.01 0.00 -0.28 0.00 0.00 59.70 58.93 1y8b h MET 294 Cb 1.05 0.18 0.00 0.00 -0.80 0.00 0.00 31.60 32.03 1y8b h MET 294 CO -0.00 1.22 -0.12 0.37 0.23 0.00 0.00 176.91 178.61 1y8b h GLN 295 N 0.23 -0.31 0.00 0.39 4.15 -0.23 -3.49 115.11 115.86 1y8b h GLN 295 Ca -0.12 0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.32 1y8b h GLN 295 Cb 1.74 0.07 0.00 0.00 0.21 0.00 0.00 27.48 29.50 1y8b h GLN 295 CO 0.19 0.06 0.00 0.41 -1.93 0.00 0.00 178.83 177.56 1y8b n GLY 296 N 0.26 1.00 2.70 2.39 0.00 -0.76 -5.08 105.19 105.69 1y8b n GLY 296 Ca -0.08 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.88 1y8b n GLY 296 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1y8b n THR 297 N 0.00 0.00 -3.41 2.61 5.66 -1.26 -5.08 114.28 112.80 1y8b n THR 297 Ca 0.00 -1.02 -0.44 0.00 -3.05 0.00 0.00 64.05 59.54 1y8b n THR 297 Cb 0.00 1.26 -0.03 0.00 -1.55 0.00 0.00 70.33 70.01 1y8b n THR 297 CO 0.00 0.00 0.00 -1.48 -3.05 0.00 0.00 175.07 170.54 1y8b s LEU 298 N -1.01 6.33 0.11 1.09 0.05 -1.26 -4.97 118.68 119.02 1y8b s LEU 298 Ca 0.25 -3.10 -0.30 0.00 0.05 0.00 0.00 54.13 51.02 1y8b s LEU 298 Cb 0.25 -2.14 -0.06 0.00 -2.05 0.00 0.00 46.19 42.20 1y8b s LEU 298 CO -0.15 -0.42 1.10 -1.58 -0.55 0.00 0.00 176.35 174.75 1y8b s GLN 299 N -0.47 4.55 -0.00 1.48 0.74 -1.26 -4.90 119.66 119.80 1y8b s GLN 299 Ca 0.23 1.66 0.02 0.00 0.05 0.00 0.00 55.36 57.31 1y8b s GLN 299 Cb -0.11 -3.34 -0.00 0.00 1.10 0.00 0.00 33.01 30.66 1y8b s GLN 299 CO -0.08 -0.03 -0.06 -1.21 -0.55 0.00 0.00 175.29 173.36 1y8b s GLU 300 N 0.30 0.45 -0.25 1.67 0.41 -1.26 -5.12 118.70 114.89 1y8b s GLU 300 Ca 0.52 -0.21 0.00 0.00 -0.41 0.00 0.00 54.97 54.87 1y8b s GLU 300 Cb -0.27 -0.43 0.04 0.00 -1.78 0.00 0.00 34.13 31.69 1y8b s GLU 300 CO 0.32 0.12 -0.09 0.15 -0.49 0.00 0.00 175.26 175.26 1y8b s LYS 301 N -0.17 2.64 0.14 1.61 3.01 -1.26 -4.39 119.74 121.32 1y8b s LYS 301 Ca 0.02 -1.09 -0.04 0.00 -1.01 0.00 0.00 55.97 53.84 1y8b s LYS 301 Cb -0.02 -2.91 -0.03 0.00 -1.01 0.00 0.00 37.83 33.86 1y8b s LYS 301 CO -0.00 -0.44 0.15 1.41 0.51 0.00 0.00 175.35 176.97 1y8b s MET 302 N 1.25 1.00 0.20 1.68 1.75 -1.26 -5.08 119.30 118.84 1y8b s MET 302 Ca -0.02 -1.30 0.05 0.00 -1.25 0.00 0.00 55.69 53.16 1y8b s MET 302 Cb -0.17 0.30 -0.03 0.00 2.84 0.00 0.00 34.83 37.76 1y8b s MET 302 CO -0.06 -0.32 0.24 -1.83 -0.65 0.00 0.00 175.02 172.40 1y8b s GLU 303 N -4.00 3.14 0.15 4.11 1.03 -1.26 -3.98 118.70 117.89 1y8b s GLU 303 Ca 0.20 -0.84 0.07 0.00 0.03 0.00 0.00 54.97 54.43 1y8b s GLU 303 Cb 0.06 -2.74 -0.04 0.00 -0.80 0.00 0.00 34.13 30.60 1y8b s GLU 303 CO 0.00 0.46 -0.16 0.21 -1.33 0.00 0.00 175.26 174.44 1y8b s LYS 304 N -3.55 1.16 0.00 -4.83 2.20 -1.26 -4.90 119.74 108.57 1y8b s LYS 304 Ca 0.33 -1.35 0.14 0.00 -0.36 0.00 0.00 55.97 54.73 1y8b s LYS 304 Cb -0.09 -1.12 0.84 0.00 -1.51 0.00 0.00 37.83 35.95 1y8b s LYS 304 CO 0.26 0.22 1.26 0.09 -0.36 0.00 0.00 175.35 176.82 1y8b n ASN 305 N 0.35 0.00 -0.03 1.43 3.02 -1.26 -3.40 115.26 115.36 1y8b n ASN 305 Ca -0.14 -0.49 -0.07 0.00 -0.03 0.00 0.00 54.58 53.86 1y8b n ASN 305 Cb 0.57 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.72 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 -0.07 -0.27 3.15 7.41 0.00 -1.26 -5.05 105.19 109.11 1y8b n GLY 306 Ca 0.11 -0.14 0.05 0.00 0.00 0.00 0.00 46.02 46.04 1y8b n GLY 306 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1y8b s ARG 307 N -2.39 0.33 -0.48 1.61 3.52 -1.22 -4.95 118.95 115.37 1y8b s ARG 307 Ca -0.15 0.48 -0.45 0.00 -0.13 0.00 0.00 55.73 55.48 1y8b s ARG 307 Cb 0.03 0.25 -0.19 0.00 -1.56 0.00 0.00 34.95 33.49 1y8b s ARG 307 CO 0.22 -0.45 1.84 0.00 -0.81 0.00 0.00 175.30 176.10 1y8b n GLN 308 N 5.38 0.14 -3.93 5.12 0.00 -1.26 -4.53 117.38 118.30 1y8b n GLN 308 Ca -0.00 0.05 -0.09 0.00 0.00 0.00 0.00 57.00 56.95 1y8b n GLN 308 Cb 0.54 -1.59 -0.09 0.00 0.00 0.00 0.00 30.24 29.10 1y8b n GLN 308 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.06 178.02 1y8b s ILE 309 N 4.35 0.13 0.05 -0.39 -4.36 -1.26 -4.91 121.20 114.81 1y8b s ILE 309 Ca 1.10 -1.10 -0.16 0.00 -0.26 0.00 0.00 60.65 60.23 1y8b s ILE 309 Cb -1.44 -0.90 -0.06 0.00 1.25 0.00 0.00 42.46 41.31 1y8b s ILE 309 CO 0.73 -0.61 0.48 -0.69 0.24 0.00 0.00 174.94 175.09 1y8b s VAL 310 N -2.62 4.92 -0.44 8.37 1.01 -1.26 -4.61 120.40 125.76 1y8b s VAL 310 Ca -0.05 0.94 -0.12 0.00 0.00 0.00 0.00 61.98 62.75 1y8b s VAL 310 Cb -0.01 -3.77 0.07 0.00 0.00 0.00 0.00 36.38 32.67 1y8b s VAL 310 CO -0.05 0.51 0.31 -0.60 0.00 0.00 0.00 175.10 175.28 1y8b s ARG 311 N -1.24 2.76 -0.14 2.72 6.06 -1.26 -5.07 118.95 122.78 1y8b s ARG 311 Ca 0.28 -1.39 -0.07 0.00 -2.50 0.00 0.00 55.73 52.04 1y8b s ARG 311 Cb -0.17 -3.92 -0.04 0.00 0.06 0.00 0.00 34.95 30.88 1y8b s ARG 311 CO 0.16 -0.97 0.12 -1.59 -2.50 0.00 0.00 175.30 170.52 1y8b s LYS 312 N 1.52 3.62 0.09 5.12 -2.85 -1.26 -4.67 119.74 121.30 1y8b s LYS 312 Ca 0.03 -0.20 -0.33 0.00 -1.00 0.00 0.00 55.97 54.47 1y8b s LYS 312 Cb -0.23 -3.20 -0.12 0.00 -2.06 0.00 0.00 37.83 32.21 1y8b s LYS 312 CO 0.04 0.61 1.74 1.47 0.10 0.00 0.00 175.35 179.31 1y8b n LEU 313 N 2.51 3.52 -4.55 2.77 -0.00 -1.26 -4.85 117.00 115.13 1y8b n LEU 313 Ca -0.19 1.02 -0.47 0.00 -0.00 0.00 0.00 56.01 56.37 1y8b n LEU 313 Cb 0.54 -1.46 -0.03 0.00 -0.00 0.00 0.00 43.42 42.47 1y8b n LEU 313 CO 0.33 -0.06 0.55 -0.46 -0.00 0.00 0.00 177.39 177.75 1y8b n ASN 314 N 4.95 0.91 -4.61 1.45 0.23 -1.26 -4.79 115.26 112.13 1y8b n ASN 314 Ca 0.19 1.15 -0.43 0.00 -0.53 0.00 0.00 54.58 54.96 1y8b n ASN 314 Cb 0.32 -1.20 -0.03 0.00 -2.08 0.00 0.00 39.78 36.80 1y8b n ASN 314 CO 0.00 0.00 0.00 -1.81 -0.93 0.00 0.00 177.26 174.52 1y8b s ASP 315 N -0.36 6.16 1.11 0.53 1.01 -1.26 -4.96 116.67 118.90 1y8b s ASP 315 Ca 0.67 1.46 -0.19 0.00 0.71 0.00 0.00 52.55 55.21 1y8b s ASP 315 Cb -0.82 -2.53 0.26 0.00 1.01 0.00 0.00 42.92 40.84 1y8b s ASP 315 CO 0.56 -1.47 1.25 -1.81 0.21 0.00 0.00 175.17 173.91 1y8b s ASP 316 N 5.07 1.82 -0.15 0.27 1.11 -1.26 -5.07 116.67 118.46 1y8b s ASP 316 Ca 0.75 0.31 -0.33 0.00 0.18 0.00 0.00 52.55 53.46 1y8b s ASP 316 Cb -0.24 -0.34 0.13 0.00 1.07 0.00 0.00 42.92 43.55 1y8b s ASP 316 CO 0.32 -3.54 1.13 -0.60 1.18 0.00 0.00 175.17 173.66 1y8b s ARG 317 N -5.77 0.43 0.47 8.23 6.06 -1.26 -5.08 118.95 122.03 1y8b s ARG 317 Ca 0.75 -0.11 -0.05 0.00 -2.50 0.00 0.00 55.73 53.81 1y8b s ARG 317 Cb -0.05 0.20 -0.04 0.00 0.06 0.00 0.00 34.95 35.13 1y8b s ARG 317 CO 0.55 -0.18 0.78 -1.01 -2.50 0.00 0.00 175.30 172.93 1y8b s HIS 318 N -2.30 3.56 0.28 5.12 3.76 -1.26 -4.47 115.29 119.97 1y8b s HIS 318 Ca 0.07 0.81 0.06 0.00 -0.15 0.00 0.00 55.06 55.85 1y8b s HIS 318 Cb -0.01 -2.30 -0.06 0.00 1.11 0.00 0.00 32.58 31.33 1y8b s HIS 318 CO -0.05 -0.25 -0.03 0.71 -0.85 0.00 0.00 174.74 174.26 1y8b s TYR 319 N -2.70 1.87 -0.48 1.40 1.51 0.29 -4.90 117.35 114.34 1y8b s TYR 319 Ca 0.47 -0.78 -0.15 0.00 -1.01 0.00 0.00 57.07 55.60 1y8b s TYR 319 Cb -0.10 -1.10 0.08 0.00 -0.11 0.00 0.00 41.96 40.73 1y8b s TYR 319 CO 0.44 0.18 0.41 0.99 -1.11 0.00 0.00 175.55 176.45 1y8b s THR 320 N -3.13 5.16 0.20 -0.71 2.01 -1.18 0.05 115.64 118.04 1y8b s THR 320 Ca 0.30 -1.17 -0.22 0.00 0.31 0.00 0.00 61.69 60.92 1y8b s THR 320 Cb 0.05 -4.13 -0.08 0.00 0.01 0.00 0.00 72.50 68.35 1y8b s THR 320 CO 0.12 -0.63 0.74 0.00 -0.69 0.00 0.00 174.62 174.16 1y8b s ALA 321 N 1.62 3.43 0.39 7.40 0.00 -1.25 -2.52 121.76 130.83 1y8b s ALA 321 Ca 0.04 0.24 0.21 0.00 0.00 0.00 0.00 51.96 52.44 1y8b s ALA 321 Cb -0.25 -2.87 1.15 0.00 0.00 0.00 0.00 23.12 21.15 1y8b s ALA 321 CO 0.06 0.31 1.98 0.00 0.00 0.00 0.00 175.76 178.11 1y8b h ALA 322 N 3.79 1.37 0.00 0.00 0.00 -1.84 -2.27 119.26 120.32 1y8b h ALA 322 Ca -0.48 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.25 1y8b h ALA 322 Cb 1.20 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1y8b h ALA 322 CO 0.65 0.25 -0.02 -3.47 0.00 0.00 0.00 179.25 176.66 1y8b n ASP 323 N -3.87 2.26 -2.71 0.00 -0.08 -1.26 -4.68 116.55 106.21 1y8b n ASP 323 Ca -0.02 -3.04 -0.04 0.00 -1.51 0.00 0.00 54.79 50.18 1y8b n ASP 323 Cb 0.29 -0.42 0.10 0.00 2.34 0.00 0.00 41.12 43.44 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 -1.38 1.76 1.23 0.27 0.00 -1.02 -5.10 105.19 100.95 1y8b n GLY 324 Ca 0.15 -0.41 -0.22 0.00 0.00 0.00 0.00 46.02 45.54 1y8b n GLY 324 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1y8b n SER 325 N -0.99 0.27 -1.25 1.61 2.88 -0.88 -3.58 113.62 111.69 1y8b n SER 325 Ca -0.07 0.24 0.00 0.00 -1.33 0.00 0.00 58.87 57.71 1y8b n SER 325 Cb 0.85 -0.34 0.00 0.00 -0.75 0.00 0.00 64.21 63.97 1y8b n SER 325 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1y8b n GLU 326 N 2.84 0.00 -4.16 -1.46 -0.58 -1.24 -4.85 120.64 111.19 1y8b n GLU 326 Ca 0.21 0.42 -0.12 0.00 -0.42 0.00 0.00 57.16 57.24 1y8b n GLU 326 Cb -0.01 -0.83 -0.10 0.00 -0.57 0.00 0.00 31.44 29.92 1y8b n GLU 326 CO 0.00 0.00 0.00 0.96 -0.48 0.00 0.00 177.13 177.61 1y8b s ILE 327 N 0.00 0.77 -0.01 -3.67 -4.36 0.11 -4.87 121.20 109.17 1y8b s ILE 327 Ca 0.00 -1.70 -0.07 0.00 -0.26 0.00 0.00 60.65 58.62 1y8b s ILE 327 Cb 0.00 -1.40 0.01 0.00 1.25 0.00 0.00 42.46 42.31 1y8b s ILE 327 CO 0.00 -0.68 0.15 -0.55 0.24 0.00 0.00 174.94 174.10 1y8b s SER 328 N -2.61 -0.03 -0.03 4.36 0.15 -1.26 0.10 113.70 114.39 1y8b s SER 328 Ca 0.06 -0.07 -0.00 0.00 0.70 0.00 0.00 55.95 56.64 1y8b s SER 328 Cb -0.00 0.24 0.03 0.00 -1.71 0.00 0.00 66.02 64.58 1y8b s SER 328 CO -0.02 -0.30 0.02 -0.76 1.20 0.00 0.00 173.24 173.39 1y8b s LEU 329 N -1.02 0.82 -0.91 3.45 1.02 -1.26 -4.88 118.68 115.89 1y8b s LEU 329 Ca -0.11 0.02 -0.18 0.00 0.02 0.00 0.00 54.13 53.88 1y8b s LEU 329 Cb -0.06 -0.17 -0.25 0.00 0.02 0.00 0.00 46.19 45.72 1y8b s LEU 329 CO 0.01 -0.16 2.32 1.57 0.02 0.00 0.00 176.35 180.12 1y8b n HIS 330 N 4.55 0.47 0.00 0.29 -0.00 -1.26 -4.62 115.22 114.65 1y8b n HIS 330 Ca -0.19 0.07 0.00 0.00 0.46 0.00 0.00 57.72 58.06 1y8b n HIS 330 Cb 0.50 -1.46 0.00 0.00 -0.12 0.00 0.00 29.99 28.91 1y8b n HIS 330 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1y8b n GLY 331 N 6.01 -0.08 3.92 1.57 0.00 -1.26 -4.55 105.19 110.81 1y8b n GLY 331 Ca 0.61 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.43 1y8b n GLY 331 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1y8b s ARG 332 N -2.01 2.80 0.59 1.61 1.81 -1.26 -4.22 118.95 118.27 1y8b s ARG 332 Ca 0.00 -1.27 -0.20 0.00 -1.72 0.00 0.00 55.73 52.54 1y8b s ARG 332 Cb 0.00 -2.59 -0.04 0.00 -0.45 0.00 0.00 34.95 31.87 1y8b s ARG 332 CO 0.00 -0.04 1.25 -1.13 -0.68 0.00 0.00 175.30 174.70 1y8b n SER 333 N -1.56 2.09 -4.70 0.23 3.41 -0.78 -4.91 113.62 107.40 1y8b n SER 333 Ca 0.01 0.90 -0.37 0.00 -0.26 0.00 0.00 58.87 59.15 1y8b n SER 333 Cb 0.60 -1.53 0.06 0.00 -0.26 0.00 0.00 64.21 63.08 1y8b n SER 333 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 1y8b n LEU 334 N -1.20 5.26 -4.22 1.04 7.94 -1.26 -4.87 117.00 119.69 1y8b n LEU 334 Ca 0.13 0.84 -0.39 0.00 -1.11 0.00 0.00 56.01 55.48 1y8b n LEU 334 Cb 0.46 -1.51 -0.11 0.00 0.53 0.00 0.00 43.42 42.80 1y8b n LEU 334 CO 0.51 -1.21 -0.14 -0.76 -1.11 0.00 0.00 177.39 174.68 1y8b s LEU 335 N -3.51 5.10 -0.17 -1.96 1.43 -1.26 -3.49 118.68 114.81 1y8b s LEU 335 Ca 0.79 -1.64 -0.04 0.00 -1.03 0.00 0.00 54.13 52.21 1y8b s LEU 335 Cb -0.40 -1.93 -0.03 0.00 0.03 0.00 0.00 46.19 43.87 1y8b s LEU 335 CO 0.43 -0.53 -0.02 -0.36 0.23 0.00 0.00 176.35 176.11 1y8b s PHE 336 N 1.34 3.05 -0.45 0.29 0.40 -0.87 -4.70 117.98 117.05 1y8b s PHE 336 Ca 0.04 -0.31 -0.21 0.00 -0.60 0.00 0.00 56.93 55.84 1y8b s PHE 336 Cb -0.23 -2.01 0.03 0.00 0.51 0.00 0.00 43.02 41.32 1y8b s PHE 336 CO 0.00 -0.08 0.69 0.42 0.70 0.00 0.00 175.22 176.95 1y8b s ILE 337 N 0.56 4.77 0.03 0.64 -1.09 -0.70 -0.68 121.20 124.73 1y8b s ILE 337 Ca -0.02 0.19 0.04 0.00 -2.23 0.00 0.00 60.65 58.63 1y8b s ILE 337 Cb -0.14 -4.25 -0.03 0.00 -1.58 0.00 0.00 42.46 36.46 1y8b s ILE 337 CO 0.02 -0.65 -0.08 -0.13 -1.23 0.00 0.00 174.94 172.87 1y8b s ARG 338 N 2.97 2.43 -0.15 2.79 0.52 -1.25 -0.97 118.95 125.30 1y8b s ARG 338 Ca 0.25 -0.80 -0.12 0.00 -0.52 0.00 0.00 55.73 54.53 1y8b s ARG 338 Cb -0.14 -2.43 0.04 0.00 0.52 0.00 0.00 34.95 32.94 1y8b s ARG 338 CO 0.20 0.58 0.38 1.21 0.02 0.00 0.00 175.30 177.69 1y8b s ASN 339 N -1.56 -0.41 0.71 0.23 3.84 -0.70 -4.12 114.94 112.92 1y8b s ASN 339 Ca 0.18 0.78 -0.10 0.00 0.21 0.00 0.00 52.86 53.92 1y8b s ASN 339 Cb -0.11 0.76 0.03 0.00 -0.55 0.00 0.00 41.25 41.38 1y8b s ASN 339 CO 0.08 -0.15 1.08 -0.69 -2.79 0.00 0.00 177.10 174.64 1y8b s VAL 340 N 0.49 3.10 0.10 -5.21 1.01 -1.26 -3.93 120.40 114.70 1y8b s VAL 340 Ca -0.02 0.26 -0.22 0.00 0.00 0.00 0.00 61.98 62.00 1y8b s VAL 340 Cb -0.04 -3.34 -0.06 0.00 0.00 0.00 0.00 36.38 32.94 1y8b s VAL 340 CO -0.03 -0.43 1.37 1.23 0.00 0.00 0.00 175.10 177.25 1y8b h GLY 341 N -0.67 -1.39 0.00 4.51 0.00 -1.93 -3.45 103.07 100.14 1y8b h GLY 341 Ca -0.45 0.84 0.00 0.00 0.00 0.00 0.00 47.33 47.72 1y8b h GLY 341 CO 0.64 -0.31 0.00 -2.39 0.00 0.00 0.00 176.54 174.47 1y8b n HIS 342 N -4.51 0.00 0.23 5.60 1.44 -1.26 -4.66 115.22 112.06 1y8b n HIS 342 Ca -0.01 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.82 1y8b n HIS 342 Cb 0.20 0.00 0.39 0.00 0.12 0.00 0.00 29.99 30.71 1y8b n HIS 342 CO 0.00 0.00 0.00 -0.07 -2.81 0.00 0.00 176.34 173.46 1y8b h LEU 343 N 0.00 0.00 -3.35 2.39 3.38 -1.93 -3.05 115.31 112.76 1y8b h LEU 343 Ca 0.00 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.81 1y8b h LEU 343 Cb 0.00 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 40.65 1y8b h LEU 343 CO 0.00 0.14 0.20 0.23 0.09 0.00 0.00 178.44 179.10 1y8b n MET 344 N -3.21 3.48 -3.67 1.13 2.81 -1.26 -4.89 117.12 111.50 1y8b n MET 344 Ca 0.01 -2.61 -0.13 0.00 -1.81 0.00 0.00 57.70 53.17 1y8b n MET 344 Cb 0.46 -2.09 -0.08 0.00 -0.71 0.00 0.00 33.22 30.80 1y8b n MET 344 CO 0.00 0.00 0.00 -0.08 1.51 0.00 0.00 175.97 177.40 1y8b s THR 345 N -2.59 -0.00 0.83 2.03 -1.32 -1.15 -4.68 115.64 108.76 1y8b s THR 345 Ca 0.47 0.01 -0.11 0.00 -1.21 0.00 0.00 61.69 60.84 1y8b s THR 345 Cb 0.37 -0.83 0.09 0.00 -1.51 0.00 0.00 72.50 70.62 1y8b s THR 345 CO 0.12 0.00 1.09 0.27 -2.21 0.00 0.00 174.62 173.89 1y8b s ILE 346 N 0.49 3.04 -0.74 5.08 -5.25 -1.26 -4.75 121.20 117.80 1y8b s ILE 346 Ca -0.01 0.34 -0.27 0.00 -0.99 0.00 0.00 60.65 59.72 1y8b s ILE 346 Cb -0.04 -2.85 0.02 0.00 2.95 0.00 0.00 42.46 42.54 1y8b s ILE 346 CO -0.02 -0.44 1.39 -2.16 -1.79 0.00 0.00 174.94 171.92 1y8b s PRO 347 N -4.94 3.13 0.51 0.37 0.04 -1.26 -4.83 135.00 128.02 1y8b s PRO 347 Ca 0.62 -0.19 0.29 0.00 0.04 0.00 0.00 61.00 61.77 1y8b s PRO 347 Cb -0.17 -4.31 1.60 0.00 0.04 0.00 0.00 34.50 31.66 1y8b s PRO 347 CO 0.56 -2.26 1.88 0.28 0.04 0.00 