#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y8b n ALA 2 N 0.00 -1.48 -2.59 3.17 0.00 -1.26 -5.09 120.51 113.25 1y8b n ALA 2 Ca 0.00 -1.30 -0.42 0.00 0.00 0.00 0.00 53.44 51.72 1y8b n ALA 2 Cb 0.00 -1.50 -0.03 0.00 0.00 0.00 0.00 19.45 17.93 1y8b n ALA 2 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1y8b s GLN 3 N 0.53 3.41 0.01 0.00 -0.44 -1.26 -4.92 119.66 116.99 1y8b s GLN 3 Ca 0.29 0.05 -0.29 0.00 -2.50 0.00 0.00 55.36 52.91 1y8b s GLN 3 Cb 0.24 -4.06 0.11 0.00 -1.64 0.00 0.00 33.01 27.66 1y8b s GLN 3 CO -0.19 -1.78 1.24 -0.08 0.50 0.00 0.00 175.29 174.99 1y8b s THR 4 N 5.01 0.00 -0.03 -0.34 -1.32 -1.26 -4.96 115.64 112.74 1y8b s THR 4 Ca 0.39 -0.27 0.05 0.00 -1.21 0.