0.00 177.00 177.51 1y8b h VAL 348 N 6.23 0.00 -3.81 -0.36 2.07 -1.96 -3.40 116.25 115.01 1y8b h VAL 348 Ca -0.24 0.00 -0.52 0.00 0.82 0.00 0.00 66.70 66.77 1y8b h VAL 348 Cb 1.06 0.65 -0.21 0.00 -1.52 0.00 0.00 31.29 31.28 1y8b h VAL 348 CO 1.28 0.00 -0.81 -0.63 0.02 0.00 0.00 177.57 177.43 1y8b s ILE 349 N -3.82 1.60 -0.05 4.57 -1.09 -1.26 -4.62 121.20 116.52 1y8b s ILE 349 Ca -0.03 -1.57 -0.17 0.00 -2.23 0.00 0.00 60.65 56.65 1y8b s ILE 349 Cb 0.08 -1.51 -0.05 0.00 -1.58 0.00 0.00 42.46 39.40 1y8b s ILE 349 CO 0.27 -0.15 0.45 0.26 -1.23 0.00 0.00 174.94 174.54 1y8b s TRP 350 N -1.38 3.64 0.73 3.97 0.52 -1.26 -4.87 118.94 120.29 1y8b s TRP 350 Ca 0.06 0.97 -0.08 0.00 0.02 0.00 0.00 56.10 57.08 1y8b s TRP 350 Cb -0.09 -2.42 0.07 0.00 -1.15 0.00 0.00 33.47 29.87 1y8b s TRP 350 CO 0.04 0.43 1.06 0.34 0.02 0.00 0.00 176.95 178.84 1y8b s ASP 351 N -0.33 4.72 0.37 2.95 -1.08 -1.26 -3.97 116.67 118.07 1y8b s ASP 351 Ca 0.25 0.52 0.20 0.00 -0.52 0.00 0.00 52.55 53.00 1y8b s ASP 351 Cb -0.16 -1.13 0.50 0.00 -1.46 0.00 0.00 42.92 40.67 1y8b s ASP 351 CO 0.12 -1.69 1.64 0.28 0.52 0.00 0.00 175.17 176.05 1y8b h SER 352 N -0.72 0.00 0.58 -0.34 0.02 -1.92 -2.88 113.55 108.28 1y8b h SER 352 Ca -0.45 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 1y8b h SER 352 Cb 1.32 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.86 1y8b h SER 352 CO 0.61 0.33 0.00 -0.62 -1.14 0.00 0.00 176.83 176.01 1y8b n GLU 353 N -3.31 0.10 -0.98 3.45 -0.58 -1.26 -4.83 120.64 113.23 1y8b n GLU 353 Ca 0.01 0.35 0.00 0.00 -0.42 0.00 0.00 57.16 57.11 1y8b n GLU 353 Cb 0.57 -1.69 0.00 0.00 -0.57 0.00 0.00 31.44 29.75 1y8b n GLU 353 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1y8b n GLY 354 N -0.09 0.58 3.99 0.62 0.00 -1.09 -5.01 105.19 104.19 1y8b n GLY 354 Ca 0.03 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.86 1y8b n GLY 354 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1y8b s ASN 355 N -2.27 5.81 -0.99 1.61 -0.87 -1.26 -4.97 114.94 111.99 1y8b s ASN 355 Ca 0.00 -0.29 -0.15 0.00 -1.57 0.00 0.00 52.86 50.84 1y8b s ASN 355 Cb 0.00 -1.01 0.18 0.00 -0.02 0.00 0.00 41.25 40.40 1y8b s ASN 355 CO 0.00 -0.54 1.11 -1.83 -2.57 0.00 0.00 177.10 173.27 1y8b s GLU 356 N -4.22 3.78 -0.56 -0.60 -1.05 -1.26 -4.19 118.70 110.60 1y8b s GLU 356 Ca 0.48 -2.28 0.04 0.00 -0.15 0.00 0.00 54.97 53.06 1y8b s GLU 356 Cb -0.09 -4.79 0.14 0.00 -0.44 0.00 0.00 34.13 28.94 1y8b s GLU 356 CO 0.31 -1.60 0.32 0.42 0.95 0.00 0.00 175.26 175.67 1y8b s ILE 357 N 1.38 2.55 0.27 1.83 -1.09 -1.26 -4.89 121.20 119.99 1y8b s ILE 357 Ca 0.31 -3.52 -0.30 0.00 -2.23 0.00 0.00 60.65 54.91 1y8b s ILE 357 Cb -0.06 -2.75 -0.13 0.00 -1.58 0.00 0.00 42.46 37.95 1y8b s ILE 357 CO -0.07 -0.87 1.46 -2.65 -1.23 0.00 0.00 174.94 171.58 1y8b n PRO 358 N 2.83 2.28 -0.01 2.79 -0.02 -1.26 -4.87 135.00 136.73 1y8b n PRO 358 Ca 0.09 0.81 0.01 0.00 -2.02 0.00 0.00 63.50 62.40 1y8b n PRO 358 Cb 0.33 -2.50 -0.12 0.00 -0.02 0.00 0.00 33.50 31.18 1y8b n PRO 358 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1y8b n GLU 359 N 1.91 0.65 0.00 -0.52 0.28 -1.26 -4.87 120.64 116.83 1y8b n GLU 359 Ca 0.10 0.03 0.00 0.00 -0.16 0.00 0.00 57.16 57.13 1y8b n GLU 359 Cb 0.34 -1.65 0.00 0.00 1.43 0.00 0.00 31.44 31.56 1y8b n GLU 359 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1y8b n GLY 360 N 1.44 1.20 0.16 -1.84 0.00 -1.26 -4.75 105.19 100.14 1y8b n GLY 360 Ca -0.14 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.75 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 0.00 1.34 -1.01 -0.61 2.10 -1.93 -0.67 117.51 116.73 1y8b h ILE 361 Ca 0.00 -1.42 0.23 0.00 1.08 0.00 0.00 64.86 64.76 1y8b h ILE 361 Cb 0.00 1.82 -0.10 0.00 -1.09 0.00 0.00 36.82 37.45 1y8b h ILE 361 CO 0.00 0.43 0.63 0.25 -1.08 0.00 0.00 178.15 178.38 1y8b h LEU 362 N 0.15 0.60 0.13 2.19 5.85 -1.98 0.59 115.31 122.83 1y8b h LEU 362 Ca 0.02 0.10 -0.19 0.00 0.84 0.00 0.00 57.88 58.65 1y8b h LEU 362 Cb 0.79 -0.00 0.02 0.00 0.37 0.00 0.00 40.66 41.83 1y8b h LEU 362 CO 0.05 0.15 -0.89 -0.78 -0.34 0.00 0.00 178.44 176.63 1y8b h ASP 363 N 0.55 0.42 -0.79 1.25 3.58 -1.92 -0.36 116.42 119.15 1y8b h ASP 363 Ca 0.59 -0.93 0.01 0.00 0.42 0.00 0.00 57.03 57.12 1y8b h ASP 363 Cb 1.23 -0.14 -0.04 0.00 1.72 0.00 0.00 39.33 42.11 1y8b h ASP 363 CO -0.35 1.42 0.52 1.23 -2.88 0.00 0.00 179.24 179.17 1y8b h GLY 364 N -0.33 1.11 0.45 -0.78 0.00 0.16 -1.95 103.07 101.72 1y8b h GLY 364 Ca -0.17 -0.41 -0.12 0.00 0.00 0.00 0.00 47.33 46.63 1y8b h GLY 364 CO 0.12 0.40 -0.51 -2.08 0.00 0.00 0.00 176.54 174.48 1y8b h VAL 365 N 1.06 1.61 -0.52 4.60 2.07 0.02 -3.28 116.25 121.82 1y8b h VAL 365 Ca 0.29 -2.44 0.09 0.00 0.82 0.00 0.00 66.70 65.46 1y8b h VAL 365 Cb -0.12 3.24 -0.10 0.00 -1.52 0.00 0.00 31.29 32.79 1y8b h VAL 365 CO -0.06 0.67 -0.34 -0.03 0.02 0.00 0.00 177.57 177.83 1y8b h MET 366 N -0.58 -0.19 0.00 1.57 -1.53 -0.96 1.93 114.93 115.16 1y8b h MET 366 Ca -0.09 0.01 0.00 0.00 -3.44 0.00 0.00 59.70 56.19 1y8b h MET 366 Cb 1.39 0.04 0.00 0.00 -0.55 0.00 0.00 31.60 32.48 1y8b h MET 366 CO 0.10 -0.13 0.20 1.79 0.14 0.00 0.00 176.91 179.01 1y8b h THR 367 N -0.20 0.00 -0.35 -0.77 1.35 -1.47 0.50 112.91 111.97 1y8b h THR 367 Ca 0.21 0.00 -0.16 0.00 -0.55 0.00 0.00 66.41 65.91 1y8b h THR 367 Cb 0.55 0.61 -0.00 0.00 -1.73 0.00 0.00 68.15 67.57 1y8b h THR 367 CO -0.63 0.00 -0.40 1.23 -0.25 0.00 0.00 175.52 175.47 1y8b h GLY 368 N 0.00 0.96 0.08 5.82 0.00 0.30 -3.23 103.07 107.00 1y8b h GLY 368 Ca 0.00 -1.02 0.01 0.00 0.00 0.00 0.00 47.33 46.32 1y8b h GLY 368 CO 0.00 0.92 -0.41 0.00 0.00 0.00 0.00 176.54 177.05 1y8b h ALA 369 N 0.74 -0.89 -0.76 3.60 0.00 -0.71 0.35 119.26 121.59 1y8b h ALA 369 Ca 0.05 -0.08 0.22 0.00 0.00 0.00 0.00 54.91 55.09 1y8b h ALA 369 Cb 1.00 0.81 -0.03 0.00 0.00 0.00 0.00 17.79 19.56 1y8b h ALA 369 CO 0.10 -0.99 0.90 0.82 0.00 0.00 0.00 179.25 180.07 1y8b h ILE 370 N -0.57 0.14 -0.36 0.00 2.04 -1.66 0.90 117.51 118.00 1y8b h ILE 370 Ca -0.00 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.91 1y8b h ILE 370 Cb 0.58 0.26 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 1y8b h ILE 370 CO -0.23 0.00 0.25 0.00 0.00 0.00 0.00 178.15 178.16 1y8b h ALA 371 N 0.91 2.00 -0.09 1.87 0.00 -0.31 0.05 119.26 123.70 1y8b h ALA 371 Ca 0.36 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.28 1y8b h ALA 371 Cb 2.16 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 19.88 1y8b h ALA 371 CO -0.00 -0.07 0.35 -0.07 0.00 0.00 0.00 179.25 179.46 1y8b h LEU 372 N 0.27 0.00 0.39 0.00 4.07 0.81 -2.42 115.31 118.42 1y8b h LEU 372 Ca 0.16 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 58.10 1y8b h LEU 372 Cb 0.29 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.04 1y8b h LEU 372 CO -0.03 0.00 -0.19 1.88 -1.08 0.00 0.00 178.44 179.02 1y8b h TYR 373 N 0.00 -0.48 -0.09 1.13 -1.99 -1.15 -2.48 116.97 111.91 1y8b h TYR 373 Ca 0.04 -0.01 0.03 0.00 2.00 0.00 0.00 58.73 60.79 1y8b h TYR 373 Cb 0.74 0.16 -0.00 0.00 2.00 0.00 0.00 36.73 39.62 1y8b h TYR 373 CO 0.00 -0.30 0.66 0.38 -0.00 0.00 0.00 178.16 178.90 1y8b h ASP 374 N -0.94 0.00 0.23 3.88 3.04 -1.58 0.96 116.42 122.01 1y8b h ASP 374 Ca -0.05 0.00 -0.35 0.00 -3.24 0.00 0.00 57.03 53.39 1y8b h ASP 374 Cb 0.40 0.00 0.01 0.00 -1.04 0.00 0.00 39.33 38.69 1y8b h ASP 374 CO 0.09 0.00 -1.74 -0.07 -2.04 0.00 0.00 179.24 175.48 1y8b h LEU 375 N 0.00 0.57 0.00 0.15 3.38 -1.45 -3.36 115.31 114.61 1y8b h LEU 375 Ca 0.04 -0.87 -0.32 0.00 0.09 0.00 0.00 57.88 56.82 1y8b h LEU 375 Cb 1.37 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 41.87 1y8b h LEU 375 CO -0.00 1.74 -2.21 1.17 0.09 0.00 0.00 178.44 179.23 1y8b n LYS 376 N -3.56 0.97 0.10 1.13 0.00 0.73 -4.53 118.16 113.00 1y8b n LYS 376 Ca -0.24 0.04 -0.12 0.00 0.00 0.00 0.00 58.31 57.98 1y8b n LYS 376 Cb 1.07 -1.44 -0.05 0.00 0.00 0.00 0.00 35.03 34.60 1y8b n LYS 376 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.40 177.01 1y8b h VAL 377 N 0.00 0.41 -6.63 3.15 -1.51 0.55 -3.45 116.25 108.78 1y8b h VAL 377 Ca -0.48 0.00 -0.51 0.00 -1.23 0.00 0.00 66.70 64.48 1y8b h VAL 377 Cb 1.96 0.41 -0.25 0.00 -2.13 0.00 0.00 31.29 31.29 1y8b h VAL 377 CO -0.01 0.00 -0.76 0.00 -1.23 0.00 0.00 177.57 175.57 1y8b n GLN 378 N -5.38 -2.15 -0.12 5.19 10.64 -1.26 -4.78 117.38 119.52 1y8b n GLN 378 Ca -0.06 0.26 -0.16 0.00 -1.83 0.00 0.00 57.00 55.20 1y8b n GLN 378 Cb 0.29 -4.90 -0.11 0.00 -0.86 0.00 0.00 30.24 24.66 1y8b n GLN 378 CO 0.00 0.00 0.00 0.36 -1.83 0.00 0.00 177.06 175.59 1y8b n LYS 379 N -4.00 0.59 -3.16 2.61 -0.00 -1.26 -4.92 118.16 108.02 1y8b n LYS 379 Ca 0.08 0.14 0.04 0.00 -0.00 0.00 0.00 58.31 58.56 1y8b n LYS 379 Cb 0.48 -1.47 -0.00 0.00 -0.00 0.00 0.00 35.03 34.04 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 -6.28 -1.58 -0.22 -5.58 3.84 -1.26 -5.04 114.94 98.81 1y8b s ASN 380 Ca -0.32 0.07 -0.01 0.00 0.21 0.00 0.00 52.86 52.82 1y8b s ASN 380 Cb 0.08 1.99 0.06 0.00 -0.55 0.00 0.00 41.25 42.84 1y8b s ASN 380 CO 0.54 -0.28 -0.02 -0.44 -2.79 0.00 0.00 177.10 174.12 1y8b s SER 381 N 2.72 3.52 -0.02 -4.21 0.01 -1.26 -4.89 113.70 109.57 1y8b s SER 381 Ca 0.11 -1.06 -0.17 0.00 1.31 0.00 0.00 55.95 56.15 1y8b s SER 381 Cb -0.09 -0.97 -0.33 0.00 0.21 0.00 0.00 66.02 64.84 1y8b s SER 381 CO -0.24 -0.26 0.86 -0.09 0.41 0.00 0.00 173.24 173.92 1y8b h ARG 382 N 8.06 0.41 0.00 12.44 2.43 -1.97 -3.32 114.38 132.43 1y8b h ARG 382 Ca -0.17 -0.71 0.00 0.00 -0.81 0.00 0.00 59.98 58.29 1y8b h ARG 382 Cb 1.09 0.26 0.00 0.00 -0.42 0.00 0.00 29.97 30.90 1y8b h ARG 382 CO 0.39 1.34 -0.56 0.25 -1.51 0.00 0.00 179.97 179.87 1y8b n THR 383 N -3.85 0.10 -0.80 0.20 -2.24 -1.26 -4.89 114.28 101.55 1y8b n THR 383 Ca -0.18 -0.09 -0.02 0.00 -2.27 0.00 0.00 64.05 61.49 1y8b n THR 383 Cb 0.99 0.13 -0.01 0.00 -2.10 0.00 0.00 70.33 69.35 1y8b n THR 383 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1y8b n GLY 384 N 1.45 0.21 3.41 3.38 0.00 -1.25 -4.77 105.19 107.62 1y8b n GLY 384 Ca 0.05 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.90 1y8b n GLY 384 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1y8b s SER 385 N -0.97 1.26 -0.25 1.61 0.01 -1.26 -4.45 113.70 109.66 1y8b s SER 385 Ca 0.00 -1.61 -0.08 0.00 1.31 0.00 0.00 55.95 55.57 1y8b s SER 385 Cb 0.00 0.63 -0.03 0.00 0.21 0.00 0.00 66.02 66.83 1y8b s SER 385 CO 0.00 -1.22 0.08 -0.69 0.41 0.00 0.00 173.24 171.82 1y8b s VAL 386 N -3.15 4.40 -0.65 3.43 1.01 -1.26 -4.97 120.40 119.21 1y8b s VAL 386 Ca 0.35 -0.14 -0.23 0.00 0.00 0.00 0.00 61.98 61.95 1y8b s VAL 386 Cb 0.01 -3.06 0.06 0.00 0.00 0.00 0.00 36.38 33.39 1y8b s VAL 386 CO 0.24 0.34 0.99 -0.72 0.00 0.00 0.00 175.10 175.95 1y8b s TYR 387 N 1.56 2.65 -0.37 5.22 -0.85 -1.26 -2.55 117.35 121.75 1y8b s TYR 387 Ca 0.06 -0.40 -0.04 0.00 -0.52 0.00 0.00 57.07 56.17 1y8b s TYR 387 Cb -0.15 -4.29 0.08 0.00 0.38 0.00 0.00 41.96 37.98 1y8b s TYR 387 CO 0.04 -1.64 0.14 0.42 -1.52 0.00 0.00 175.55 172.99 1y8b s ILE 388 N 4.23 3.45 -0.29 -3.49 -1.09 -1.16 -1.71 121.20 121.12 1y8b s ILE 388 Ca 0.25 -1.61 -0.01 0.00 -2.23 0.00 0.00 60.65 57.04 1y8b s ILE 388 Cb -0.15 -3.15 0.05 0.00 -1.58 0.00 0.00 42.46 37.63 1y8b s ILE 388 CO 0.12 -0.42 -0.02 -0.69 -1.23 0.00 0.00 174.94 172.71 1y8b s VAL 389 N 1.26 2.89 -0.18 2.92 1.01 -0.14 -3.91 120.40 124.25 1y8b s VAL 389 Ca 0.02 -1.41 -0.07 0.00 0.00 0.00 0.00 61.98 60.52 1y8b s VAL 389 Cb -0.21 -2.66 0.08 0.00 0.00 0.00 0.00 36.38 33.58 1y8b s VAL 389 CO -0.01 -0.09 0.38 -1.59 0.00 0.00 0.00 175.10 173.78 1y8b s LYS 390 N 1.23 0.28 0.00 2.72 -2.85 -1.26 -1.72 119.74 118.15 1y8b s LYS 390 Ca -0.06 0.93 0.00 0.00 -1.00 0.00 0.00 55.97 55.84 1y8b s LYS 390 Cb -0.20 0.20 0.00 0.00 -2.06 0.00 0.00 37.83 35.77 1y8b s LYS 390 CO -0.02 -0.25 0.00 -2.30 0.10 0.00 0.00 175.35 172.89 1y8b n PRO 391 N 5.24 0.00 -0.69 1.78 -0.02 -1.25 -4.69 135.00 135.37 1y8b n PRO 391 Ca -0.10 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.38 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 -1.55 -0.52 0.00 -1.26 -4.70 118.16 110.14 1y8b n LYS 392 Ca 0.00 0.45 -0.48 0.00 0.00 0.00 0.00 58.31 58.28 1y8b n LYS 392 Cb 0.00 -0.24 -0.05 0.00 0.00 0.00 0.00 35.03 34.74 1y8b n LYS 392 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.40 177.28 1y8b n MET 393 N 0.28 1.55 0.00 1.64 0.00 -1.26 -4.63 117.12 114.70 1y8b n MET 393 Ca 0.00 0.47 0.00 0.00 -0.00 0.00 0.00 57.70 58.17 1y8b n MET 393 Cb 0.00 -2.70 0.00 0.00 0.00 0.00 0.00 33.22 30.52 1y8b n MET 393 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 175.97 176.69 1y8b n HIS 394 N 9.50 0.00 0.00 1.12 -0.00 -1.26 -5.04 115.22 119.54 1y8b n HIS 394 Ca 0.34 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 58.06 1y8b n HIS 394 Cb 0.30 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.29 1y8b n HIS 394 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1y8b n GLY 395 N 3.78 4.02 0.38 -1.41 0.00 -1.26 -4.55 105.19 106.14 1y8b n GLY 395 Ca 0.00 -1.19 -0.03 0.00 0.00 0.00 0.00 46.02 44.80 1y8b n GLY 395 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1y8b h PRO 396 N 0.00 -0.04 0.00 1.61 0.11 -1.96 0.48 132.00 132.20 1y8b h PRO 396 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1y8b h PRO 396 Cb 0.00 0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.12 1y8b h PRO 396 CO 0.00 -0.03 -0.28 1.04 -0.21 0.00 0.00 178.00 178.52 1y8b n GLN 397 N -5.44 0.28 0.05 1.05 3.00 -1.26 -3.56 117.38 111.50 1y8b n GLN 397 Ca 0.08 0.16 -0.08 0.00 -0.01 0.00 0.00 57.00 57.14 1y8b n GLN 397 Cb 0.38 -1.76 0.06 0.00 0.00 0.00 0.00 30.24 28.92 1y8b n GLN 397 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.06 178.55 1y8b h GLU 398 N 0.00 0.40 -0.27 -1.09 4.57 -0.39 -3.00 114.58 114.80 1y8b h GLU 398 Ca 0.00 -0.29 -0.06 0.00 -1.18 0.00 0.00 59.36 57.83 1y8b h GLU 398 Cb 0.75 0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 29.37 1y8b h GLU 398 CO 0.00 0.91 -0.10 0.28 -1.18 0.00 0.00 179.01 178.92 1y8b h VAL 399 N 0.29 1.21 -0.70 0.32 2.07 -1.01 -0.50 116.25 117.93 1y8b h VAL 399 Ca -0.01 -0.92 -0.03 0.00 0.82 0.00 0.00 66.70 66.56 1y8b h VAL 399 Cb 1.19 1.12 -0.03 0.00 -1.52 0.00 0.00 31.29 32.05 1y8b h VAL 399 CO 0.11 0.30 0.32 0.00 0.02 0.00 0.00 177.57 178.32 1y8b h ALA 400 N 1.49 1.26 0.00 1.67 0.00 -1.66 0.75 119.26 122.76 1y8b h ALA 400 Ca 0.08 -0.15 -0.18 0.00 0.00 0.00 0.00 54.91 54.66 1y8b h ALA 400 Cb 0.43 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1y8b h ALA 400 CO 0.02 0.57 -0.93 0.35 0.00 0.00 0.00 179.25 179.26 1y8b h PHE 401 N 0.99 0.00 0.00 0.00 3.57 -1.45 -3.17 116.94 116.88 1y8b h PHE 401 Ca 0.24 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.72 1y8b h PHE 401 Cb 0.12 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 38.86 1y8b h PHE 401 CO 0.01 0.82 -0.16 0.00 -2.23 0.00 0.00 178.31 176.74 1y8b h ALA 402 N 1.18 0.02 -1.06 2.41 0.00 -0.56 -2.45 119.26 118.81 1y8b h ALA 402 Ca -0.04 -0.28 0.29 0.00 0.00 0.00 0.00 54.91 54.88 1y8b h ALA 402 Cb 1.66 0.13 -0.07 0.00 0.00 0.00 0.00 17.79 19.51 1y8b h ALA 402 CO 0.10 0.13 0.72 -0.91 0.00 0.00 0.00 179.25 179.29 1y8b h ASN 403 N -1.00 0.23 0.54 0.00 4.21 0.34 1.78 115.58 121.68 1y8b h ASN 403 Ca -0.02 0.04 -0.28 0.00 1.21 0.00 0.00 56.30 57.25 1y8b h ASN 403 Cb 0.41 0.01 0.01 0.00 -1.12 0.00 0.00 38.32 37.62 1y8b h ASN 403 CO -0.01 0.05 -1.26 0.11 -1.29 0.00 0.00 177.43 175.02 1y8b h LYS 404 N 0.21 0.34 0.00 0.81 6.56 -1.65 -2.73 116.57 120.10 1y8b h LYS 404 Ca 0.56 -0.55 -0.12 0.00 -1.06 0.00 0.00 60.65 59.48 1y8b h LYS 404 Cb 1.78 0.20 -0.02 0.00 -0.57 0.00 0.00 32.23 33.62 1y8b h LYS 404 CO -0.15 1.25 -0.64 1.25 -2.06 0.00 0.00 179.45 179.10 1y8b h LEU 405 N 0.10 0.00 -0.27 2.94 5.85 0.25 -3.11 115.31 121.08 1y8b h LEU 405 Ca -0.15 0.00 -0.20 0.00 0.84 0.00 0.00 57.88 58.37 1y8b h LEU 405 Cb 1.98 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 43.00 1y8b h LEU 405 CO 0.21 0.54 -0.88 -0.26 -0.34 0.00 0.00 178.44 177.71 1y8b h PHE 406 N 0.00 0.39 0.00 1.25 0.04 0.24 -3.06 116.94 115.80 1y8b h PHE 406 Ca -0.02 -0.21 -0.04 0.00 2.80 0.00 0.00 57.97 60.50 1y8b h PHE 406 Cb 1.43 -0.04 -0.01 0.00 2.20 0.00 0.00 35.95 39.53 1y8b h PHE 406 CO 0.00 1.02 -0.17 1.79 -0.60 0.00 0.00 178.31 180.35 1y8b h THR 407 N 0.15 0.35 -0.11 -1.55 1.35 -1.52 -1.79 112.91 109.79 1y8b h THR 407 Ca -0.05 -1.14 -0.11 0.00 -0.55 0.00 0.00 66.41 64.55 1y8b h THR 407 Cb 1.50 1.87 0.00 0.00 -1.73 0.00 0.00 68.15 69.80 1y8b h THR 407 CO 0.14 0.17 -0.37 0.03 -0.25 0.00 0.00 175.52 175.23 1y8b h ARG 408 N 0.00 0.45 -0.00 4.72 3.08 -1.46 0.46 114.38 121.62 1y8b h ARG 408 Ca -0.00 -0.33 -0.16 0.00 0.07 0.00 0.00 59.98 59.55 1y8b h ARG 408 Cb 0.86 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.95 1y8b h ARG 408 CO 0.02 0.96 -0.76 0.97 -1.07 0.00 0.00 179.97 180.09 1y8b h ILE 409 N 0.03 1.54 0.07 2.04 -0.00 -1.52 -2.28 117.51 117.39 1y8b h ILE 409 Ca -0.01 -2.60 -0.11 0.00 -0.00 0.00 0.00 64.86 62.14 1y8b h ILE 409 Cb 1.00 2.40 0.01 0.00 -0.00 0.00 0.00 36.82 40.23 1y8b h ILE 409 CO 0.08 0.74 -0.48 -0.33 -0.00 0.00 0.00 178.15 178.16 1y8b h GLU 410 N 0.01 0.15 0.00 2.19 4.39 -1.31 0.65 114.58 120.65 1y8b h GLU 410 Ca -0.01 -0.25 -0.01 0.00 0.34 0.00 0.00 59.36 59.43 1y8b h GLU 410 Cb 1.35 0.09 -0.00 0.00 -0.10 0.00 0.00 28.75 30.09 1y8b h GLU 410 CO 0.10 1.12 -0.02 1.15 -1.16 0.00 0.00 179.01 180.20 1y8b h THR 411 N -0.68 0.42 0.00 1.13 2.02 -0.14 0.19 112.91 115.85 1y8b h THR 411 Ca -0.09 -0.12 -0.06 0.00 0.77 0.00 0.00 66.41 66.91 1y8b h THR 411 Cb 1.34 1.08 -0.01 0.00 -1.74 0.00 0.00 68.15 68.82 1y8b h THR 411 CO 0.06 0.02 -0.48 -0.03 0.37 0.00 0.00 175.52 175.46 1y8b h MET 412 N 0.00 0.00 -0.99 6.66 1.85 -1.42 -1.08 114.93 119.96 1y8b h MET 412 Ca -0.00 0.00 -0.08 0.00 -0.61 0.00 0.00 59.70 59.01 1y8b h MET 412 Cb 0.08 0.00 -0.05 0.00 0.43 0.00 0.00 31.60 32.06 1y8b h MET 412 CO 0.00 0.46 0.11 -0.11 -0.40 0.00 0.00 176.91 176.97 1y8b n LEU 413 N -4.61 3.49 0.00 3.39 7.94 0.22 -4.41 117.00 123.02 1y8b n LEU 413 Ca -0.13 -1.78 0.00 0.00 -1.11 0.00 0.00 56.01 52.99 1y8b n LEU 413 Cb 0.35 -0.56 0.00 0.00 0.53 0.00 0.00 43.42 43.75 1y8b n LEU 413 CO 0.15 0.57 0.00 0.61 -1.11 0.00 0.00 177.39 177.61 1y8b n GLY 414 N 0.20 -0.14 0.46 -3.96 0.00 0.48 -4.78 105.19 97.45 1y8b n GLY 414 Ca 0.10 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1y8b n GLY 414 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1y8b n MET 415 N -2.09 0.00 -2.64 1.61 1.56 -0.07 -4.59 117.12 110.90 1y8b n MET 415 Ca 0.00 0.00 -0.00 0.00 -0.27 0.00 0.00 57.70 57.43 1y8b n MET 415 Cb 0.00 -0.95 0.00 0.00 2.15 0.00 0.00 33.22 34.42 1y8b n MET 415 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1y8b n ALA 416 N -0.62 -2.22 -1.00 -5.12 0.00 -1.25 -4.91 120.51 105.38 1y8b n ALA 416 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1y8b n ALA 416 Cb 0.19 -1.17 0.00 0.00 0.00 0.00 0.00 19.45 18.47 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 -1.59 2.88 -0.59 0.00 -0.02 -1.26 -4.64 135.00 129.78 1y8b n PRO 417 Ca -0.00 0.00 -0.10 0.00 -2.02 0.00 0.00 63.50 61.38 1y8b n PRO 417 Cb 0.50 0.00 0.05 0.00 -0.02 0.00 0.00 33.50 34.03 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 0.00 4.42 -1.71 2.55 4.05 -1.26 -4.84 115.26 118.47 1y8b n ASN 418 Ca 0.00 -2.71 -0.00 0.00 0.45 0.00 0.00 54.58 52.32 1y8b n ASN 418 Cb 0.00 -0.80 0.00 0.00 1.23 0.00 0.00 39.78 40.21 1y8b n ASN 418 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 177.26 174.62 1y8b n THR 419 N 0.18 -3.73 -1.82 -0.44 -1.04 -1.26 -4.67 114.28 101.50 1y8b n THR 419 Ca 0.22 0.31 -0.42 0.00 -2.04 0.00 0.00 64.05 62.13 1y8b n THR 419 Cb 0.78 -4.51 -0.02 0.00 -1.82 0.00 0.00 70.33 64.76 1y8b n THR 419 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1y8b s LEU 420 N -0.34 4.36 0.57 -4.42 1.02 -1.26 -4.65 118.68 113.96 1y8b s LEU 420 Ca 0.00 2.85 -0.07 0.00 0.02 0.00 0.00 54.13 56.93 1y8b s LEU 420 Cb -0.00 -3.62 -0.01 0.00 0.02 0.00 0.00 46.19 42.57 1y8b s LEU 420 CO 0.14 -0.88 0.91 -1.59 0.02 0.00 0.00 176.35 174.94 1y8b s LYS 421 N 0.01 3.23 -0.24 1.70 -2.85 -1.06 -4.41 119.74 116.13 1y8b s LYS 421 Ca 0.66 0.25 -0.13 0.00 -1.00 0.00 0.00 55.97 55.75 1y8b s LYS 421 Cb -0.47 -2.24 0.07 0.00 -2.06 0.00 0.00 37.83 33.14 1y8b s LYS 421 CO 0.42 -0.56 0.58 -1.64 0.10 0.00 0.00 175.35 174.25 1y8b s MET 422 N -4.99 0.58 -0.65 1.78 -1.94 -1.21 -2.99 119.30 109.87 1y8b s MET 422 Ca 0.52 1.07 -0.23 0.00 -1.71 0.00 0.00 55.69 55.34 1y8b s MET 422 Cb -0.11 0.11 0.06 0.00 2.01 0.00 0.00 34.83 36.90 1y8b s MET 422 CO 0.47 -0.16 1.00 0.20 -0.01 0.00 0.00 175.02 176.53 1y8b s GLY 423 N 1.62 1.32 -0.32 -0.03 0.00 -0.90 -0.26 107.32 108.75 1y8b s GLY 423 Ca -0.09 -1.66 -0.28 0.00 0.00 0.00 0.00 44.72 42.69 1y8b s GLY 423 CO -0.17 2.13 1.97 -0.42 0.00 0.00 0.00 173.10 176.61 1y8b s ILE 424 N 4.25 3.29 -0.48 0.90 -1.09 -1.26 -4.38 121.20 122.44 1y8b s ILE 424 Ca 0.25 0.29 0.04 0.00 -2.23 0.00 0.00 60.65 59.00 1y8b s ILE 424 Cb -0.15 -3.43 0.12 0.00 -1.58 0.00 0.00 42.46 37.43 1y8b s ILE 424 CO 0.13 -0.29 0.21 -0.04 -1.23 0.00 0.00 174.94 173.72 1y8b s MET 425 N 6.11 1.87 0.12 2.79 -1.94 -1.26 -4.92 119.30 122.08 1y8b s MET 425 Ca 0.87 -2.46 -0.35 0.00 -1.71 0.00 0.00 55.69 52.04 1y8b s MET 425 Cb -0.25 -3.30 -0.16 0.00 2.01 0.00 0.00 34.83 33.13 1y8b s MET 425 CO 0.33 -1.07 1.28 -3.47 -0.01 0.00 0.00 175.02 172.07 1y8b n ASP 426 N 3.37 1.57 0.00 3.03 -0.08 -1.26 -4.23 116.55 118.95 1y8b n ASP 426 Ca 0.05 1.13 0.04 0.00 -1.51 0.00 0.00 54.79 54.49 1y8b n ASP 426 Cb 0.34 -1.21 -0.12 0.00 2.34 0.00 0.00 41.12 42.48 1y8b n ASP 426 CO 0.00 0.00 0.00 1.21 0.12 0.00 0.00 177.20 178.53 1y8b n GLU 427 N 2.24 0.65 -0.29 -0.67 2.13 -1.26 -4.27 120.64 119.16 1y8b n GLU 427 Ca 0.17 0.01 0.12 0.00 0.66 0.00 0.00 57.16 58.11 1y8b n GLU 427 Cb 0.22 -1.65 0.27 0.00 0.27 0.00 0.00 31.44 30.55 1y8b n GLU 427 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 1y8b h GLU 428 N 0.00 0.30 0.00 5.31 4.22 -1.94 -3.44 114.58 119.02 1y8b h GLU 428 Ca -0.16 -0.02 0.00 0.00 0.08 0.00 0.00 59.36 59.26 1y8b h GLU 428 Cb 1.42 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.60 1y8b h GLU 428 CO 0.02 0.20 0.00 0.54 -2.18 0.00 0.00 179.01 177.59 1y8b n ARG 429 N -5.13 0.00 0.02 1.92 1.74 -1.26 -4.96 116.66 108.99 1y8b n ARG 429 Ca 0.20 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.28 1y8b n ARG 429 Cb 0.62 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.06 1y8b n ARG 429 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 1y8b n ARG 430 N 0.00 0.00 -1.68 5.56 3.00 -1.26 -4.53 116.66 117.75 1y8b n ARG 430 Ca 0.00 0.00 -0.52 0.00 -0.00 0.00 0.00 57.85 57.33 1y8b n ARG 430 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 32.46 32.40 1y8b n ARG 430 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.63 177.88 1y8b n THR 431 N -2.35 0.34 -0.81 5.15 -2.24 -1.26 -4.61 114.28 108.49 1y8b n THR 431 Ca 0.00 -0.06 -0.42 0.00 -2.27 0.00 0.00 64.05 61.30 1y8b n THR 431 Cb 0.00 -1.44 -0.10 0.00 -2.10 0.00 0.00 70.33 66.69 1y8b n THR 431 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1y8b n SER 432 N 5.27 1.55 0.08 3.42 7.64 -1.09 -4.57 113.62 125.91 1y8b n SER 432 Ca 0.23 -2.56 -0.09 0.00 1.01 0.00 0.00 58.87 57.46 1y8b n SER 432 Cb 0.21 -0.80 -0.06 0.00 -1.01 0.00 0.00 64.21 62.56 1y8b n SER 432 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 1y8b h LEU 433 N 16.97 -0.25 -3.76 -3.43 7.12 -1.91 -3.25 115.31 126.81 1y8b h LEU 433 Ca 0.29 -0.22 -0.43 0.00 0.13 0.00 0.00 57.88 57.66 1y8b h LEU 433 Cb 0.72 0.06 -0.18 0.00 -0.53 0.00 0.00 40.66 40.73 1y8b h LEU 433 CO 1.94 0.28 0.52 0.59 -0.13 0.00 0.00 178.44 181.64 1y8b n ASN 434 N -4.97 6.75 -0.28 1.25 4.13 -1.26 -4.67 115.26 116.21 1y8b n ASN 434 Ca -0.07 -3.25 0.02 0.00 1.68 0.00 0.00 54.58 52.97 1y8b n ASN 434 Cb 0.23 -1.07 0.10 0.00 -1.54 0.00 0.00 39.78 37.50 1y8b n ASN 434 CO 0.00 0.00 0.00 0.25 0.28 0.00 0.00 177.26 177.79 1y8b h LEU 435 N 2.61 -0.76 -1.75 3.41 6.46 -1.91 0.99 115.31 124.36 1y8b h LEU 435 Ca 0.38 0.24 0.38 0.00 -0.12 0.00 0.00 57.88 58.76 1y8b h LEU 435 Cb 0.84 0.50 -0.08 0.00 -0.73 0.00 0.00 40.66 41.20 1y8b h LEU 435 CO 0.96 -0.27 0.90 0.08 -0.62 0.00 0.00 178.44 179.49 1y8b h ARG 436 N -0.00 0.10 0.15 1.25 0.11 -1.91 0.19 114.38 114.27 1y8b h ARG 436 Ca 0.39 -0.01 -0.27 0.00 0.10 0.00 0.00 59.98 60.19 1y8b h ARG 436 Cb 0.59 -0.02 0.01 0.00 1.11 0.00 0.00 29.97 31.66 1y8b h ARG 436 CO -0.83 0.07 -1.32 0.66 0.10 0.00 0.00 179.97 178.65 1y8b h SER 437 N 0.10 0.49 -0.06 0.08 4.64 0.67 -2.12 113.55 117.35 1y8b h SER 437 Ca 0.67 -0.90 0.04 0.00 -0.47 0.00 0.00 61.79 61.13 1y8b h SER 437 Cb 2.38 -0.16 -0.06 0.00 -0.31 0.00 0.00 62.40 64.25 1y8b h SER 437 CO -0.14 1.60 -0.35 0.00 -0.87 0.00 0.00 176.83 177.06 1y8b h ILE 439 N -0.47 1.41 0.00 0.00 6.09 -1.55 -3.29 117.51 119.71 1y8b h ILE 439 Ca 0.07 -3.02 0.00 0.00 -1.37 0.00 0.00 64.86 60.55 1y8b h ILE 439 Cb 0.58 2.88 0.00 0.00 0.47 0.00 0.00 36.82 40.76 1y8b h ILE 439 CO -0.32 0.87 0.46 0.00 -3.07 0.00 0.00 178.15 176.09 1y8b n ALA 440 N -2.55 0.15 0.38 0.18 0.00 -0.80 -0.50 120.51 117.37 1y8b n ALA 440 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.34 1y8b n ALA 440 Cb 1.02 -0.15 0.00 0.00 0.00 0.00 0.00 19.45 20.32 1y8b n ALA 440 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1y8b n GLN 441 N -1.18 0.38 0.00 0.00 3.00 -1.24 -4.04 117.38 114.30 1y8b n GLN 441 Ca -0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1y8b n GLN 441 Cb 0.46 -1.25 0.00 0.00 0.00 0.00 0.00 30.24 29.45 1y8b n GLN 441 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1y8b n ALA 442 N 0.56 0.77 -0.32 -1.58 0.00 0.35 -3.29 120.51 116.99 1y8b n ALA 442 Ca 0.00 0.00 0.17 0.00 0.00 0.00 0.00 53.44 53.61 1y8b n ALA 442 Cb 0.14 -0.53 0.37 0.00 0.00 0.00 0.00 19.45 19.43 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 0.04 0.29 0.00 0.00 2.47 -1.85 -3.30 114.38 112.03 1y8b h ARG 443 Ca 0.00 -0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.70 1y8b h ARG 443 Cb 0.00 -0.07 0.00 0.00 -1.65 0.00 0.00 29.97 28.25 1y8b h ARG 443 CO 0.00 0.19 0.00 -1.71 0.56 0.00 0.00 179.97 179.01 1y8b n ASN 444 N -5.12 0.00 -1.68 7.04 5.15 -1.21 -4.91 115.26 114.54 1y8b n ASN 444 Ca 0.26 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.24 1y8b n ASN 444 Cb 0.79 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 40.04 1y8b n ASN 444 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1y8b n ARG 445 N 0.00 0.31 -3.78 1.20 1.74 -1.26 -4.60 116.66 110.27 1y8b n ARG 445 Ca 0.00 0.00 -0.36 0.00 -0.77 0.00 0.00 57.85 56.72 1y8b n ARG 445 Cb 0.00 -1.34 -0.12 0.00 -1.02 0.00 0.00 32.46 29.98 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 1.24 3.37 -0.37 1.55 0.11 -1.26 -3.36 120.40 121.68 1y8b s VAL 446 Ca 0.00 -1.82 0.04 0.00 -2.93 0.00 0.00 61.98 57.27 1y8b s VAL 446 Cb 0.00 -3.20 0.10 0.00 -1.53 0.00 0.00 36.38 31.76 1y8b s VAL 446 CO 0.00 -0.54 0.08 0.00 -3.33 0.00 0.00 175.10 171.31 1y8b s ALA 447 N 1.21 2.92 -0.20 1.54 0.00 0.64 -4.74 121.76 123.12 1y8b s ALA 447 Ca 0.05 -2.62 -0.09 0.00 0.00 0.00 0.00 51.96 49.29 1y8b s ALA 447 Cb -0.22 -1.99 0.08 0.00 0.00 0.00 0.00 23.12 20.99 1y8b s ALA 447 CO -0.03 -1.74 0.46 0.12 0.00 0.00 0.00 175.76 174.58 1y8b s PHE 448 N 0.74 -0.79 -0.05 0.00 5.36 -1.18 -2.11 117.98 119.95 1y8b s PHE 448 Ca 0.12 1.55 -0.02 0.00 -0.96 0.00 0.00 56.93 57.62 1y8b s PHE 448 Cb -0.20 0.36 0.04 0.00 -0.34 0.00 0.00 43.02 42.88 1y8b s PHE 448 CO -0.07 -0.44 0.11 0.42 -1.46 0.00 0.00 175.22 173.77 1y8b s ILE 449 N 1.99 -0.10 -0.03 3.12 -1.09 -1.26 -4.84 121.20 118.99 1y8b s ILE 449 Ca -0.06 0.25 -0.31 0.00 -2.23 0.00 0.00 60.65 58.30 1y8b s ILE 449 Cb -0.10 -0.19 0.12 0.00 -1.58 0.00 0.00 42.46 40.71 1y8b s ILE 449 CO -0.14 0.10 1.29 0.20 -1.23 0.00 0.00 174.94 175.16 1y8b s ASN 450 N 1.45 -0.06 0.00 3.58 0.01 -1.21 -4.48 114.94 114.24 1y8b s ASN 450 Ca -0.05 -0.12 0.00 0.00 -0.71 0.00 0.00 52.86 51.97 1y8b s ASN 450 Cb -0.12 0.16 0.00 0.00 0.41 0.00 0.00 41.25 41.69 1y8b s ASN 450 CO -0.05 -0.29 0.00 1.07 -1.51 0.00 0.00 177.10 176.33 1y8b n THR 451 N -0.46 0.00 -0.01 1.60 5.66 -1.26 -4.66 114.28 115.15 1y8b n THR 451 Ca -0.08 -0.01 0.00 0.00 -3.05 0.00 0.00 64.05 60.91 1y8b n THR 451 Cb 0.62 0.28 0.00 0.00 -1.55 0.00 0.00 70.33 69.69 1y8b n THR 451 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1y8b n GLY 452 N 1.11 1.42 3.32 1.09 0.00 -1.26 -2.68 105.19 108.18 1y8b n GLY 452 Ca 0.00 -0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.57 1y8b n GLY 452 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1y8b s PHE 453 N -2.00 4.12 -0.12 1.61 5.36 -1.26 -4.79 117.98 120.90 1y8b s PHE 453 Ca 0.00 -2.56 -0.32 0.00 -0.96 0.00 0.00 56.93 53.09 1y8b s PHE 453 Cb 0.00 -3.78 0.13 0.00 -0.34 0.00 0.00 43.02 39.03 1y8b s PHE 453 CO 0.00 -0.94 1.07 -1.17 -1.46 0.00 0.00 175.22 172.72 1y8b s LEU 454 N -0.93 -0.24 0.64 6.12 2.96 -1.26 -1.95 118.68 124.02 1y8b s LEU 454 Ca 0.27 0.05 0.12 0.00 -0.22 0.00 0.00 54.13 54.35 1y8b s LEU 454 Cb -0.10 1.66 0.50 0.00 0.50 0.00 0.00 46.19 48.75 1y8b s LEU 454 CO -0.08 -0.38 1.22 -0.78 -1.32 0.00 0.00 176.35 175.01 1y8b h ASP 455 N 2.07 0.00 0.00 3.68 1.82 -1.94 0.19 116.42 122.24 1y8b h ASP 455 Ca -0.15 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.49 1y8b h ASP 455 Cb 1.19 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.20 1y8b h ASP 455 CO 0.27 0.00 0.57 0.03 -1.61 0.00 0.00 179.24 178.50 1y8b h ARG 456 N 0.00 0.00 -0.02 0.28 3.08 -1.93 -0.62 114.38 115.18 1y8b h ARG 456 Ca 0.15 0.00 0.01 0.00 0.07 0.00 0.00 59.98 60.20 1y8b h ARG 456 Cb 2.08 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 32.13 1y8b h ARG 456 CO -0.00 0.00 0.69 1.79 -1.07 0.00 0.00 179.97 181.38 1y8b h THR 457 N 0.00 0.00 -0.42 2.04 1.35 -0.92 0.16 112.91 115.12 1y8b h THR 457 Ca 0.00 0.00 0.06 0.00 -0.55 0.00 0.00 66.41 65.92 1y8b h THR 457 Cb 1.15 0.32 -0.05 0.00 -1.73 0.00 0.00 68.15 67.83 1y8b h THR 457 CO 0.00 0.00 0.12 1.23 -0.25 0.00 0.00 175.52 176.62 1y8b h GLY 458 N 0.00 0.53 0.20 5.82 0.00 -1.39 0.22 103.07 108.45 1y8b h GLY 458 Ca 0.01 -0.06 0.21 0.00 0.00 0.00 0.00 47.33 47.49 1y8b h GLY 458 CO -0.00 -0.00 0.62 -0.55 0.00 0.00 0.00 176.54 176.60 1y8b h ASP 459 N 0.27 0.52 1.19 0.19 5.19 -0.94 0.77 116.42 123.61 1y8b h ASP 459 Ca 0.20 0.06 -0.08 0.00 -0.62 0.00 0.00 57.03 56.59 1y8b h ASP 459 Cb 0.21 -0.03 -0.01 0.00 0.18 0.00 0.00 39.33 39.68 1y8b h ASP 459 CO -0.23 0.19 -0.38 -0.08 -3.12 0.00 0.00 179.24 175.62 1y8b h GLU 460 N 0.51 0.00 0.00 3.56 4.81 -1.13 -2.95 114.58 119.38 1y8b h GLU 460 Ca 0.52 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.75 1y8b h GLU 460 Cb 1.14 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.52 1y8b h GLU 460 CO -0.25 0.38 -0.28 0.52 -0.73 0.00 0.00 179.01 178.65 1y8b h MET 461 N 0.00 0.00 0.00 1.92 2.86 0.15 -3.23 114.93 116.63 1y8b h MET 461 Ca -0.00 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.62 1y8b h MET 461 Cb 1.08 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.73 1y8b h MET 461 CO 0.05 0.00 -0.08 1.25 1.06 0.00 0.00 176.91 179.19 1y8b h HIS 462 N 0.00 0.00 0.13 -0.22 -0.00 -0.60 2.69 115.15 117.14 1y8b h HIS 462 Ca 0.00 0.00 -0.25 0.00 -0.00 0.00 0.00 60.37 60.12 1y8b h HIS 462 Cb 0.96 0.00 0.01 0.00 -0.00 0.00 0.00 27.41 28.37 1y8b h HIS 462 CO 0.00 0.08 -1.21 0.66 -0.00 0.00 0.00 177.93 177.46 1y8b h SER 463 N 0.00 0.42 -0.38 3.26 4.64 -1.68 -3.35 113.55 116.46 1y8b h SER 463 Ca -0.00 -0.88 0.00 0.00 -0.47 0.00 0.00 61.79 60.44 1y8b h SER 463 Cb 0.38 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 1y8b h SER 463 CO 0.01 1.55 0.00 1.33 -0.87 0.00 0.00 176.83 178.85 1y8b n VAL 464 N -3.99 0.62 -0.65 0.95 0.24 -1.12 -4.56 118.33 109.82 1y8b n VAL 464 Ca -0.21 -0.81 0.50 0.00 -2.04 0.00 0.00 64.34 61.78 1y8b n VAL 464 Cb 0.88 0.84 0.80 0.00 -1.47 0.00 0.00 33.84 34.88 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 3.54 0.00 0.00 7.34 4.05 0.46 1.75 114.93 132.07 1y8b h MET 465 Ca 0.00 -0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 1y8b h MET 465 Cb 0.85 -0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.65 1y8b h MET 465 CO 0.00 0.00 0.17 -1.91 0.23 0.00 0.00 176.91 175.40 1y8b n GLU 466 N -4.09 0.09 0.02 0.39 0.00 -1.26 -2.50 120.64 113.28 1y8b n GLU 466 Ca 0.43 0.56 -0.01 0.00 0.00 0.00 0.00 57.16 58.14 1y8b n GLU 466 Cb 1.90 -1.97 -0.00 0.00 0.00 0.00 0.00 31.44 31.37 1y8b n GLU 466 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1y8b h ALA 467 N 1.51 -0.55 -2.71 4.31 0.00 0.23 -3.48 119.26 118.58 1y8b h ALA 467 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1y8b h ALA 467 Cb 0.34 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1y8b h ALA 467 CO 0.00 -0.54 0.00 0.41 0.00 0.00 0.00 179.25 179.12 1y8b n GLY 468 N 0.36 1.63 3.69 0.00 0.00 -1.04 -4.93 105.19 104.91 1y8b n GLY 468 Ca -0.01 -0.71 -0.42 0.00 0.00 0.00 0.00 46.02 44.88 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 0.43 4.42 1.06 1.61 0.04 -1.26 -4.84 135.00 136.45 1y8b s PRO 469 Ca 0.00 1.26 -0.12 0.00 0.04 0.00 0.00 61.00 62.18 1y8b s PRO 469 Cb 0.00 -3.53 0.23 0.00 0.04 0.00 0.00 34.50 31.24 1y8b s PRO 469 CO 0.00 -0.24 1.07 0.00 0.04 0.00 0.00 177.00 177.87 1y8b s MET 470 N 1.77 -0.10 0.00 4.56 0.23 -1.26 -1.60 119.30 122.89 1y8b s MET 470 Ca 0.46 1.00 0.00 0.00 -1.03 0.00 0.00 55.69 56.12 1y8b s MET 470 Cb -0.18 -1.64 0.00 0.00 -1.53 0.00 0.00 34.83 31.48 1y8b s MET 470 CO 0.18 -3.22 0.00 -0.11 -2.03 0.00 0.00 175.02 169.84 1y8b n LEU 471 N -4.59 0.00 -0.60 0.18 0.00 -1.13 -4.60 117.00 106.26 1y8b n LEU 471 Ca 0.06 0.00 0.06 0.00 0.00 0.00 0.00 56.01 56.13 1y8b n LEU 471 Cb 0.54 0.00 0.12 0.00 0.00 0.00 0.00 43.42 44.08 1y8b n LEU 471 CO 0.55 0.00 0.56 -2.11 0.00 0.00 0.00 177.39 176.39 1y8b n ARG 472 N 0.00 2.05 0.22 1.96 -4.01 -1.26 -4.37 116.66 111.24 1y8b n ARG 472 Ca 0.00 -1.76 -0.17 0.00 -1.04 0.00 0.00 57.85 54.88 1y8b n ARG 472 Cb 0.00 -1.26 -0.10 0.00 -3.04 0.00 0.00 32.46 28.06 1y8b n ARG 472 CO 0.00 0.00 0.00 -0.22 -3.04 0.00 0.00 177.63 174.37 1y8b h LYS 473 N 2.21 -0.87 0.51 2.89 1.63 -1.96 0.26 116.57 121.25 1y8b h LYS 473 Ca 0.00 0.06 -0.03 0.00 -0.85 0.00 0.00 60.65 59.83 1y8b h LYS 473 Cb 0.65 0.20 0.01 0.00 -0.60 0.00 0.00 32.23 32.48 1y8b h LYS 473 CO 0.00 -0.58 -0.25 -0.91 -3.45 0.00 0.00 179.45 174.27 1y8b h ASN 474 N -0.90 -0.58 -1.11 4.20 -0.26 -2.03 -3.03 115.58 111.87 1y8b h ASN 474 Ca -0.04 -0.06 0.35 0.00 -0.56 0.00 0.00 56.30 55.99 1y8b h ASN 474 Cb 0.83 0.15 -0.13 0.00 -1.06 0.00 0.00 38.32 38.11 1y8b h ASN 474 CO -0.16 -0.20 0.68 1.56 -1.06 0.00 0.00 177.43 178.24 1y8b h GLN 475 N -1.03 0.25 0.00 0.81 4.20 -1.82 1.85 115.11 119.38 1y8b h GLN 475 Ca -0.07 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.62 1y8b h GLN 475 Cb 0.61 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.33 1y8b h GLN 475 CO 0.12 0.17 0.12 0.52 -0.67 0.00 0.00 178.83 179.08 1y8b h MET 476 N 0.26 0.00 0.61 1.46 2.86 -0.34 -2.49 114.93 117.29 1y8b h MET 476 Ca 0.73 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 58.34 1y8b h MET 476 Cb 1.93 0.00 0.01 0.00 0.06 0.00 0.00 31.60 33.59 1y8b h MET 476 CO -0.48 0.00 -0.30 0.87 1.06 0.00 0.00 176.91 178.06 1y8b h LYS 477 N 0.00 -0.80 -0.80 1.72 1.57 0.28 -3.45 116.57 115.09 1y8b h LYS 477 Ca 0.00 0.05 0.08 0.00 -1.87 0.00 0.00 60.65 58.91 1y8b h LYS 477 Cb 0.23 0.18 -0.20 0.00 0.08 0.00 0.00 32.23 32.52 1y8b h LYS 477 CO 0.00 -0.50 -0.28 -1.12 -0.57 0.00 0.00 179.45 176.97 1y8b s SER 478 N -4.61 -1.31 -0.15 0.86 0.01 -0.94 -5.14 113.70 102.41 1y8b s SER 478 Ca -0.13 0.15 -0.11 0.00 1.31 0.00 0.00 55.95 57.17 1y8b s SER 478 Cb 0.01 1.83 0.05 0.00 0.21 0.00 0.00 66.02 68.12 1y8b s SER 478 CO 0.41 -0.24 0.39 -0.89 0.41 0.00 0.00 173.24 173.32 1y8b s THR 479 N 2.86 -0.02 0.05 1.44 2.01 -1.21 -4.95 115.64 115.82 1y8b s THR 479 Ca 0.15 0.06 -0.27 0.00 0.31 0.00 0.00 61.69 61.93 1y8b s THR 479 Cb -0.08 -0.56 -0.17 0.00 0.01 0.00 0.00 72.50 71.70 1y8b s THR 479 CO -0.25 0.02 1.51 1.55 -0.69 0.00 0.00 174.62 176.76 1y8b h PRO 480 N 6.49 -0.45 -1.03 4.92 0.13 -1.97 0.80 132.00 140.89 1y8b h PRO 480 Ca -0.33 0.03 0.26 0.00 -0.87 0.00 0.00 66.00 65.09 1y8b h PRO 480 Cb 1.18 0.10 -0.09 0.00 0.13 0.00 0.00 31.00 32.32 1y8b h PRO 480 CO 0.29 -0.22 0.66 -1.49 -0.23 0.00 0.00 178.00 177.01 1y8b h TRP 481 N -0.60 0.64 0.09 1.56 4.06 -1.97 0.02 115.95 119.74 1y8b h TRP 481 Ca -0.05 0.02 -0.32 0.00 2.06 0.00 0.00 58.89 60.60 1y8b h TRP 481 Cb 0.44 -0.19 -0.02 0.00 -1.00 0.00 0.00 29.16 28.39 1y8b h TRP 481 CO -0.02 0.07 -1.73 0.97 -3.56 0.00 0.00 178.44 174.17 1y8b h ILE 482 N 0.40 0.89 -0.66 1.49 -0.00 -1.86 -3.26 117.51 114.52 1y8b h ILE 482 Ca 0.58 -2.62 0.19 0.00 -0.00 0.00 0.00 64.86 63.01 1y8b h ILE 482 Cb 1.47 2.58 -0.03 0.00 -0.00 0.00 0.00 36.82 40.84 1y8b h ILE 482 CO -0.28 0.75 0.57 0.50 -0.00 0.00 0.00 178.15 179.69 1y8b h LYS 483 N 0.05 0.00 0.00 2.19 1.63 0.26 0.25 116.57 120.95 1y8b h LYS 483 Ca -0.31 0.00 -0.04 0.00 -0.85 0.00 0.00 60.65 59.45 1y8b h LYS 483 Cb 2.02 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 33.64 1y8b h LYS 483 CO 0.11 0.00 -0.37 0.00 -3.45 0.00 0.00 179.45 175.74 1y8b h ALA 484 N 1.48 0.04 0.18 5.00 0.00 -1.53 -3.19 119.26 121.25 1y8b h ALA 484 Ca 0.31 -0.45 0.01 0.00 0.00 0.00 0.00 54.91 54.78 1y8b h ALA 484 Cb 1.45 0.29 -0.02 0.00 0.00 0.00 0.00 17.79 19.50 1y8b h ALA 484 CO -0.00 0.28 -0.24 -0.92 0.00 0.00 0.00 179.25 178.37 1y8b h TYR 485 N -1.00 -0.63 -0.89 0.00 3.20 -1.45 2.14 116.97 118.34 1y8b h TYR 485 Ca -0.06 0.01 0.19 0.00 3.14 0.00 0.00 58.73 62.01 1y8b h TYR 485 Cb 0.55 0.25 -0.11 0.00 1.54 0.00 0.00 36.73 38.97 1y8b h TYR 485 CO -0.01 -0.34 0.45 1.49 -1.64 0.00 0.00 178.16 178.11 1y8b h GLU 486 N -0.47 0.53 0.20 1.82 4.22 -0.71 -1.47 114.58 118.70 1y8b h GLU 486 Ca 0.01 -0.03 -0.31 0.00 0.08 0.00 0.00 59.36 59.11 1y8b h GLU 486 Cb 0.46 -0.12 0.02 0.00 0.50 0.00 0.00 28.75 29.62 1y8b h GLU 486 CO -0.09 0.35 -1.45 -0.09 -2.18 0.00 0.00 179.01 175.54 1y8b h ARG 487 N 0.54 0.43 0.00 1.92 2.43 -1.35 -3.24 114.38 115.11 1y8b h ARG 487 Ca 0.52 -0.73 0.00 0.00 -0.81 0.00 0.00 59.98 58.97 1y8b h ARG 487 Cb 0.88 0.27 0.00 0.00 -0.42 0.00 0.00 29.97 30.70 1y8b h ARG 487 CO -0.44 1.35 0.28 -0.97 -1.51 0.00 0.00 179.97 178.68 1y8b h ASN 488 N -0.00 0.00 -0.47 -3.80 -0.00 0.44 -2.33 115.58 109.42 1y8b h ASN 488 Ca -0.27 0.00 0.09 0.00 -0.00 0.00 0.00 56.30 56.12 1y8b h ASN 488 Cb 2.02 0.00 -0.10 0.00 -0.00 0.00 0.00 38.32 40.24 1y8b h ASN 488 CO 0.20 0.00 -0.23 -0.55 -0.00 0.00 0.00 177.43 176.86 1y8b h ASN 489 N 0.00 -0.78 1.17 1.15 -0.00 -1.33 0.38 115.58 116.18 1y8b h ASN 489 Ca 0.00 0.18 -0.17 0.00 -0.00 0.00 0.00 56.30 56.31 1y8b h ASN 489 Cb 0.56 0.42 -0.02 0.00 -0.00 0.00 0.00 38.32 39.27 1y8b h ASN 489 CO 0.00 -0.25 -0.84 0.58 -0.00 0.00 0.00 177.43 176.92 1y8b h VAL 490 N -0.13 1.22 0.50 6.14 2.07 -1.67 0.27 116.25 124.66 1y8b h VAL 490 Ca 0.22 -2.77 -0.02 0.00 0.82 0.00 0.00 66.70 64.94 1y8b h VAL 490 Cb 0.47 2.59 0.00 0.00 -1.52 0.00 0.00 31.29 32.83 1y8b h VAL 490 CO -0.55 0.70 -0.24 0.25 0.02 0.00 0.00 177.57 177.75 1y8b h LEU 491 N 0.00 -0.57 -0.34 2.57 7.12 -1.23 -2.34 115.31 120.52 1y8b h LEU 491 Ca -0.03 0.02 -0.13 0.00 0.13 0.00 0.00 57.88 57.86 1y8b h LEU 491 Cb 1.60 0.15 -0.02 0.00 -0.53 0.00 0.00 40.66 41.86 1y8b h LEU 491 CO 0.09 -0.18 -0.64 -1.28 -0.13 0.00 0.00 178.44 176.30 1y8b h SER 492 N -1.12 0.00 0.56 1.25 0.87 -0.45 -3.30 113.55 111.36 1y8b h SER 492 Ca -0.07 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.46 1y8b h SER 492 Cb 0.52 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.48 1y8b h SER 492 CO 0.11 0.64 -0.27 1.23 -0.53 0.00 0.00 176.83 178.02 1y8b h GLY 493 N 2.74 -0.78 -0.26 5.77 0.00 -0.93 -2.11 103.07 107.50 1y8b h GLY 493 Ca -0.01 0.29 0.32 0.00 0.00 0.00 0.00 47.33 47.93 1y8b h GLY 493 CO 0.08 -0.29 0.79 1.41 0.00 0.00 0.00 176.54 178.53 1y8b h LEU 494 N -0.86 0.11 -1.41 3.11 3.38 -1.50 1.21 115.31 119.35 1y8b h LEU 494 Ca -0.08 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1y8b h LEU 494 Cb 0.62 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.37 1y8b h LEU 494 CO 0.13 0.02 0.47 0.15 0.09 0.00 0.00 178.44 179.30 1y8b h PHE 495 N 0.09 0.00 0.00 1.13 3.04 -1.45 2.47 116.94 122.22 1y8b h PHE 495 Ca 0.56 0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.51 1y8b h PHE 495 Cb 2.03 0.00 0.00 0.00 2.56 0.00 0.00 35.95 40.54 1y8b h PHE 495 CO -0.00 0.00 -1.46 0.00 -2.02 0.00 0.00 178.31 174.83 1y8b n GLY 497 N 1.37 1.67 0.32 0.00 0.00 0.83 -4.46 105.19 104.92 1y8b n GLY 497 Ca 0.00 -0.07 0.06 0.00 0.00 0.00 0.00 46.02 46.01 1y8b n GLY 497 CO 0.00 0.00 0.00 0.17 0.00 0.00 0.00 173.32 173.49 1y8b h LEU 498 N 0.37 0.00 0.05 0.99 -0.00 -1.70 -2.49 115.31 112.54 1y8b h LEU 498 Ca 0.01 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 57.88 1y8b h LEU 498 Cb 0.67 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.33 1y8b h LEU 498 CO 0.04 0.00 -0.03 0.08 -0.00 0.00 0.00 178.44 178.54 1y8b h ARG 499 N 0.00 -0.07 0.00 0.17 0.11 -1.92 -3.46 114.38 109.21 1y8b h ARG 499 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1y8b h ARG 499 Cb 1.45 0.02 0.00 0.00 1.11 0.00 0.00 29.97 32.55 1y8b h ARG 499 CO 0.00 -0.05 0.00 0.41 0.10 0.00 0.00 179.97 180.43 1y8b n GLY 500 N 1.42 -2.18 3.20 0.08 0.00 -0.94 -5.11 105.19 101.66 1y8b n GLY 500 Ca -0.01 0.70 -0.31 0.00 0.00 0.00 0.00 46.02 46.40 1y8b n GLY 500 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1y8b s LYS 501 N -0.68 2.92 0.31 1.61 1.02 -1.26 -5.00 119.74 118.66 1y8b s LYS 501 Ca 0.00 -0.83 -0.18 0.00 0.02 0.00 0.00 55.97 54.97 1y8b s LYS 501 Cb 0.00 -2.22 0.03 0.00 -0.52 0.00 0.00 37.83 35.12 1y8b s LYS 501 CO 0.00 0.16 0.72 0.00 -0.92 0.00 0.00 175.35 175.31 1y8b s ALA 502 N 0.39 -0.97 -0.19 5.17 0.00 -1.26 -4.38 121.76 120.52 1y8b s ALA 502 Ca -0.18 -0.51 -0.19 0.00 0.00 0.00 0.00 51.96 51.08 1y8b s ALA 502 Cb -0.18 0.82 -0.03 0.00 0.00 0.00 0.00 23.12 23.73 1y8b s ALA 502 CO 0.08 -1.01 0.53 1.14 0.00 0.00 0.00 175.76 176.51 1y8b s GLN 503 N -3.41 4.21 -0.41 0.00 -2.07 -1.26 -4.92 119.66 111.79 1y8b s GLN 503 Ca 0.13 0.45 -0.07 0.00 -1.82 0.00 0.00 55.36 54.05 1y8b s GLN 503 Cb -0.05 -3.55 0.09 0.00 -1.09 0.00 0.00 33.01 28.40 1y8b s GLN 503 CO 0.09 -0.13 0.23 0.42 -1.32 0.00 0.00 175.29 174.58 1y8b s ILE 504 N 1.56 3.93 0.00 3.63 1.09 -1.26 -3.30 121.20 126.85 1y8b s ILE 504 Ca 0.25 -1.57 0.00 0.00 -1.10 0.00 0.00 60.65 58.23 1y8b s ILE 504 Cb -0.15 -3.47 0.00 0.00 -1.06 0.00 0.00 42.46 37.78 1y8b s ILE 504 CO 0.10 -0.54 0.00 0.61 -0.10 0.00 0.00 174.94 175.01 1y8b n GLY 505 N 4.82 -0.14 0.00 6.18 0.00 -1.26 -4.54 105.19 110.25 1y8b n GLY 505 Ca -0.08 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 44.95 1y8b n GLY 505 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1y8b n LYS 506 N -0.60 0.00 0.00 1.61 4.01 -0.82 -4.74 118.16 117.61 1y8b n LYS 506 Ca 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.80 1y8b n LYS 506 Cb 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 34.52 1y8b n LYS 506 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1y8b n GLY 507 N 1.02 3.05 2.69 0.72 0.00 -1.12 -4.39 105.19 107.16 1y8b n GLY 507 Ca 0.00 -0.08 -0.05 0.00 0.00 0.00 0.00 46.02 45.89 1y8b n GLY 507 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1y8b n MET 508 N 0.00 0.47 -1.66 1.61 1.56 -1.26 -4.07 117.12 113.77 1y8b n MET 508 Ca 0.00 -1.15 -0.43 0.00 -0.27 0.00 0.00 57.70 55.85 1y8b n MET 508 Cb 0.00 -0.43 -0.03 0.00 2.15 0.00 0.00 33.22 34.91 1y8b n MET 508 CO 0.00 0.00 0.00 -2.67 -0.73 0.00 0.00 175.97 172.57 1y8b n TRP 509 N 0.35 2.48 -3.05 1.12 2.14 -1.26 -4.89 117.44 114.33 1y8b n TRP 509 Ca -0.03 -0.32 -0.01 0.00 2.07 0.00 0.00 57.50 59.21 1y8b n TRP 509 Cb 0.74 -2.78 -0.00 0.00 -0.81 0.00 0.00 31.31 28.45 1y8b n TRP 509 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1y8b s ALA 510 N 4.47 -2.23 0.18 -1.67 0.00 -1.26 -5.13 121.76 116.11 1y8b s ALA 510 Ca 0.90 -0.05 0.09 0.00 0.00 0.00 0.00 51.96 52.90 1y8b s ALA 510 Cb -0.48 -2.72 -0.04 0.00 0.00 0.00 0.00 23.12 19.89 1y8b s ALA 510 CO 0.44 -2.23 -0.12 -1.64 0.00 0.00 0.00 175.76 172.22 1y8b s MET 511 N 1.47 1.99 0.06 0.00 -1.94 -1.26 -5.07 119.30 114.55 1y8b s MET 511 Ca 0.21 -1.29 -0.37 0.00 -1.71 0.00 0.00 55.69 52.53 1y8b s MET 511 Cb -0.03 -2.12 -0.21 0.00 2.01 0.00 0.00 34.83 34.48 1y8b s MET 511 CO -0.06 0.43 1.57 -1.00 -0.01 0.00 0.00 175.02 175.96 1y8b h PRO 512 N 3.00 -1.26 0.00 2.03 0.13 -2.03 -3.47 132.00 130.40 1y8b h PRO 512 Ca -0.47 0.09 0.00 0.00 -0.87 0.00 0.00 66.00 64.75 1y8b h PRO 512 Cb 1.20 0.29 0.00 0.00 0.13 0.00 0.00 31.00 32.62 1y8b h PRO 512 CO 0.53 -0.84 0.00 -0.25 -0.23 0.00 0.00 178.00 177.21 1y8b n ASP 513 N -5.65 0.00 -4.53 1.44 9.92 -1.26 -5.09 116.55 111.38 1y8b n ASP 513 Ca -0.16 0.00 -0.50 0.00 -0.53 0.00 0.00 54.79 53.59 1y8b n ASP 513 Cb 0.52 0.00 -0.04 0.00 -0.64 0.00 0.00 41.12 40.96 1y8b n ASP 513 CO 0.00 0.00 0.00 -0.11 0.13 0.00 0.00 177.20 177.22 1y8b n LEU 514 N -0.40 0.70 -0.01 0.64 0.00 -1.26 -4.87 117.00 111.80 1y8b n LEU 514 Ca 0.00 1.15 0.10 0.00 0.00 0.00 0.00 56.01 57.25 1y8b n LEU 514 Cb 0.00 -1.11 -0.15 0.00 0.00 0.00 0.00 43.42 42.15 1y8b n LEU 514 CO 0.00 -1.76 -0.73 1.15 0.00 0.00 0.00 177.39 176.05 1y8b n MET 515 N 1.48 0.59 -0.03 1.96 0.00 -1.26 -4.31 117.12 115.56 1y8b n MET 515 Ca 0.16 -0.18 0.24 0.00 0.00 0.00 0.00 57.70 57.92 1y8b n MET 515 Cb 0.22 -1.47 0.63 0.00 0.00 0.00 0.00 33.22 32.61 1y8b n MET 515 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1y8b h ALA 516 N 1.80 2.44 0.00 3.17 0.00 -1.88 1.80 119.26 126.59 1y8b h ALA 516 Ca 0.00 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.73 1y8b h ALA 516 Cb 0.90 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 1y8b h ALA 516 CO 0.00 -1.08 -0.94 -0.44 0.00 0.00 0.00 179.25 176.78 1y8b h ASP 517 N 0.00 0.00 -0.74 0.00 3.32 -1.92 -3.32 116.42 113.75 1y8b h ASP 517 Ca 0.31 0.00 0.17 0.00 0.02 0.00 0.00 57.03 57.53 1y8b h ASP 517 Cb 1.80 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 41.22 1y8b h ASP 517 CO -0.00 0.68 0.01 -0.03 -1.72 0.00 0.00 179.24 178.18 1y8b h MET 518 N 0.00 0.11 0.00 3.56 4.05 0.26 1.54 114.93 124.44 1y8b h MET 518 Ca -0.07 -0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.35 1y8b h MET 518 Cb 1.58 -0.02 0.00 0.00 -0.80 0.00 0.00 31.60 32.35 1y8b h MET 518 CO 0.08 0.07 0.59 -0.92 0.23 0.00 0.00 176.91 176.96 1y8b h TYR 519 N 0.11 0.00 0.00 1.39 5.03 -1.66 2.22 116.97 124.07 1y8b h TYR 519 Ca 0.41 0.00 -0.22 0.00 2.58 0.00 0.00 58.73 61.49 1y8b h TYR 519 Cb 0.71 0.00 -0.04 0.00 1.55 0.00 0.00 36.73 38.95 1y8b h TYR 519 CO -0.41 0.00 -1.57 0.45 -1.32 0.00 0.00 178.16 175.31 1y8b n SER 520 N -2.30 0.84 -0.04 -2.11 2.88 0.53 -1.98 113.62 111.44 1y8b n SER 520 Ca -0.01 0.38 -0.18 0.00 -1.33 0.00 0.00 58.87 57.73 1y8b n SER 520 Cb 0.61 0.09 -0.13 0.00 -0.75 0.00 0.00 64.21 64.03 1y8b n SER 520 CO 0.00 0.00 0.00 -0.61 -1.23 0.00 0.00 175.04 173.20 1y8b h GLN 521 N 0.00 0.10 0.00 -1.46 5.75 0.37 -3.11 115.11 116.76 1y8b h GLN 521 Ca -0.22 -0.17 -0.03 0.00 -0.15 0.00 0.00 58.65 58.07 1y8b h GLN 521 Cb 1.78 0.06 -0.00 0.00 1.07 0.00 0.00 27.48 30.39 1y8b h GLN 521 CO 0.06 1.08 -0.16 1.57 -2.65 0.00 0.00 178.83 178.74 1y8b h LYS 522 N -0.75 0.00 -0.26 1.69 2.10 -1.27 -2.20 116.57 115.88 1y8b h LYS 522 Ca -0.17 0.00 -0.10 0.00 -2.00 0.00 0.00 60.65 58.38 1y8b h LYS 522 Cb 1.33 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.66 1y8b h LYS 522 CO -0.01 0.16 -0.25 0.78 -2.00 0.00 0.00 179.45 178.13 1y8b h GLY 523 N 3.76 0.68 2.00 0.07 0.00 -1.52 -2.54 103.07 105.52 1y8b h GLY 523 Ca -0.00 -0.69 -0.16 0.00 0.00 0.00 0.00 47.33 46.48 1y8b h GLY 523 CO 0.02 0.62 -0.77 1.29 0.00 0.00 0.00 176.54 177.71 1y8b h ASP 524 N 0.34 0.00 0.36 0.19 3.04 -1.57 -2.97 116.42 115.82 1y8b h ASP 524 Ca 0.04 0.00 -0.03 0.00 -3.24 0.00 0.00 57.03 53.80 1y8b h ASP 524 Cb 0.81 0.00 -0.00 0.00 -1.04 0.00 0.00 39.33 39.09 1y8b h ASP 524 CO 0.06 0.77 -0.15 -0.61 -2.04 0.00 0.00 179.24 177.27 1y8b h GLN 525 N 0.00 0.00 0.17 4.15 4.15 -1.31 -2.32 115.11 119.95 1y8b h GLN 525 Ca -0.01 0.00 -0.23 0.00 0.77 0.00 0.00 58.65 59.18 1y8b h GLN 525 Cb 1.56 0.00 0.03 0.00 0.21 0.00 0.00 27.48 29.28 1y8b h GLN 525 CO 0.10 0.15 -1.01 1.25 -1.93 0.00 0.00 178.83 177.39 1y8b h LEU 526 N 0.00 0.59 -1.48 -2.39 7.12 -1.36 -3.19 115.31 114.60 1y8b h LEU 526 Ca -0.00 -0.94 0.26 0.00 0.13 0.00 0.00 57.88 57.32 1y8b h LEU 526 Cb 0.37 -0.19 -0.04 0.00 -0.53 0.00 0.00 40.66 40.27 1y8b h LEU 526 CO 0.02 1.49 0.95 0.03 -0.13 0.00 0.00 178.44 180.79 1y8b h ARG 527 N -0.21 0.00 -0.01 1.25 2.47 -1.26 0.82 114.38 117.44 1y8b h ARG 527 Ca -0.18 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.54 1y8b h ARG 527 Cb 1.80 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 30.12 1y8b h ARG 527 CO 0.19 0.00 0.00 0.00 0.56 0.00 0.00 179.97 180.72 1y8b n ALA 528 N -2.34 1.90 -1.01 0.04 0.00 -1.19 -4.71 120.51 113.20 1y8b n ALA 528 Ca 0.19 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.63 1y8b n ALA 528 Cb 1.23 -1.00 -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 -0.08 0.44 3.84 0.00 0.00 0.28 -4.78 105.19 104.89 1y8b n GLY 529 Ca 0.00 -0.65 -0.29 0.00 0.00 0.00 0.00 46.02 45.08 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 -2.00 2.19 0.00 4.61 0.00 -0.88 -4.81 121.76 120.87 1y8b s ALA 530 Ca 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 51.96 51.38 1y8b s ALA 530 Cb 0.00 -3.00 0.00 0.00 0.00 0.00 0.00 23.12 20.12 1y8b s ALA 530 CO 0.00 -1.99 0.00 -1.71 0.00 0.00 0.00 175.76 172.06 1y8b n ASN 531 N -3.55 0.00 -4.30 0.00 5.15 -1.26 -4.85 115.26 106.46 1y8b n ASN 531 Ca 0.07 0.00 -0.16 0.00 -0.60 0.00 0.00 54.58 53.89 1y8b n ASN 531 Cb 0.60 0.00 -0.10 0.00 -0.53 0.00 0.00 39.78 39.75 1y8b n ASN 531 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 1y8b s THR 532 N 0.28 0.53 0.23 -0.44 -4.23 -1.26 -5.00 115.64 105.76 1y8b s THR 532 Ca 0.00 -2.00 0.05 0.00 -1.18 0.00 0.00 61.69 58.56 1y8b s THR 532 Cb 0.00 -2.63 -0.05 0.00 1.34 0.00 0.00 72.50 71.16 1y8b s THR 532 CO 0.00 0.00 -0.05 0.00 -0.54 0.00 0.00 174.62 174.03 1y8b s ALA 533 N -3.76 1.96 0.36 3.99 0.00 -1.26 -4.25 121.76 118.80 1y8b s ALA 533 Ca 0.38 -1.77 -0.24 0.00 0.00 0.00 0.00 51.96 50.33 1y8b s ALA 533 Cb 0.08 0.28 -0.10 0.00 0.00 0.00 0.00 23.12 23.37 1y8b s ALA 533 CO 0.14 -0.14 0.95 -1.58 0.00 0.00 0.00 175.76 175.13 1y8b s TRP 534 N -3.23 3.54 -0.17 0.00 0.51 -1.26 -3.36 118.94 114.97 1y8b s TRP 534 Ca 0.27 1.72 -0.14 0.00 -2.12 0.00 0.00 56.10 55.83 1y8b s TRP 534 Cb 0.04 -2.91 0.05 0.00 -0.81 0.00 0.00 33.47 29.84 1y8b s TRP 534 CO 0.09 0.06 0.44 0.14 -0.51 0.00 0.00 176.95 177.17 1y8b s VAL 535 N -1.80 -0.01 -0.44 4.03 -7.23 -0.67 -4.91 120.40 109.37 1y8b s VAL 535 Ca 0.54 0.03 0.00 0.00 -1.81 0.00 0.00 61.98 60.74 1y8b s VAL 535 Cb -0.16 -0.63 0.00 0.00 0.56 0.00 0.00 36.38 36.15 1y8b s VAL 535 CO 0.20 0.01 0.77 -0.81 -0.31 0.00 0.00 175.10 174.97 1y8b n PRO 536 N 3.29 0.99 -3.52 4.82 -0.04 -1.26 -1.66 135.00 137.61 1y8b n PRO 536 Ca -0.16 0.00 -0.18 0.00 -0.04 0.00 0.00 63.50 63.12 1y8b n PRO 536 Cb 0.56 -1.22 -0.06 0.00 -0.04 0.00 0.00 33.50 32.74 1y8b n PRO 536 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1y8b s SER 537 N 0.55 -0.66 0.05 3.54 0.01 -1.26 -4.86 113.70 111.07 1y8b s SER 537 Ca 0.00 0.73 -0.18 0.00 1.31 0.00 0.00 55.95 57.81 1y8b s SER 537 Cb 0.00 0.55 -0.16 0.00 0.21 0.00 0.00 66.02 66.62 1y8b s SER 537 CO 0.00 -0.61 1.26 1.55 0.41 0.00 0.00 173.24 175.86 1y8b h PRO 538 N 3.02 0.52 -1.13 12.44 0.13 -1.89 -2.81 132.00 142.29 1y8b h PRO 538 Ca -0.27 -0.39 0.33 0.00 -0.87 0.00 0.00 66.00 64.81 1y8b h PRO 538 Cb 1.14 0.07 -0.11 0.00 0.13 0.00 0.00 31.00 32.22 1y8b h PRO 538 CO 0.39 1.01 0.71 1.79 -0.23 0.00 0.00 178.00 181.67 1y8b h THR 539 N 0.13 0.35 0.02 1.56 1.35 -1.95 0.11 112.91 114.49 1y8b h THR 539 Ca -0.02 -0.10 -0.07 0.00 -0.55 0.00 0.00 66.41 65.68 1y8b h THR 539 Cb 1.05 0.05 -0.00 0.00 -1.73 0.00 0.00 68.15 67.52 1y8b h THR 539 CO 0.09 0.05 -0.32 0.00 -0.25 0.00 0.00 175.52 175.09 1y8b h ALA 540 N 1.65 0.03 -0.13 6.62 0.00 -1.96 -2.99 119.26 122.48 1y8b h ALA 540 Ca 0.69 -0.64 0.04 0.00 0.00 0.00 0.00 54.91 55.01 1y8b h ALA 540 Cb 1.89 0.12 -0.07 0.00 0.00 0.00 0.00 17.79 19.74 1y8b h ALA 540 CO -0.39 0.17 -0.40 0.00 0.00 0.00 0.00 179.25 178.63 1y8b h ALA 541 N -0.05 -0.54 -0.85 0.00 0.00 -0.76 0.09 119.26 117.16 1y8b h ALA 541 Ca -0.07 -0.00 0.06 0.00 0.00 0.00 0.00 54.91 54.89 1y8b h ALA 541 Cb 1.16 0.74 -0.05 0.00 0.00 0.00 0.00 17.79 19.64 1y8b h ALA 541 CO -0.00 -0.89 0.55 0.00 0.00 0.00 0.00 179.25 178.91 1y8b h THR 542 N -0.47 1.08 0.00 0.00 1.03 -1.03 0.11 112.91 113.64 1y8b h THR 542 Ca 0.08 -0.34 -0.00 0.00 -0.01 0.00 0.00 66.41 66.14 1y8b h THR 542 Cb 0.61 0.02 -0.00 0.00 -1.07 0.00 0.00 68.15 67.71 1y8b h THR 542 CO -0.39 0.18 -0.02 -0.07 -0.01 0.00 0.00 175.52 175.21 1y8b h LEU 543 N 0.98 0.00 0.00 0.00 3.38 -0.92 -2.21 115.31 116.53 1y8b h LEU 543 Ca 0.36 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 58.07 1y8b h LEU 543 Cb 0.16 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.87 1y8b h LEU 543 CO -0.12 0.02 -1.37 -0.74 0.09 0.00 0.00 178.44 176.32 1y8b h HIS 544 N 0.00 0.00 -0.04 1.13 2.76 0.10 -3.21 115.15 115.90 1y8b h HIS 544 Ca -0.00 -0.00 -0.04 0.00 -2.20 0.00 0.00 60.37 58.13 1y8b h HIS 544 Cb 0.35 -0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.31 1y8b h HIS 544 CO 0.00 1.00 -0.11 0.00 -1.30 0.00 0.00 177.93 177.52 1y8b h ALA 545 N 1.00 0.07 -0.87 5.26 0.00 -0.80 -3.18 119.26 120.74 1y8b h ALA 545 Ca -0.16 -0.35 0.05 0.00 0.00 0.00 0.00 54.91 54.46 1y8b h ALA 545 Cb 1.90 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 19.63 1y8b h ALA 545 CO 0.10 -0.04 0.57 -0.07 0.00 0.00 0.00 179.25 179.81 1y8b h LEU 546 N -0.40 0.88 -0.98 0.00 3.38 -1.59 -2.07 115.31 114.53 1y8b h LEU 546 Ca -0.00 0.00 0.32 0.00 0.09 0.00 0.00 57.88 58.29 1y8b h LEU 546 Cb 0.73 -0.19 -0.16 0.00 0.09 0.00 0.00 40.66 41.13 1y8b h LEU 546 CO 0.02 0.58 0.45 0.45 0.09 0.00 0.00 178.44 180.04 1y8b h HIS 547 N 1.01 0.71 -0.18 1.13 3.86 -1.54 1.08 115.15 121.22 1y8b h HIS 547 Ca 0.36 0.04 0.05 0.00 -1.16 0.00 0.00 60.37 59.67 1y8b h HIS 547 Cb 0.15 -0.15 -0.01 0.00 1.06 0.00 0.00 27.41 28.46 1y8b h HIS 547 CO -0.00 -0.27 0.70 1.88 0.86 0.00 0.00 177.93 181.10 1y8b h TYR 548 N 0.21 0.00 0.00 2.45 0.05 -1.49 1.25 116.97 119.44 1y8b h TYR 548 Ca 0.71 0.00 -0.05 0.00 0.05 0.00 0.00 58.73 59.44 1y8b h TYR 548 Cb 1.65 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 39.38 1y8b h TYR 548 CO -0.10 0.00 -0.24 1.12 -1.05 0.00 0.00 178.16 177.89 1y8b h HIS 549 N 0.00 0.00 0.00 4.88 2.07 0.10 -3.24 115.15 118.97 1y8b h HIS 549 Ca 0.09 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.61 1y8b h HIS 549 Cb 1.49 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.47 1y8b h HIS 549 CO 0.00 0.24 -0.85 0.37 -3.07 0.00 0.00 177.93 174.62 1y8b h GLN 550 N 0.00 0.00 -1.91 5.12 5.75 0.15 -3.43 115.11 120.79 1y8b h GLN 550 Ca -0.00 0.00 0.08 0.00 -0.15 0.00 0.00 58.65 58.57 1y8b h GLN 550 Cb 1.18 0.00 -0.20 0.00 1.07 0.00 0.00 27.48 29.52 1y8b h GLN 550 CO 0.03 0.00 -0.15 0.99 -2.65 0.00 0.00 178.83 177.05 1y8b s THR 551 N -3.28 -0.99 -0.16 2.39 2.01 -1.11 -5.12 115.64 109.38 1y8b s THR 551 Ca 0.02 0.00 -0.28 0.00 0.31 0.00 0.00 61.69 61.74 1y8b s THR 551 Cb 0.11 -0.99 -0.01 0.00 0.01 0.00 0.00 72.50 71.62 1y8b s THR 551 CO 0.76 0.00 0.97 0.20 -0.69 0.00 0.00 174.62 175.87 1y8b s ASN 552 N 2.89 7.13 -0.02 3.53 -0.87 -1.26 -4.56 114.94 121.78 1y8b s ASN 552 Ca -0.03 1.40 -0.20 0.00 -1.57 0.00 0.00 52.86 52.46 1y8b s ASN 552 Cb -0.12 -2.52 -0.31 0.00 -0.02 0.00 0.00 41.25 38.27 1y8b s ASN 552 CO -0.19 -0.50 0.96 -0.37 -2.57 0.00 0.00 177.10 174.43 1y8b h VAL 553 N 5.22 1.44 -1.10 1.60 -1.51 -1.88 -2.67 116.25 117.35 1y8b h VAL 553 Ca -0.27 -2.50 0.30 0.00 -1.23 0.00 0.00 66.70 62.99 1y8b h VAL 553 Cb 1.12 3.06 -0.08 0.00 -2.13 0.00 0.00 31.29 33.25 1y8b h VAL 553 CO 0.88 0.72 0.73 -0.61 -1.23 0.00 0.00 177.57 178.07 1y8b h GLN 554 N -0.19 0.24 0.00 5.19 5.75 -1.92 0.61 115.11 124.80 1y8b h GLN 554 Ca -0.16 -0.01 -0.06 0.00 -0.15 0.00 0.00 58.65 58.27 1y8b h GLN 554 Cb 1.72 -0.06 -0.01 0.00 1.07 0.00 0.00 27.48 30.21 1y8b h GLN 554 CO 0.18 0.16 -0.34 1.03 -2.65 0.00 0.00 178.83 177.21 1y8b h SER 555 N 0.25 0.00 -0.21 -0.69 0.87 -1.98 -1.93 113.55 109.87 1y8b h SER 555 Ca 0.60 -0.78 0.04 0.00 -1.23 0.00 0.00 61.79 60.42 1y8b h SER 555 Cb 1.80 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 63.72 1y8b h SER 555 CO -0.22 1.09 -0.01 0.58 -0.53 0.00 0.00 176.83 177.74 1y8b h VAL 556 N -1.00 0.84 -0.39 2.23 2.07 -0.87 -2.25 116.25 116.88 1y8b h VAL 556 Ca -0.09 -0.02 -0.13 0.00 0.82 0.00 0.00 66.70 67.28 1y8b h VAL 556 Cb 1.00 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 31.54 1y8b h VAL 556 CO -0.06 0.01 -0.27 0.06 0.02 0.00 0.00 177.57 177.33 1y8b h GLN 557 N 0.05 0.82 -0.98 1.57 3.07 0.02 -2.64 115.11 117.02 1y8b h GLN 557 Ca 0.10 -0.36 0.28 0.00 0.09 0.00 0.00 58.65 58.76 1y8b h GLN 557 Cb 0.13 -0.02 -0.04 0.00 0.08 0.00 0.00 27.48 27.63 1y8b h GLN 557 CO -0.18 0.99 0.71 0.00 0.09 0.00 0.00 178.83 180.44 1y8b h ALA 558 N 0.99 2.92 0.37 0.06 0.00 -0.75 1.56 119.26 124.41 1y8b h ALA 558 Ca 0.08 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1y8b h ALA 558 Cb 0.81 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1y8b h ALA 558 CO 0.07 -1.20 -0.18 -0.91 0.00 0.00 0.00 179.25 177.03 1y8b h ASN 559 N 0.01 -0.42 1.28 0.00 2.35 -1.19 -2.36 115.58 115.25 1y8b h ASN 559 Ca 0.47 -0.12 -0.06 0.00 -0.55 0.00 0.00 56.30 56.03 1y8b h ASN 559 Cb 1.87 0.11 -0.01 0.00 0.05 0.00 0.00 38.32 40.34 1y8b h ASN 559 CO -0.01 0.02 -0.29 0.16 -1.65 0.00 0.00 177.43 175.66 1y8b h ILE 560 N -1.00 0.57 -0.22 2.81 -0.00 -1.32 -3.10 117.51 115.26 1y8b h ILE 560 Ca -0.05 -1.48 -0.11 0.00 -0.00 0.00 0.00 64.86 63.22 1y8b h ILE 560 Cb 0.52 2.03 -0.01 0.00 -0.00 0.00 0.00 36.82 39.35 1y8b h ILE 560 CO 0.08 0.28 -0.35 0.00 -0.00 0.00 0.00 178.15 178.16 1y8b h ALA 561 N 1.71 1.00 -0.55 0.16 0.00 0.21 -2.78 119.26 119.02 1y8b h ALA 561 Ca -0.00 -0.40 -0.36 0.00 0.00 0.00 0.00 54.91 54.15 1y8b h ALA 561 Cb 1.00 -0.11 -0.16 0.00 0.00 0.00 0.00 17.79 18.52 1y8b h ALA 561 CO 0.04 0.60 0.46 0.94 0.00 0.00 0.00 179.25 181.29 1y8b n GLN 562 N -4.06 1.89 -3.61 0.00 -0.06 -0.89 -4.90 117.38 105.75 1y8b n GLN 562 Ca -0.01 -1.78 -0.23 0.00 -2.00 0.00 0.00 57.00 52.97 1y8b n GLN 562 Cb 0.47 -1.70 0.00 0.00 -4.06 0.00 0.00 30.24 24.96 1y8b n GLN 562 CO 0.00 0.00 0.00 0.99 -0.20 0.00 0.00 177.06 177.85 1y8b s THR 563 N -2.51 1.99 -0.37 1.69 2.01 -1.05 -5.03 115.64 112.38 1y8b s THR 563 Ca 0.35 -1.34 -0.29 0.00 0.31 0.00 0.00 61.69 60.72 1y8b s THR 563 Cb 0.28 -2.33 0.02 0.00 0.01 0.00 0.00 72.50 70.48 1y8b s THR 563 CO 0.01 0.00 1.09 -1.61 -0.69 0.00 0.00 174.62 173.41 1y8b s GLU 564 N -4.34 3.96 -0.13 4.92 2.02 -1.26 -4.91 118.70 118.97 1y8b s GLU 564 Ca 0.44 0.92 -0.29 0.00 0.02 0.00 0.00 54.97 56.06 1y8b s GLU 564 Cb -0.03 -3.79 -0.25 0.00 0.10 0.00 0.00 34.13 30.16 1y8b s GLU 564 CO 0.27 -1.04 0.82 0.74 0.02 0.00 0.00 175.26 176.07 1y8b h PHE 565 N 8.42 -0.00 -0.54 1.61 -1.00 -1.95 -2.89 116.94 120.59 1y8b h PHE 565 Ca -0.21 -0.00 0.07 0.00 2.81 0.00 0.00 57.97 60.64 1y8b h PHE 565 Cb 1.06 0.00 -0.10 0.00 3.61 0.00 0.00 35.95 40.52 1y8b h PHE 565 CO 0.87 0.94 -0.51 -0.97 -1.61 0.00 0.00 178.31 177.04 1y8b h ASN 566 N -0.94 -1.73 -0.73 2.17 -0.00 -1.98 3.57 115.58 115.94 1y8b h ASN 566 Ca -0.00 0.25 -0.01 0.00 -0.00 0.00 0.00 56.30 56.55 1y8b h ASN 566 Cb 0.94 0.74 -0.04 0.00 -0.00 0.00 0.00 38.32 39.97 1y8b h ASN 566 CO 0.00 -0.36 0.43 0.00 -0.00 0.00 0.00 177.43 177.50 1y8b h ALA 567 N 0.31 1.37 0.00 1.57 0.00 -1.99 -2.29 119.26 118.22 1y8b h ALA 567 Ca 0.13 -0.09 -0.19 0.00 0.00 0.00 0.00 54.91 54.75 1y8b h ALA 567 Cb 0.57 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 1y8b h ALA 567 CO -0.67 0.53 -0.91 1.49 0.00 0.00 0.00 179.25 179.69 1y8b h GLU 568 N 1.02 0.00 -1.30 0.00 4.81 -0.55 -3.29 114.58 115.26 1y8b h GLU 568 Ca 0.26 0.00 0.39 0.00 -0.13 0.00 0.00 59.36 59.89 1y8b h GLU 568 Cb -0.02 0.00 -0.10 0.00 0.63 0.00 0.00 28.75 29.26 1y8b h GLU 568 CO -0.05 0.91 0.87 0.35 -0.73 0.00 0.00 179.01 180.36 1y8b h PHE 569 N 0.00 0.43 0.08 0.92 3.04 0.72 -2.37 116.94 119.75 1y8b h PHE 569 Ca -0.01 0.02 -0.00 0.00 3.98 0.00 0.00 57.97 61.95 1y8b h PHE 569 Cb 1.63 -0.11 0.00 0.00 2.56 0.00 0.00 35.95 40.03 1y8b h PHE 569 CO 0.00 -0.09 -0.04 0.93 -2.02 0.00 0.00 178.31 177.09 1y8b h GLU 570 N 0.14 -0.10 -1.72 1.11 4.39 -1.66 -2.59 114.58 114.14 1y8b h GLU 570 Ca 0.74 0.01 0.50 0.00 0.34 0.00 0.00 59.36 60.95 1y8b h GLU 570 Cb 2.39 0.02 -0.07 0.00 -0.10 0.00 0.00 28.75 31.00 1y8b h GLU 570 CO -0.29 -0.07 1.29 -1.35 -1.16 0.00 0.00 179.01 177.44 1y8b h PRO 571 N -0.82 0.00 0.00 2.33 0.11 -1.62 -0.77 132.00 131.23 1y8b h PRO 571 Ca -0.01 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.10 1y8b h PRO 571 Cb 0.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.19 1y8b h PRO 571 CO 0.02 0.00 -0.23 -0.07 -0.21 0.00 0.00 178.00 177.51 1y8b h LEU 572 N 0.00 0.00 -1.27 2.35 3.38 -1.54 -3.04 115.31 115.19 1y8b h LEU 572 Ca 0.82 0.00 0.10 0.00 0.09 0.00 0.00 57.88 58.89 1y8b h LEU 572 Cb 3.39 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 44.13 1y8b h LEU 572 CO -0.01 0.49 0.74 0.25 0.09 0.00 0.00 178.44 180.00 1y8b h LEU 573 N -0.74 0.00 0.14 1.67 5.85 -0.94 1.58 115.31 122.86 1y8b h LEU 573 Ca 0.00 0.00 -0.22 0.00 0.84 0.00 0.00 57.88 58.50 1y8b h LEU 573 Cb 0.23 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.27 1y8b h LEU 573 CO 0.00 0.00 -1.00 -0.78 -0.34 0.00 0.00 178.44 176.32 1y8b h ASP 574 N 0.00 0.45 0.59 1.25 1.82 -1.28 -3.36 116.42 115.89 1y8b h ASP 574 Ca 0.16 -0.92 -0.28 0.00 -0.39 0.00 0.00 57.03 55.60 1y8b h ASP 574 Cb 1.64 -0.15 -0.03 0.00 0.68 0.00 0.00 39.33 41.47 1y8b h ASP 574 CO -0.00 1.46 -1.48 -0.78 -1.61 0.00 0.00 179.24 176.83 1y8b h ASP 575 N -0.35 0.14 -1.20 2.28 1.82 0.10 -3.32 116.42 115.89 1y8b h ASP 575 Ca -0.19 -0.22 0.34 0.00 -0.39 0.00 0.00 57.03 56.57 1y8b h ASP 575 Cb 1.69 -0.05 -0.08 0.00 0.68 0.00 0.00 39.33 41.57 1y8b h ASP 575 CO 0.13 1.18 0.81 -0.07 -1.61 0.00 0.00 179.24 179.68 1y8b h LEU 576 N 0.02 0.22 -0.66 2.28 3.38 0.18 0.97 115.31 121.70 1y8b h LEU 576 Ca -0.21 0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.82 1y8b h LEU 576 Cb 1.95 0.03 0.00 0.00 0.09 0.00 0.00 40.66 42.73 1y8b h LEU 576 CO 0.12 0.00 0.00 -0.11 0.09 0.00 0.00 178.44 178.54 1y8b n LEU 577 N -4.43 0.32 -4.59 1.67 7.94 -1.25 -4.79 117.00 111.86 1y8b n LEU 577 Ca 0.29 -0.16 -0.30 0.00 -1.11 0.00 0.00 56.01 54.73 1y8b n LEU 577 Cb 1.18 -0.16 0.23 0.00 0.53 0.00 0.00 43.42 45.20 1y8b n LEU 577 CO 0.31 0.08 0.61 0.28 -1.11 0.00 0.00 177.39 177.57 1y8b s THR 578 N -1.34 1.67 -0.29 1.96 -1.32 0.33 -4.88 115.64 111.77 1y8b s THR 578 Ca 0.00 0.00 0.01 0.00 -1.21 0.00 0.00 61.69 60.49 1y8b s THR 578 Cb 0.00 -2.47 0.15 0.00 -1.51 0.00 0.00 72.50 68.67 1y8b s THR 578 CO 0.00 0.00 0.34 0.27 -2.21 0.00 0.00 174.62 173.02 1y8b s ILE 579 N -2.96 -0.49 0.00 5.08 -5.25 -1.26 -5.02 121.20 111.30 1y8b s ILE 579 Ca 0.70 -0.44 0.00 0.00 -0.99 0.00 0.00 60.65 59.92 1y8b s ILE 579 Cb -0.12 -0.97 0.00 0.00 2.95 0.00 0.00 42.46 44.32 1y8b s ILE 579 CO 0.57 -0.41 0.13 -2.65 -1.79 0.00 0.00 174.94 170.79 1y8b n PRO 580 N 5.28 0.00 -1.90 0.37 -0.02 -1.26 -4.80 135.00 132.68 1y8b n PRO 580 Ca -0.01 0.00 -0.31 0.00 -2.02 0.00 0.00 63.50 61.17 1y8b n PRO 580 Cb 0.47 -1.14 0.01 0.00 -0.02 0.00 0.00 33.50 32.82 1y8b n PRO 580 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1y8b s VAL 581 N 1.55 4.71 0.54 -1.45 0.11 -1.26 -2.82 120.40 121.79 1y8b s VAL 581 Ca 0.00 0.85 -0.19 0.00 -2.93 0.00 0.00 61.98 59.71 1y8b s VAL 581 Cb 0.00 -3.87 -0.06 0.00 -1.53 0.00 0.00 36.38 30.92 1y8b s VAL 581 CO 0.00 -1.14 1.13 0.00 -3.33 0.00 0.00 175.10 171.76 1y8b s ALA 582 N -3.16 2.70 -0.45 1.54 0.00 -0.63 -4.72 121.76 117.05 1y8b s ALA 582 Ca 0.55 0.82 0.04 0.00 0.00 0.00 0.00 51.96 53.36 1y8b s ALA 582 Cb -0.11 -3.36 0.12 0.00 0.00 0.00 0.00 23.12 19.77 1y8b s ALA 582 CO 0.54 -0.76 0.19 -2.00 0.00 0.00 0.00 175.76 173.73 1y8b s GLU 583 N -3.28 1.69 -0.04 0.00 2.12 -1.26 -4.90 118.70 113.03 1y8b s GLU 583 Ca 0.73 -2.26 -0.03 0.00 0.36 0.00 0.00 54.97 53.76 1y8b s GLU 583 Cb -0.24 -3.11 0.01 0.00 0.26 0.00 0.00 34.13 31.06 1y8b s GLU 583 CO 0.27 -1.06 0.07 0.09 -0.54 0.00 0.00 175.26 174.09 1y8b n ASN 584 N 3.58 -5.31 -4.46 -1.70 5.03 -1.26 -4.92 115.26 106.23 1y8b n ASN 584 Ca 0.05 1.51 -0.39 0.00 0.87 0.00 0.00 54.58 56.62 1y8b n ASN 584 Cb 0.36 -4.26 -0.11 0.00 -1.02 0.00 0.00 39.78 34.74 1y8b n ASN 584 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1y8b s ALA 585 N -0.46 3.31 -0.36 5.41 0.00 -1.26 -4.94 121.76 123.46 1y8b s ALA 585 Ca -0.08 -1.37 0.08 0.00 0.00 0.00 0.00 51.96 50.59 1y8b s ALA 585 Cb 0.01 -2.42 0.70 0.00 0.00 0.00 0.00 23.12 21.41 1y8b s ALA 585 CO 0.21 -0.89 1.82 0.09 0.00 0.00 0.00 175.76 176.99 1y8b n ASN 586 N 5.00 4.26 -4.67 0.00 5.03 -1.26 -4.99 115.26 118.63 1y8b n ASN 586 Ca -0.14 -3.40 -0.46 0.00 0.87 0.00 0.00 54.58 51.45 1y8b n ASN 586 Cb 0.49 -0.77 -0.04 0.00 -1.02 0.00 0.00 39.78 38.44 1y8b n ASN 586 CO 0.00 0.00 0.00 0.79 -1.83 0.00 0.00 177.26 176.22 1y8b n TRP 587 N -0.60 2.27 -1.16 3.10 8.01 -1.26 -4.93 117.44 122.87 1y8b n TRP 587 Ca 0.47 0.27 -0.31 0.00 -1.31 0.00 0.00 57.50 56.62 1y8b n TRP 587 Cb 1.46 -2.54 0.11 0.00 -2.01 0.00 0.00 31.31 28.33 1y8b n TRP 587 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.69 177.13 1y8b s SER 588 N 0.89 4.06 0.44 -0.99 0.15 -1.26 -4.77 113.70 112.23 1y8b s SER 588 Ca 0.78 1.82 0.11 0.00 0.70 0.00 0.00 55.95 59.37 1y8b s SER 588 Cb -0.68 -2.47 0.99 0.00 -1.71 0.00 0.00 66.02 62.15 1y8b s SER 588 CO 0.38 -2.32 2.06 0.00 1.20 0.00 0.00 173.24 174.56 1y8b h ALA 589 N -1.32 1.86 -0.11 5.45 0.00 -2.00 -1.80 119.26 121.33 1y8b h ALA 589 Ca -0.45 -0.02 -0.20 0.00 0.00 0.00 0.00 54.91 54.25 1y8b h ALA 589 Cb 1.25 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.94 1y8b h ALA 589 CO 0.50 0.10 -0.71 0.37 0.00 0.00 0.00 179.25 179.51 1y8b h GLN 590 N 0.40 0.67 0.31 0.00 5.75 -1.99 -2.84 115.11 117.41 1y8b h GLN 590 Ca 0.15 -0.58 -0.01 0.00 -0.15 0.00 0.00 58.65 58.07 1y8b h GLN 590 Cb 0.12 0.13 -0.01 0.00 1.07 0.00 0.00 27.48 28.78 1y8b h GLN 590 CO -0.04 1.19 -0.31 0.93 -2.65 0.00 0.00 178.83 177.96 1y8b h GLU 591 N 0.34 -0.60 -0.98 1.69 4.39 -1.69 0.36 114.58 118.09 1y8b h GLU 591 Ca -0.06 0.04 0.29 0.00 0.34 0.00 0.00 59.36 59.97 1y8b h GLU 591 Cb 1.36 0.14 -0.14 0.00 -0.10 0.00 0.00 28.75 30.00 1y8b h GLU 591 CO 0.15 -0.40 0.51 0.82 -1.16 0.00 0.00 179.01 178.93 1y8b h ILE 592 N -0.62 0.36 -0.13 3.13 2.04 -1.51 0.87 117.51 121.65 1y8b h ILE 592 Ca -0.04 -0.13 -0.11 0.00 1.00 0.00 0.00 64.86 65.59 1y8b h ILE 592 Cb 0.54 -0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.57 1y8b h ILE 592 CO -0.04 0.07 -0.39 1.56 0.00 0.00 0.00 178.15 179.35 1y8b h GLN 593 N 0.37 0.29 -0.60 2.37 1.08 -1.05 0.25 115.11 117.83 1y8b h GLN 593 Ca 0.68 -0.14 -0.09 0.00 -1.45 0.00 0.00 58.65 57.65 1y8b h GLN 593 Cb 1.45 -0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.86 1y8b h GLN 593 CO -0.58 0.64 0.02 1.96 -0.95 0.00 0.00 178.83 179.93 1y8b h GLN 594 N 0.25 1.02 0.09 1.46 4.20 0.49 -2.28 115.11 120.35 1y8b h GLN 594 Ca 0.02 -0.30 -0.29 0.00 0.06 0.00 0.00 58.65 58.14 1y8b h GLN 594 Cb 0.81 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.47 1y8b h GLN 594 CO 0.06 0.99 -1.45 1.05 -0.67 0.00 0.00 178.83 178.81 1y8b h GLU 595 N 0.94 0.20 0.26 1.46 4.11 -1.15 -2.85 114.58 117.55 1y8b h GLU 595 Ca 0.17 -0.34 0.00 0.00 0.07 0.00 0.00 59.36 59.27 1y8b h GLU 595 Cb 0.51 0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.86 1y8b h GLU 595 CO 0.02 1.05 -0.30 1.25 0.07 0.00 0.00 179.01 181.11 1y8b h LEU 596 N 0.05 -0.81 0.06 3.06 6.46 -0.39 0.36 115.31 124.10 1y8b h LEU 596 Ca -0.21 0.08 -0.00 0.00 -0.12 0.00 0.00 57.88 57.63 1y8b h LEU 596 Cb 1.98 0.28 0.00 0.00 -0.73 0.00 0.00 40.66 42.19 1y8b h LEU 596 CO 0.15 -0.42 -0.03 0.44 -0.62 0.00 0.00 178.44 177.97 1y8b h ASP 597 N -0.60 -0.07 -0.65 1.25 5.19 -1.54 0.32 116.42 120.33 1y8b h ASP 597 Ca -0.00 -0.00 0.13 0.00 -0.62 0.00 0.00 57.03 56.53 1y8b h ASP 597 Cb 0.57 0.02 -0.09 0.00 0.18 0.00 0.00 39.33 40.00 1y8b h ASP 597 CO -0.08 -0.04 0.14 -1.13 -3.12 0.00 0.00 179.24 175.00 1y8b h ASN 598 N -0.08 -0.01 0.03 6.45 -0.73 -1.23 0.23 115.58 120.24 1y8b h ASN 598 Ca -0.01 0.12 -0.00 0.00 1.87 0.00 0.00 56.30 58.29 1y8b h ASN 598 Cb 0.06 0.17 0.00 0.00 0.27 0.00 0.00 38.32 38.83 1y8b h ASN 598 CO 0.01 -0.01 -0.01 0.78 -0.37 0.00 0.00 177.43 177.83 1y8b h ASN 599 N 0.26 -0.03 -0.51 1.15 4.21 0.20 -2.40 115.58 118.44 1y8b h ASN 599 Ca 0.35 -0.39 0.10 0.00 1.21 0.00 0.00 56.30 57.56 1y8b h ASN 599 Cb 0.54 0.01 -0.08 0.00 -1.12 0.00 0.00 38.32 37.67 1y8b h ASN 599 CO -0.44 0.38 0.02 0.58 -1.29 0.00 0.00 177.43 176.67 1y8b h VAL 600 N -0.46 0.61 -0.84 2.81 2.07 0.45 0.11 116.25 121.01 1y8b h VAL 600 Ca -0.00 -0.05 0.06 0.00 0.82 0.00 0.00 66.70 67.53 1y8b h VAL 600 Cb 0.43 0.47 -0.06 0.00 -1.52 0.00 0.00 31.29 30.60 1y8b h VAL 600 CO 0.01 0.02 0.52 1.56 0.02 0.00 0.00 177.57 179.70 1y8b h GLN 601 N 0.13 0.92 -0.08 1.57 1.08 -0.56 0.16 115.11 118.34 1y8b h GLN 601 Ca 0.26 -0.06 0.04 0.00 -1.45 0.00 0.00 58.65 57.44 1y8b h GLN 601 Cb 0.39 -0.21 -0.05 0.00 -0.05 0.00 0.00 27.48 27.56 1y8b h GLN 601 CO -0.42 0.61 -0.21 0.78 -0.95 0.00 0.00 178.83 178.64 1y8b h GLY 602 N 0.95 -0.24 0.57 3.46 0.00 -0.28 -0.74 103.07 106.80 1y8b h GLY 602 Ca 0.36 0.26 -0.00 0.00 0.00 0.00 0.00 47.33 47.95 1y8b h GLY 602 CO -0.17 -0.19 -0.00 0.16 0.00 0.00 0.00 176.54 176.34 1y8b h ILE 603 N -0.30 1.32 -1.11 2.60 3.07 -0.79 -2.94 117.51 119.37 1y8b h ILE 603 Ca 0.08 -1.00 0.31 0.00 1.55 0.00 0.00 64.86 65.80 1y8b h ILE 603 Cb 0.42 2.00 -0.10 0.00 -0.27 0.00 0.00 36.82 38.86 1y8b h ILE 603 CO -0.25 0.26 0.71 -0.07 -1.05 0.00 0.00 178.15 177.75 1y8b h LEU 604 N -0.44 0.39 -0.58 0.16 3.38 -0.50 0.44 115.31 118.16 1y8b h LEU 604 Ca -0.00 0.10 -0.07 0.00 0.09 0.00 0.00 57.88 57.99 1y8b h LEU 604 Cb 0.43 0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 1y8b h LEU 604 CO 0.00 0.01 0.08 1.23 0.09 0.00 0.00 178.44 179.86 1y8b h GLY 605 N 0.31 1.05 2.00 0.83 0.00 -0.96 0.12 103.07 106.42 1y8b h GLY 605 Ca 0.65 -0.71 -0.03 0.00 0.00 0.00 0.00 47.33 47.24 1y8b h GLY 605 CO -0.33 0.66 -0.16 -1.82 0.00 0.00 0.00 176.54 174.89 1y8b h TYR 606 N 0.87 0.00 0.00 5.60 5.03 -0.18 -2.62 116.97 125.68 1y8b h TYR 606 Ca 0.18 0.00 -0.24 0.00 2.58 0.00 0.00 58.73 61.24 1y8b h TYR 606 Cb 0.44 0.00 -0.04 0.00 1.55 0.00 0.00 36.73 38.68 1y8b h TYR 606 CO 0.03 0.16 -1.40 0.28 -1.32 0.00 0.00 178.16 175.91 1y8b h VAL 607 N 0.00 1.08 0.00 1.81 2.07 -0.38 -3.16 116.25 117.68 1y8b h VAL 607 Ca -0.00 -2.83 -0.07 0.00 0.82 0.00 0.00 66.70 64.62 1y8b h VAL 607 Cb 0.96 2.51 -0.01 0.00 -1.52 0.00 0.00 31.29 33.23 1y8b h VAL 607 CO 0.02 0.62 -0.40 1.62 0.02 0.00 0.00 177.57 179.44 1y8b h VAL 608 N 0.00 1.17 0.00 2.57 3.04 -0.77 -3.32 116.25 118.94 1y8b h VAL 608 Ca -0.17 -2.02 0.00 0.00 -1.01 0.00 0.00 66.70 63.49 1y8b h VAL 608 Cb 1.86 2.36 0.00 0.00 -2.01 0.00 0.00 31.29 33.50 1y8b h VAL 608 CO 0.09 0.40 -0.14 0.03 -1.01 0.00 0.00 177.57 176.94 1y8b h ARG 609 N -1.00 0.00 -1.35 4.17 3.08 -1.67 -2.69 114.38 114.93 1y8b h ARG 609 Ca -0.10 0.00 0.39 0.00 0.07 0.00 0.00 59.98 60.34 1y8b h ARG 609 Cb 0.92 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.90 1y8b h ARG 609 CO -0.06 0.00 0.94 2.35 -1.07 0.00 0.00 179.97 182.13 1y8b h TRP 610 N -0.88 0.19 0.00 3.04 7.01 -1.68 0.82 115.95 124.45 1y8b h TRP 610 Ca 0.00 0.01 -0.24 0.00 2.11 0.00 0.00 58.89 60.76 1y8b h TRP 610 Cb 0.14 -0.05 -0.04 0.00 -2.10 0.00 0.00 29.16 27.11 1y8b h TRP 610 CO -0.06 -0.02 -1.29 0.28 -2.79 0.00 0.00 178.44 174.56 1y8b h VAL 611 N 0.08 1.35 0.00 2.65 2.07 -1.66 -1.98 116.25 118.75 1y8b h VAL 611 Ca 0.69 -3.12 -0.19 0.00 0.82 0.00 0.00 66.70 64.90 1y8b h VAL 611 Cb 2.51 2.67 -0.03 0.00 -1.52 0.00 0.00 31.29 34.92 1y8b h VAL 611 CO -0.12 0.77 -1.05 -0.33 0.02 0.00 0.00 177.57 176.86 1y8b h GLU 612 N 0.00 0.00 0.00 1.57 4.39 0.74 -3.41 114.58 117.87 1y8b h GLU 612 Ca -0.12 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.58 1y8b h GLU 612 Cb 1.87 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.52 1y8b h GLU 612 CO 0.11 0.93 -1.22 1.04 -1.16 0.00 0.00 179.01 178.71 1y8b n GLN 613 N -4.47 1.28 -3.12 2.33 1.13 0.14 -5.04 117.38 109.63 1y8b n GLN 613 Ca -0.28 -0.07 -0.11 0.00 -1.94 0.00 0.00 57.00 54.60 1y8b n GLN 613 Cb 0.63 -1.26 0.01 0.00 0.11 0.00 0.00 30.24 29.72 1y8b n GLN 613 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1y8b n GLY 614 N 1.53 -1.10 3.49 1.08 0.00 -0.75 -4.94 105.19 104.50 1y8b n GLY 614 Ca -0.00 0.90 -0.12 0.00 0.00 0.00 0.00 46.02 46.80 1y8b n GLY 614 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1y8b s ILE 615 N -2.64 -0.00 0.00 -0.61 -5.25 -1.26 -4.33 121.20 107.10 1y8b s ILE 615 Ca 0.15 0.01 0.00 0.00 -0.99 0.00 0.00 60.65 59.82 1y8b s ILE 615 Cb -0.03 -0.82 0.00 0.00 2.95 0.00 0.00 42.46 44.55 1y8b s ILE 615 CO 0.79 0.01 0.29 0.61 -1.79 0.00 0.00 174.94 174.85 1y8b n GLY 616 N 3.26 -0.38 3.81 6.27 0.00 -1.26 -4.58 105.19 112.30 1y8b n GLY 616 Ca -0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.54 1y8b n GLY 616 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y8b n SER 618 N -2.27 0.00 -3.92 0.00 7.64 -1.26 -4.89 113.62 108.93 1y8b n SER 618 Ca 0.08 0.00 -0.10 0.00 1.01 0.00 0.00 58.87 59.86 1y8b n SER 618 Cb 0.53 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.63 1y8b n SER 618 CO 0.00 0.00 0.00 -1.59 -3.01 0.00 0.00 175.04 170.44 1y8b s LYS 619 N 0.00 0.47 -0.35 1.43 0.00 -1.26 -4.89 119.74 115.14 1y8b s LYS 619 Ca 0.00 -0.55 -0.11 0.00 0.00 0.00 0.00 55.97 55.30 1y8b s LYS 619 Cb 0.00 0.19 0.01 0.00 0.00 0.00 0.00 37.83 38.03 1y8b s LYS 619 CO 0.00 -0.11 0.21 0.14 0.00 0.00 0.00 175.35 175.59 1y8b s VAL 620 N -1.76 4.78 0.13 1.79 -7.23 -0.09 -4.86 120.40 113.16 1y8b s VAL 620 Ca -0.12 -0.59 -0.34 0.00 -1.81 0.00 0.00 61.98 59.12 1y8b s VAL 620 Cb -0.06 -3.56 -0.17 0.00 0.56 0.00 0.00 36.38 33.15 1y8b s VAL 620 CO -0.01 -0.11 1.03 -2.65 -0.31 0.00 0.00 175.10 173.06 1y8b n PRO 621 N 5.03 0.67 0.00 4.82 -0.02 -1.26 -3.75 135.00 140.48 1y8b n PRO 621 Ca -0.12 0.24 0.00 0.00 -2.02 0.00 0.00 63.50 61.59 1y8b n PRO 621 Cb 0.48 -1.65 0.00 0.00 -0.02 0.00 0.00 33.50 32.30 1y8b n PRO 621 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1y8b n ASP 622 N 1.90 0.06 0.17 2.55 5.75 -1.22 -4.90 116.55 120.86 1y8b n ASP 622 Ca 0.17 0.00 0.13 0.00 -0.01 0.00 0.00 54.79 55.08 1y8b n ASP 622 Cb 0.20 0.00 0.39 0.00 -1.03 0.00 0.00 41.12 40.69 1y8b n ASP 622 CO 0.00 0.00 0.00 0.40 -0.11 0.00 0.00 177.20 177.49 1y8b h ILE 623 N 0.00 0.00 -0.38 2.12 2.04 -1.94 -2.93 117.51 116.43 1y8b h ILE 623 Ca 0.00 -0.58 0.00 0.00 1.00 0.00 0.00 64.86 65.28 1y8b h ILE 623 Cb 0.00 1.54 0.00 0.00 -0.74 0.00 0.00 36.82 37.62 1y8b h ILE 623 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 178.15 179.56 1y8b n HIS 624 N -2.61 1.12 -1.12 1.37 8.25 -1.26 -4.91 115.22 116.06 1y8b n HIS 624 Ca 0.04 -0.76 -0.07 0.00 -0.26 0.00 0.00 57.72 56.67 1y8b n HIS 624 Cb 0.40 -0.29 -0.03 0.00 1.12 0.00 0.00 29.99 31.19 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 0.05 -4.82 -4.84 0.41 4.05 -1.11 -4.92 115.26 104.08 1y8b n ASN 625 Ca 0.21 0.18 -0.30 0.00 0.45 0.00 0.00 54.58 55.12 1y8b n ASN 625 Cb 0.87 -3.48 0.06 0.00 1.23 0.00 0.00 39.78 38.46 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 -1.53 3.45 -0.55 3.44 1.01 -1.26 -4.72 120.40 120.25 1y8b s VAL 626 Ca 0.00 0.47 -0.28 0.00 0.00 0.00 0.00 61.98 62.17 1y8b s VAL 626 Cb 0.00 -3.33 0.02 0.00 0.00 0.00 0.00 36.38 33.07 1y8b s VAL 626 CO 0.00 -0.62 1.33 0.00 0.00 0.00 0.00 175.10 175.81 1y8b s ALA 627 N -3.22 2.91 0.01 5.51 0.00 -1.26 -3.44 121.76 122.27 1y8b s ALA 627 Ca 0.59 -0.66 0.03 0.00 0.00 0.00 0.00 51.96 51.92 1y8b s ALA 627 Cb -0.13 -4.06 -0.03 0.00 0.00 0.00 0.00 23.12 18.90 1y8b s ALA 627 CO 0.53 -2.76 -0.06 -0.51 0.00 0.00 0.00 175.76 172.96 1y8b s LEU 628 N 5.55 3.20 -0.23 0.00 2.01 -1.25 -4.53 118.68 123.44 1y8b s LEU 628 Ca 0.50 -0.15 -0.04 0.00 0.01 0.00 0.00 54.13 54.44 1y8b s LEU 628 Cb -0.10 -1.85 -0.01 0.00 0.01 0.00 0.00 46.19 44.24 1y8b s LEU 628 CO 0.26 0.27 -0.02 -0.04 1.01 0.00 0.00 176.35 177.83 1y8b s MET 629 N -1.52 3.39 -0.06 1.70 -1.94 -1.26 -0.92 119.30 118.69 1y8b s MET 629 Ca 0.18 -0.62 -0.02 0.00 -1.71 0.00 0.00 55.69 53.51 1y8b s MET 629 Cb -0.11 -3.06 0.04 0.00 2.01 0.00 0.00 34.83 33.70 1y8b s MET 629 CO 0.09 -0.21 0.11 -1.21 -0.01 0.00 0.00 175.02 173.79 1y8b s GLU 630 N 1.49 0.02 0.35 2.03 2.02 -1.26 -5.01 118.70 118.34 1y8b s GLU 630 Ca 0.06 0.39 0.05 0.00 0.02 0.00 0.00 54.97 55.48 1y8b s GLU 630 Cb -0.14 -0.27 -0.02 0.00 0.10 0.00 0.00 34.13 33.79 1y8b s GLU 630 CO -0.02 -0.23 0.36 -0.51 0.02 0.00 0.00 175.26 174.88 1y8b s ASP 631 N 1.64 1.52 0.35 -0.19 1.11 -1.26 -4.90 116.67 114.94 1y8b s ASP 631 Ca -0.03 -1.70 0.11 0.00 0.18 0.00 0.00 52.55 51.11 1y8b s ASP 631 Cb -0.12 0.61 0.60 0.00 1.07 0.00 0.00 42.92 45.08 1y8b s ASP 631 CO -0.05 -1.17 1.21 -0.09 1.18 0.00 0.00 175.17 176.25 1y8b h ARG 632 N 2.09 0.00 -0.22 8.23 2.43 -1.95 0.73 114.38 125.70 1y8b h ARG 632 Ca -0.26 0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 58.85 1y8b h ARG 632 Cb 1.23 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.77 1y8b h ARG 632 CO 0.36 0.00 -0.16 0.00 -1.51 0.00 0.00 179.97 178.66 1y8b h ALA 633 N 0.94 1.32 0.00 2.80 0.00 -1.94 -0.70 119.26 121.68 1y8b h ALA 633 Ca 0.00 -0.26 -0.19 0.00 0.00 0.00 0.00 54.91 54.46 1y8b h ALA 633 Cb 0.81 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 1y8b h ALA 633 CO 0.00 0.45 -0.90 1.79 0.00 0.00 0.00 179.25 180.59 1y8b h THR 634 N 0.34 1.63 0.00 0.00 1.35 0.19 -0.08 112.91 116.35 1y8b h THR 634 Ca 0.06 -3.05 -0.02 0.00 -0.55 0.00 0.00 66.41 62.86 1y8b h THR 634 Cb 0.49 2.65 -0.00 0.00 -1.73 0.00 0.00 68.15 69.56 1y8b h THR 634 CO 0.03 0.87 -0.09 0.25 -0.25 0.00 0.00 175.52 176.33 1y8b h LEU 635 N 0.01 0.00 0.00 3.87 5.85 -1.41 -0.90 115.31 122.73 1y8b h LEU 635 Ca -0.01 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.71 1y8b h LEU 635 Cb 1.59 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.62 1y8b h LEU 635 CO 0.12 0.09 -1.77 0.54 -0.34 0.00 0.00 178.44 177.08 1y8b n ARG 636 N -3.15 0.51 -2.69 1.25 1.74 -0.33 -4.27 116.66 109.72 1y8b n ARG 636 Ca 0.02 -0.15 -0.13 0.00 -0.77 0.00 0.00 57.85 56.82 1y8b n ARG 636 Cb 0.48 -1.52 0.02 0.00 -1.02 0.00 0.00 32.46 30.42 1y8b n ARG 636 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 1y8b n ILE 637 N -2.09 1.13 0.04 0.55 -0.00 -0.05 -4.83 119.36 114.11 1y8b n ILE 637 Ca -0.02 -3.54 0.00 0.00 -0.00 0.00 0.00 62.75 59.19 1y8b n ILE 637 Cb 0.52 0.24 0.00 0.00 -0.00 0.00 0.00 39.64 40.40 1y8b n ILE 637 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.55 175.01 1y8b n SER 638 N -0.09 -0.66 -0.13 4.38 3.41 -0.45 -4.77 113.62 115.30 1y8b n SER 638 Ca 0.16 0.37 0.26 0.00 -0.26 0.00 0.00 58.87 59.40 1y8b n SER 638 Cb 0.77 0.89 0.72 0.00 -0.26 0.00 0.00 64.21 66.33 1y8b n SER 638 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1y8b h SER 639 N 0.00 0.00 0.11 4.04 4.64 -1.45 1.06 113.55 121.95 1y8b h SER 639 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1y8b h SER 639 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1y8b h SER 639 CO 0.00 0.00 0.00 -0.61 -0.87 0.00 0.00 176.83 175.35 1y8b h GLN 640 N 0.00 0.00 -0.27 4.77 4.15 -1.83 -1.36 115.11 120.57 1y8b h GLN 640 Ca 0.38 0.00 -0.12 0.00 0.77 0.00 0.00 58.65 59.68 1y8b h GLN 640 Cb 1.53 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 29.21 1y8b h GLN 640 CO -0.00 0.00 -0.32 0.45 -1.93 0.00 0.00 178.83 177.02 1y8b h HIS 641 N 0.00 0.65 0.49 3.99 3.86 0.81 -2.81 115.15 122.14 1y8b h HIS 641 Ca 0.00 -0.16 -0.02 0.00 -1.16 0.00 0.00 60.37 59.02 1y8b h HIS 641 Cb 0.06 -0.15 0.00 0.00 1.06 0.00 0.00 27.41 28.38 1y8b h HIS 641 CO 0.00 0.82 -0.28 0.82 0.86 0.00 0.00 177.93 180.15 1y8b h ILE 642 N 0.48 0.00 -0.34 2.45 2.04 -1.39 0.16 117.51 120.91 1y8b h ILE 642 Ca 0.06 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.97 1y8b h ILE 642 Cb 0.80 0.00 -0.08 0.00 -0.74 0.00 0.00 36.82 36.79 1y8b h ILE 642 CO 0.06 0.00 -0.50 0.00 0.00 0.00 0.00 178.15 177.72 1y8b h ALA 643 N -1.55 -0.66 -0.57 1.87 0.00 -1.69 1.95 119.26 118.61 1y8b h ALA 643 Ca -0.07 0.01 0.11 0.00 0.00 0.00 0.00 54.91 54.97 1y8b h ALA 643 Cb 0.56 1.00 -0.11 0.00 0.00 0.00 0.00 17.79 19.24 1y8b h ALA 643 CO 0.08 -0.98 -0.15 -0.91 0.00 0.00 0.00 179.25 177.29 1y8b h ASN 644 N -0.41 -0.55 0.04 0.00 4.21 -1.44 -1.45 115.58 115.98 1y8b h ASN 644 Ca 0.09 0.17 -0.00 0.00 1.21 0.00 0.00 56.30 57.77 1y8b h ASN 644 Cb 0.61 0.36 0.00 0.00 -1.12 0.00 0.00 38.32 38.17 1y8b h ASN 644 CO -0.55 -0.19 -0.02 -0.50 -1.29 0.00 0.00 177.43 174.88 1y8b h TRP 645 N -0.00 -0.05 -1.44 1.19 -0.00 0.13 -2.88 115.95 112.89 1y8b h TRP 645 Ca 0.28 -0.00 0.46 0.00 -0.00 0.00 0.00 58.89 59.62 1y8b h TRP 645 Cb 0.42 0.02 -0.12 0.00 -0.00 0.00 0.00 29.16 29.48 1y8b h TRP 645 CO -0.48 0.31 0.96 1.25 -0.00 0.00 0.00 178.44 180.49 1y8b h LEU 646 N -0.43 0.18 -0.09 -4.49 6.46 0.40 3.50 115.31 120.85 1y8b h LEU 646 Ca -0.01 0.11 -0.02 0.00 -0.12 0.00 0.00 57.88 57.84 1y8b h LEU 646 Cb 0.39 0.10 -0.00 0.00 -0.73 0.00 0.00 40.66 40.41 1y8b h LEU 646 CO 0.01 -0.15 -0.01 -0.09 -0.62 0.00 0.00 178.44 177.58 1y8b h ARG 647 N 0.06 0.17 -0.31 1.25 1.12 -1.11 -3.28 114.38 112.28 1y8b h ARG 647 Ca 0.84 -0.06 -0.21 0.00 -1.11 0.00 0.00 59.98 59.43 1y8b h ARG 647 Cb 2.81 -0.01 -0.15 0.00 -0.01 0.00 0.00 29.97 32.60 1y8b h ARG 647 CO -0.33 0.46 -0.48 1.58 -3.11 0.00 0.00 179.97 178.10 1y8b n HIS 648 N -4.80 1.09 0.07 2.20 -0.00 0.24 -4.68 115.22 109.33 1y8b n HIS 648 Ca -0.06 -1.78 0.05 0.00 0.46 0.00 0.00 57.72 56.38 1y8b n HIS 648 Cb 0.22 -0.36 0.22 0.00 -0.12 0.00 0.00 29.99 29.95 1y8b n HIS 648 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1y8b n GLY 649 N -1.00 2.07 1.52 1.57 0.00 1.10 -4.86 105.19 105.60 1y8b n GLY 649 Ca 0.30 -0.51 -0.04 0.00 0.00 0.00 0.00 46.02 45.77 1y8b n GLY 649 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1y8b n ILE 650 N 0.43 0.00 -4.13 -0.61 0.13 -1.26 -4.83 119.36 109.09 1y8b n ILE 650 Ca 0.16 0.00 -0.21 0.00 -1.10 0.00 0.00 62.75 61.59 1y8b n ILE 650 Cb 0.71 -0.39 -0.17 0.00 -0.84 0.00 0.00 39.64 38.95 1y8b n ILE 650 CO 0.00 0.00 0.00 -1.48 2.80 0.00 0.00 176.55 177.87 1y8b s LEU 651 N -2.08 1.25 1.10 9.51 0.05 -1.26 -5.14 118.68 122.10 1y8b s LEU 651 Ca 0.00 -0.15 -0.17 0.00 0.05 0.00 0.00 54.13 53.86 1y8b s LEU 651 Cb 0.00 -0.50 0.24 0.00 -2.05 0.00 0.00 46.19 43.88 1y8b s LEU 651 CO 0.00 -0.07 1.17 0.42 -0.55 0.00 0.00 176.35 177.32 1y8b s THR 652 N 1.08 1.77 0.05 5.48 -4.23 -1.26 -4.88 115.64 113.65 1y8b s THR 652 Ca -0.08 0.00 0.33 0.00 -1.18 0.00 0.00 61.69 60.76 1y8b s THR 652 Cb -0.14 -2.66 0.37 0.00 1.34 0.00 0.00 72.50 71.41 1y8b s THR 652 CO -0.01 0.00 1.97 0.11 -0.54 0.00 0.00 174.62 176.15 1y8b h LYS 653 N -2.18 0.00 0.00 3.99 6.56 -2.01 -2.68 116.57 120.26 1y8b h LYS 653 Ca -0.46 0.00 -0.00 0.00 -1.06 0.00 0.00 60.65 59.13 1y8b h LYS 653 Cb 1.28 0.00 -0.00 0.00 -0.57 0.00 0.00 32.23 32.94 1y8b h LYS 653 CO 0.39 0.00 -0.01 0.93 -2.06 0.00 0.00 179.45 178.70 1y8b h GLU 654 N 0.00 0.00 0.00 3.15 3.07 -2.00 -2.52 114.58 116.28 1y8b h GLU 654 Ca 0.00 0.00 -0.05 0.00 -0.50 0.00 0.00 59.36 58.81 1y8b h GLU 654 Cb 0.46 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.36 1y8b h GLU 654 CO 0.00 0.01 -0.44 0.37 -1.40 0.00 0.00 179.01 177.55 1y8b h GLN 655 N 0.00 0.00 -0.96 2.33 5.75 -1.83 -3.20 115.11 117.20 1y8b h GLN 655 Ca -0.00 0.00 0.28 0.00 -0.15 0.00 0.00 58.65 58.78 1y8b h GLN 655 Cb 0.13 0.00 -0.04 0.00 1.07 0.00 0.00 27.48 28.64 1y8b h GLN 655 CO 0.00 0.39 0.72 0.28 -2.65 0.00 0.00 178.83 177.56 1y8b h VAL 656 N -1.00 0.47 -0.22 2.39 2.07 -1.64 0.44 116.25 118.76 1y8b h VAL 656 Ca -0.07 0.00 -0.20 0.00 0.82 0.00 0.00 66.70 67.25 1y8b h VAL 656 Cb 0.62 0.50 0.01 0.00 -1.52 0.00 0.00 31.29 30.89 1y8b h VAL 656 CO -0.05 0.00 -0.63 -0.61 0.02 0.00 0.00 177.57 176.30 1y8b h GLN 657 N 0.00 0.82 -0.25 1.57 4.15 -1.56 -0.95 115.11 118.88 1y8b h GLN 657 Ca 0.46 -0.58 -0.14 0.00 0.77 0.00 0.00 58.65 59.15 1y8b h GLN 657 Cb 1.88 0.10 -0.00 0.00 0.21 0.00 0.00 27.48 29.67 1y8b h GLN 657 CO -0.00 1.21 -0.38 0.00 -1.93 0.00 0.00 178.83 177.72 1y8b h ALA 658 N 0.61 0.38 0.10 3.38 0.00 -0.24 -2.83 119.26 120.66 1y8b h ALA 658 Ca -0.02 -0.44 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 1y8b h ALA 658 Cb 1.25 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1y8b h ALA 658 CO 0.14 0.47 -0.05 0.66 0.00 0.00 0.00 179.25 180.46 1y8b h SER 659 N 0.42 -0.12 -0.87 0.00 4.64 -0.92 -1.97 113.55 114.73 1y8b h SER 659 Ca 0.02 -0.10 0.25 0.00 -0.47 0.00 0.00 61.79 61.49 1y8b h SER 659 Cb 0.97 0.03 -0.04 0.00 -0.31 0.00 0.00 62.40 63.05 1y8b h SER 659 CO 0.09 0.03 0.62 0.25 -0.87 0.00 0.00 176.83 176.95 1y8b h LEU 660 N -0.26 0.04 -0.10 5.97 5.85 -1.18 -0.87 115.31 124.76 1y8b h LEU 660 Ca -0.01 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 1y8b h LEU 660 Cb 0.22 -0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.24 1y8b h LEU 660 CO 0.02 0.02 0.03 -0.08 -0.34 0.00 0.00 178.44 178.09 1y8b h GLU 661 N 0.04 0.15 -0.21 1.25 4.22 -1.10 0.71 114.58 119.65 1y8b h GLU 661 Ca 0.42 -0.03 -0.01 0.00 0.08 0.00 0.00 59.36 59.82 1y8b h GLU 661 Cb 1.60 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.82 1y8b h GLU 661 CO -0.02 0.29 0.08 -0.97 -2.18 0.00 0.00 179.01 176.21 1y8b h ASN 662 N -0.01 0.29 -0.02 1.04 -0.73 -1.08 -3.05 115.58 112.01 1y8b h ASN 662 Ca 0.03 -0.17 -0.20 0.00 1.87 0.00 0.00 56.30 57.84 1y8b h ASN 662 Cb 0.20 -0.07 0.00 0.00 0.27 0.00 0.00 38.32 38.71 1y8b h ASN 662 CO -0.00 0.37 -0.69 0.00 -0.37 0.00 0.00 177.43 176.74 1y8b h MET 663 N 0.18 0.65 -0.93 6.67 -0.00 -1.47 -3.18 114.93 116.86 1y8b h MET 663 Ca 0.07 -0.49 0.25 0.00 -0.00 0.00 0.00 59.70 59.53 1y8b h MET 663 Cb 0.18 0.09 -0.17 0.00 -0.00 0.00 0.00 31.60 31.70 1y8b h MET 663 CO -0.01 1.11 0.07 0.00 -0.00 0.00 0.00 176.91 178.09 1y8b h ALA 664 N 0.76 1.14 -0.64 -3.00 0.00 0.55 1.30 119.26 119.37 1y8b h ALA 664 Ca -0.03 0.30 0.03 0.00 0.00 0.00 0.00 54.91 55.21 1y8b h ALA 664 Cb 1.29 0.51 -0.04 0.00 0.00 0.00 0.00 17.79 19.55 1y8b h ALA 664 CO 0.14 -0.54 0.40 -0.22 0.00 0.00 0.00 179.25 179.03 1y8b h LYS 665 N 0.06 0.77 -0.28 0.00 3.11 -1.53 0.17 116.57 118.86 1y8b h LYS 665 Ca 0.57 -0.05 0.08 0.00 -2.81 0.00 0.00 60.65 58.44 1y8b h LYS 665 Cb 1.15 -0.17 -0.01 0.00 -1.00 0.00 0.00 32.23 32.19 1y8b h LYS 665 CO -0.83 0.51 0.32 0.28 -2.81 0.00 0.00 179.45 176.92 1y8b h VAL 666 N 0.79 0.42 -0.31 2.00 2.07 0.16 0.23 116.25 121.60 1y8b h VAL 666 Ca 0.25 0.00 -0.14 0.00 0.82 0.00 0.00 66.70 67.64 1y8b h VAL 666 Cb 0.00 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 30.51 1y8b h VAL 666 CO -0.10 0.00 -0.36 0.58 0.02 0.00 0.00 177.57 177.71 1y8b h VAL 667 N 0.00 1.29 -0.97 2.57 2.07 0.18 -2.96 116.25 118.43 1y8b h VAL 667 Ca 0.13 -1.52 0.27 0.00 0.82 0.00 0.00 66.70 66.41 1y8b h VAL 667 Cb 0.77 1.43 -0.14 0.00 -1.52 0.00 0.00 31.29 31.83 1y8b h VAL 667 CO -0.00 0.49 0.50 0.44 0.02 0.00 0.00 177.57 179.02 1y8b h ASP 668 N 0.59 0.46 -0.91 0.57 5.19 -0.44 0.72 116.42 122.59 1y8b h ASP 668 Ca 0.06 0.17 0.02 0.00 -0.62 0.00 0.00 57.03 56.66 1y8b h ASP 668 Cb 0.89 0.13 -0.05 0.00 0.18 0.00 0.00 39.33 40.48 1y8b h ASP 668 CO 0.08 -0.05 0.60 1.56 -3.12 0.00 0.00 179.24 178.31 1y8b h GLN 669 N 0.39 1.16 -0.62 3.56 4.20 -1.61 0.21 115.11 122.41 1y8b h GLN 669 Ca 0.66 -0.07 -0.00 0.00 0.06 0.00 0.00 58.65 59.30 1y8b h GLN 669 Cb 1.37 -0.26 -0.03 0.00 0.30 0.00 0.00 27.48 28.86 1y8b h GLN 669 CO -0.56 0.77 0.39 1.96 -0.67 0.00 0.00 178.83 180.71 1y8b h GLN 670 N 1.20 0.84 -0.67 1.46 4.20 0.33 -1.83 115.11 120.64 1y8b h GLN 670 Ca 0.35 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.99 1y8b h GLN 670 Cb -0.07 -0.18 0.00 0.00 0.30 0.00 0.00 27.48 27.53 1y8b h GLN 670 CO -0.09 0.59 0.00 -1.71 -0.67 0.00 0.00 178.83 176.95 1y8b n ASN 671 N -4.61 4.65 -1.07 1.46 4.05 -0.81 -4.51 115.26 114.42 1y8b n ASN 671 Ca 0.05 -2.71 0.00 0.00 0.45 0.00 0.00 54.58 52.37 1y8b n ASN 671 Cb 0.05 -0.64 0.00 0.00 1.23 0.00 0.00 39.78 40.42 1y8b n ASN 671 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1y8b n ALA 672 N 0.50 2.24 0.06 5.20 0.00 0.69 -4.24 120.51 124.97 1y8b n ALA 672 Ca 0.21 0.00 0.19 0.00 0.00 0.00 0.00 53.44 53.84 1y8b n ALA 672 Cb 0.98 -1.04 0.52 0.00 0.00 0.00 0.00 19.45 19.90 1y8b n ALA 672 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1y8b h GLY 673 N 3.29 0.00 -7.09 0.00 0.00 -1.83 -3.39 103.07 94.05 1y8b h GLY 673 Ca 0.00 0.00 -0.61 0.00 0.00 0.00 0.00 47.33 46.72 1y8b h GLY 673 CO 0.00 0.00 1.50 1.22 0.00 0.00 0.00 176.54 179.26 1y8b n ASP 674 N -3.19 2.06 -0.10 0.19 9.92 -1.26 -4.81 116.55 119.35 1y8b n ASP 674 Ca 0.11 0.22 -0.21 0.00 -0.53 0.00 0.00 54.79 54.38 1y8b n ASP 674 Cb 0.99 -1.30 -0.12 0.00 -0.64 0.00 0.00 41.12 40.05 1y8b n ASP 674 CO 0.00 0.00 0.00 1.55 0.13 0.00 0.00 177.20 178.88 1y8b h PRO 675 N 13.72 0.01 0.00 -0.24 0.13 -2.00 -3.47 132.00 140.15 1y8b h PRO 675 Ca -0.25 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1y8b h PRO 675 Cb 1.31 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.44 1y8b h PRO 675 CO 1.08 1.00 0.00 0.00 -0.23 0.00 0.00 178.00 179.85 1y8b n ALA 676 N -3.34 1.71 -2.80 -0.56 0.00 -1.26 -5.08 120.51 109.18 1y8b n ALA 676 Ca -0.30 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 52.79 1y8b n ALA 676 Cb 0.67 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 20.03 1y8b n ALA 676 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1y8b s TYR 677 N -1.15 3.34 0.88 0.00 5.04 -1.26 -5.10 117.35 119.11 1y8b s TYR 677 Ca 0.00 0.24 -0.12 0.00 -2.44 0.00 0.00 57.07 54.75 1y8b s TYR 677 Cb 0.00 -1.99 0.12 0.00 0.35 0.00 0.00 41.96 40.44 1y8b s TYR 677 CO 0.00 0.38 1.15 1.03 -1.34 0.00 0.00 175.55 176.77 1y8b s ARG 678 N -0.24 1.38 0.98 4.97 0.52 -1.26 -4.80 118.95 120.50 1y8b s ARG 678 Ca 0.09 0.25 -0.15 0.00 -0.52 0.00 0.00 55.73 55.40 1y8b s ARG 678 Cb -0.12 -1.87 -0.04 0.00 0.52 0.00 0.00 34.95 33.44 1y8b s ARG 678 CO 0.01 -2.03 -0.19 -2.30 0.02 0.00 0.00 175.30 170.82 1y8b n PRO 679 N -3.64 -0.24 0.11 3.54 -0.02 -1.26 -4.91 135.00 128.57 1y8b n PRO 679 Ca 0.07 -0.05 -0.17 0.00 -2.02 0.00 0.00 63.50 61.33 1y8b n PRO 679 Cb 0.60 -1.47 -0.14 0.00 -0.02 0.00 0.00 33.50 32.46 1y8b n PRO 679 CO 0.00 0.00 0.00 0.52 1.98 0.00 0.00 175.50 178.00 1y8b h MET 680 N -1.35 0.31 0.01 -0.52 2.86 -2.07 -3.38 114.93 110.79 1y8b h MET 680 Ca -0.44 -0.53 -0.41 0.00 -2.06 0.00 0.00 59.70 56.26 1y8b h MET 680 Cb 1.30 0.20 -0.06 0.00 0.06 0.00 0.00 31.60 33.09 1y8b h MET 680 CO 0.29 1.25 -2.37 0.00 1.06 0.00 0.00 176.91 177.15 1y8b n ALA 681 N -2.56 1.22 -1.24 6.32 0.00 -1.26 -4.98 120.51 118.01 1y8b n ALA 681 Ca -0.10 -1.01 -0.08 0.00 0.00 0.00 0.00 53.44 52.25 1y8b n ALA 681 Cb 1.04 -0.08 -0.04 0.00 0.00 0.00 0.00 19.45 20.37 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 1.68 1.02 0.08 0.00 0.00 -1.26 -4.88 105.19 101.83 1y8b n GLY 682 Ca -0.48 -0.56 -0.07 0.00 0.00 0.00 0.00 46.02 44.92 1y8b n GLY 682 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 1y8b h ASN 683 N 0.00 0.00 -0.69 1.61 -0.00 -1.94 -3.34 115.58 111.22 1y8b h ASN 683 Ca -0.17 0.00 0.14 0.00 -0.00 0.00 0.00 56.30 56.27 1y8b h ASN 683 Cb 0.59 0.00 -0.13 0.00 -0.00 0.00 0.00 38.32 38.78 1y8b h ASN 683 CO 0.25 0.93 -0.19 0.15 -0.00 0.00 0.00 177.43 178.57 1y8b h PHE 684 N 0.00 -0.41 -0.12 4.14 3.57 -1.95 0.75 116.94 122.92 1y8b h PHE 684 Ca -0.18 0.06 -0.00 0.00 3.53 0.00 0.00 57.97 61.38 1y8b h PHE 684 Cb 1.86 0.29 -0.01 0.00 2.79 0.00 0.00 35.95 40.89 1y8b h PHE 684 CO 0.00 -0.31 0.06 0.00 -2.23 0.00 0.00 178.31 175.84 1y8b h ALA 685 N 1.65 0.15 -0.13 2.41 0.00 -1.99 -1.52 119.26 119.83 1y8b h ALA 685 Ca 0.33 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 55.13 1y8b h ALA 685 Cb 0.51 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 1y8b h ALA 685 CO -0.72 -0.30 0.05 -1.71 0.00 0.00 0.00 179.25 176.58 1y8b n ASN 686 N -4.94 2.44 -4.87 0.00 5.15 0.31 -4.85 115.26 108.51 1y8b n ASN 686 Ca -0.05 -2.22 -0.35 0.00 -0.60 0.00 0.00 54.58 51.36 1y8b n ASN 686 Cb 0.08 -0.54 -0.06 0.00 -0.53 0.00 0.00 39.78 38.73 1y8b n ASN 686 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 1y8b s SER 687 N 0.22 6.63 0.00 1.20 0.15 0.24 -4.95 113.70 117.18 1y8b s SER 687 Ca 0.10 0.77 0.25 0.00 0.70 0.00 0.00 55.95 57.76 1y8b s SER 687 Cb 0.08 -2.17 1.25 0.00 -1.71 0.00 0.00 66.02 63.47 1y8b s SER 687 CO 0.02 0.22 1.83 0.00 1.20 0.00 0.00 173.24 176.51 1y8b h ALA 689 N 3.17 1.64 -0.98 0.00 0.00 -1.92 -2.25 119.26 118.92 1y8b h ALA 689 Ca 0.00 -0.14 0.17 0.00 0.00 0.00 0.00 54.91 54.94 1y8b h ALA 689 Cb 0.23 -0.08 -0.10 0.00 0.00 0.00 0.00 17.79 17.84 1y8b h ALA 689 CO 0.00 0.27 0.59 0.35 0.00 0.00 0.00 179.25 180.46 1y8b h PHE 690 N 0.22 1.04 -0.12 0.00 3.04 -1.84 0.63 116.94 119.91 1y8b h PHE 690 Ca 0.05 0.03 0.03 0.00 3.98 0.00 0.00 57.97 62.07 1y8b h PHE 690 Cb 0.23 -0.31 -0.00 0.00 2.56 0.00 0.00 35.95 38.42 1y8b h PHE 690 CO 0.00 0.27 0.13 -0.22 -2.02 0.00 0.00 178.31 176.48 1y8b h LYS 691 N 0.79 0.00 -0.55 1.11 3.64 -1.66 -2.22 116.57 117.68 1y8b h LYS 691 Ca 0.55 0.00 0.11 0.00 -1.27 0.00 0.00 60.65 60.04 1y8b h LYS 691 Cb 0.78 0.00 -0.11 0.00 -0.41 0.00 0.00 32.23 32.49 1y8b h LYS 691 CO -0.36 0.00 -0.16 0.00 -2.27 0.00 0.00 179.45 176.66 1y8b h ALA 692 N 1.85 0.31 -1.13 5.00 0.00 0.16 0.50 119.26 125.95 1y8b h ALA 692 Ca 0.06 0.21 0.32 0.00 0.00 0.00 0.00 54.91 55.50 1y8b h ALA 692 Cb 0.32 0.46 -0.10 0.00 0.00 0.00 0.00 17.79 18.47 1y8b h ALA 692 CO -0.00 -0.47 0.73 0.00 0.00 0.00 0.00 179.25 179.51 1y8b h ALA 693 N 1.47 2.41 0.21 0.00 0.00 -1.53 0.24 119.26 122.06 1y8b h ALA 693 Ca 0.26 0.08 -0.34 0.00 0.00 0.00 0.00 54.91 54.91 1y8b h ALA 693 Cb 0.43 0.09 0.02 0.00 0.00 0.00 0.00 17.79 18.33 1y8b h ALA 693 CO -0.58 -0.89 -1.57 0.77 0.00 0.00 0.00 179.25 176.98 1y8b h SER 694 N 0.28 0.70 -0.82 0.00 0.02 -0.29 -3.32 113.55 110.12 1y8b h SER 694 Ca 0.67 -0.85 0.20 0.00 -0.84 0.00 0.00 61.79 60.96 1y8b h SER 694 Cb 1.87 -0.23 -0.13 0.00 0.14 0.00 0.00 62.40 64.06 1y8b h SER 694 CO -0.33 1.69 0.20 0.44 -1.14 0.00 0.00 176.83 177.69 1y8b h ASP 695 N 0.12 -0.00 -0.47 3.07 5.19 0.19 1.04 116.42 125.57 1y8b h ASP 695 Ca -0.28 0.17 0.13 0.00 -0.62 0.00 0.00 57.03 56.44 1y8b h ASP 695 Cb 2.12 0.24 -0.02 0.00 0.18 0.00 0.00 39.33 41.85 1y8b h ASP 695 CO 0.23 -0.10 0.39 -0.07 -3.12 0.00 0.00 179.24 176.57 1y8b h LEU 696 N 0.24 0.00 0.12 1.55 3.38 -1.53 0.15 115.31 119.22 1y8b h LEU 696 Ca 0.49 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 58.15 1y8b h LEU 696 Cb 0.91 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.65 1y8b h LEU 696 CO -0.59 0.00 -1.52 0.40 0.09 0.00 0.00 178.44 176.82 1y8b h ILE 697 N 0.00 1.17 0.04 1.22 2.04 0.94 -2.51 117.51 120.41 1y8b h ILE 697 Ca 0.22 -2.80 -0.00 0.00 1.00 0.00 0.00 64.86 63.28 1y8b h ILE 697 Cb 0.99 2.77 0.00 0.00 -0.74 0.00 0.00 36.82 39.84 1y8b h ILE 697 CO -0.00 0.82 -0.02 -0.26 0.00 0.00 0.00 178.15 178.69 1y8b h PHE 698 N 0.07 -0.05 0.00 1.37 0.04 -0.24 -3.30 116.94 114.83 1y8b h PHE 698 Ca -0.24 -0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.53 1y8b h PHE 698 Cb 2.02 0.02 0.00 0.00 2.20 0.00 0.00 35.95 40.18 1y8b h PHE 698 CO 0.06 0.55 0.00 -0.07 -0.60 0.00 0.00 178.31 178.26 1y8b h LEU 699 N -0.94 0.00 0.00 1.54 4.07 -0.97 -2.94 115.31 116.07 1y8b h LEU 699 Ca -0.01 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.95 1y8b h LEU 699 Cb 0.62 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.36 1y8b h LEU 699 CO 0.01 0.00 0.00 0.61 -1.08 0.00 0.00 178.44 177.98 1y8b n GLY 700 N 0.24 -0.33 0.10 0.83 0.00 -0.95 -2.06 105.19 103.02 1y8b n GLY 700 Ca 0.01 -0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.09 1y8b n GLY 700 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1y8b n VAL 701 N -0.50 0.84 -0.04 1.61 0.24 -1.11 -4.34 118.33 115.03 1y8b n VAL 701 Ca 0.00 -0.62 0.00 0.00 -2.04 0.00 0.00 64.34 61.68 1y8b n VAL 701 Cb 0.00 -0.49 0.00 0.00 -1.47 0.00 0.00 33.84 31.88 1y8b n VAL 701 CO 0.00 0.00 0.00 2.29 -2.14 0.00 0.00 176.83 176.98 1y8b n LYS 702 N -2.74 4.25 -1.50 7.34 2.85 -0.87 -5.06 118.16 122.43 1y8b n LYS 702 Ca -0.06 -0.07 -0.37 0.00 -1.05 0.00 0.00 58.31 56.77 1y8b n LYS 702 Cb 0.70 -0.47 0.06 0.00 -0.65 0.00 0.00 35.03 34.67 1y8b n LYS 702 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 177.40 178.39 1y8b n GLN 703 N -0.63 0.68 -1.82 -1.58 1.13 -1.00 -4.85 117.38 109.31 1y8b n GLN 703 Ca 0.00 0.28 -0.42 0.00 -1.94 0.00 0.00 57.00 54.92 1y8b n GLN 703 Cb 0.01 -2.09 -0.03 0.00 0.11 0.00 0.00 30.24 28.24 1y8b n GLN 703 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 1y8b s PRO 704 N -2.84 4.17 -0.49 -1.09 0.04 -1.26 -2.50 135.00 131.02 1y8b s PRO 704 Ca 0.74 2.48 -0.01 0.00 0.04 0.00 0.00 61.00 64.26 1y8b s PRO 704 Cb -0.39 -3.37 0.00 0.00 0.04 0.00 0.00 34.50 30.78 1y8b s PRO 704 CO 0.49 -0.74 0.02 0.09 0.04 0.00 0.00 177.00 176.90 1y8b n ASN 705 N 4.85 -2.28 -0.02 6.66 3.02 -1.26 0.22 115.26 126.44 1y8b n ASN 705 Ca 0.16 0.33 -0.00 0.00 -0.03 0.00 0.00 54.58 55.04 1y8b n ASN 705 Cb 0.38 -2.02 -0.00 0.00 -0.61 0.00 0.00 39.78 37.53 1y8b n ASN 705 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1y8b n GLY 706 N -0.65 0.33 3.57 7.41 0.00 -1.04 -4.91 105.19 109.90 1y8b n GLY 706 Ca -0.06 -0.02 -0.32 0.00 0.00 0.00 0.00 46.02 45.62 1y8b n GLY 706 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1y8b s TYR 707 N -1.63 2.13 -2.42 1.61 2.02 0.59 -4.64 117.35 115.00 1y8b s TYR 707 Ca 0.00 -0.01 0.22 0.00 -0.37 0.00 0.00 57.07 56.91 1y8b s TYR 707 Cb 0.00 -4.23 0.51 0.00 -0.40 0.00 0.00 41.96 37.84 1y8b s TYR 707 CO 0.00 -1.55 1.44 -2.37 -1.57 0.00 0.00 175.55 171.50 1y8b n THR 708 N 7.47 0.42 -0.03 -0.71 5.66 -1.26 -4.37 114.28 121.45 1y8b n THR 708 Ca 0.43 -0.63 -0.10 0.00 -3.05 0.00 0.00 64.05 60.69 1y8b n THR 708 Cb 0.47 0.81 -0.04 0.00 -1.55 0.00 0.00 70.33 70.02 1y8b n THR 708 CO 0.00 0.00 0.00 -0.33 -3.05 0.00 0.00 175.07 171.69 1y8b h GLU 709 N 3.83 0.23 -0.58 1.09 3.07 -1.90 -2.56 114.58 117.75 1y8b h GLU 709 Ca 0.00 -0.02 0.17 0.00 -0.50 0.00 0.00 59.36 59.01 1y8b h GLU 709 Cb 0.84 -0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 28.68 1y8b h GLU 709 CO 0.00 0.19 1.09 -1.00 -1.40 0.00 0.00 179.01 177.88 1y8b h PRO 710 N 0.21 0.00 0.04 2.33 0.13 -1.90 0.55 132.00 133.35 1y8b h PRO 710 Ca 0.06 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.19 1y8b h PRO 710 Cb 0.01 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.14 1y8b h PRO 710 CO -0.01 0.00 -0.02 -0.07 -0.23 0.00 0.00 178.00 177.67 1y8b h LEU 711 N 0.00 -0.04 -0.22 1.56 3.38 -1.78 -2.88 115.31 115.33 1y8b h LEU 711 Ca 0.28 -0.44 0.03 0.00 0.09 0.00 0.00 57.88 57.84 1y8b h LEU 711 Cb 2.45 0.01 -0.07 0.00 0.09 0.00 0.00 40.66 43.14 1y8b h LEU 711 CO -0.00 0.66 -0.52 0.25 0.09 0.00 0.00 178.44 178.92 1y8b h LEU 712 N -0.98 -1.68 -0.48 1.67 6.46 -1.00 -0.86 115.31 118.44 1y8b h LEU 712 Ca -0.00 0.21 0.09 0.00 -0.12 0.00 0.00 57.88 58.05 1y8b h LEU 712 Cb 0.48 0.67 -0.08 0.00 -0.73 0.00 0.00 40.66 41.00 1y8b h LEU 712 CO 0.01 -0.43 0.02 -0.74 -0.62 0.00 0.00 178.44 176.67 1y8b h HIS 713 N -0.49 0.00 -0.97 1.25 2.76 -1.70 0.98 115.15 116.98 1y8b h HIS 713 Ca 0.04 0.03 0.22 0.00 -2.20 0.00 0.00 60.37 58.46 1y8b h HIS 713 Cb 0.62 0.07 -0.08 0.00 1.55 0.00 0.00 27.41 29.56 1y8b h HIS 713 CO -0.63 -0.09 0.62 0.00 -1.30 0.00 0.00 177.93 176.53 1y8b h ALA 714 N 1.41 2.09 0.00 5.26 0.00 -1.00 0.53 119.26 127.55 1y8b h ALA 714 Ca 0.24 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 55.11 1y8b h ALA 714 Cb 0.35 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1y8b h ALA 714 CO -0.38 -0.43 -0.37 -1.49 0.00 0.00 0.00 179.25 176.59 1y8b h TRP 715 N 0.49 0.00 -0.20 0.00 4.06 0.46 -3.24 115.95 117.52 1y8b h TRP 715 Ca 0.53 0.00 -0.18 0.00 2.06 0.00 0.00 58.89 61.30 1y8b h TRP 715 Cb 1.20 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.36 1y8b h TRP 715 CO -0.00 0.37 -0.57 0.00 -3.56 0.00 0.00 178.44 174.67 1y8b h ARG 716 N 0.00 0.74 -0.20 0.49 3.08 0.11 -2.85 114.38 115.74 1y8b h ARG 716 Ca -0.00 -0.53 0.06 0.00 0.07 0.00 0.00 59.98 59.58 1y8b h ARG 716 Cb 1.14 0.09 -0.01 0.00 0.08 0.00 0.00 29.97 31.27 1y8b h ARG 716 CO 0.05 1.15 0.54 -0.07 -1.07 0.00 0.00 179.97 180.57 1y8b h LEU 717 N 0.46 0.00 0.00 3.04 3.38 -1.38 1.25 115.31 122.05 1y8b h LEU 717 Ca -0.02 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.87 1y8b h LEU 717 Cb 1.19 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.93 1y8b h LEU 717 CO 0.12 0.00 -0.75 0.03 0.09 0.00 0.00 178.44 177.93 1y8b h ARG 718 N 0.00 0.00 -0.10 1.13 3.08 -1.65 -2.80 114.38 114.04 1y8b h ARG 718 Ca 0.10 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.09 1y8b h ARG 718 Cb 1.18 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.23 1y8b h ARG 718 CO -0.00 0.27 -0.16 1.49 -1.07 0.00 0.00 179.97 180.50 1y8b h GLU 719 N 0.00 0.28 -0.14 0.04 4.22 0.15 -3.15 114.58 115.99 1y8b h GLU 719 Ca -0.05 -0.17 -0.21 0.00 0.08 0.00 0.00 59.36 59.01 1y8b h GLU 719 Cb 1.30 0.02 0.01 0.00 0.50 0.00 0.00 28.75 30.58 1y8b h GLU 719 CO 0.04 0.75 -0.73 0.87 -2.18 0.00 0.00 179.01 177.75 1y8b h LYS 720 N -0.15 0.74 -1.18 1.92 1.57 -1.64 -3.06 116.57 114.77 1y8b h LYS 720 Ca 0.01 -0.61 0.33 0.00 -1.87 0.00 0.00 60.65 58.51 1y8b h LYS 720 Cb 0.72 0.13 -0.07 0.00 0.08 0.00 0.00 32.23 33.09 1y8b h LYS 720 CO 0.04 1.22 0.81 1.49 -0.57 0.00 0.00 179.45 182.44 1y8b h GLU 721 N 0.45 0.13 0.04 3.15 4.81 -1.54 0.29 114.58 121.91 1y8b h GLU 721 Ca -0.05 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.17 1y8b h GLU 721 Cb 1.37 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.72 1y8b h GLU 721 CO 0.15 0.09 -0.02 1.03 -0.73 0.00 0.00 179.01 179.53 1y8b h SER 722 N 0.14 -0.04 0.00 1.04 0.87 -1.49 -3.51 113.55 110.56 1y8b h SER 722 Ca 0.61 -0.61 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1y8b h SER 722 Cb 2.10 0.01 0.00 0.00 -0.44 0.00 0.00 62.40 64.07 1y8b h SER 722 CO -0.14 0.63 0.00 1.57 -0.53 0.00 0.00 176.83 178.36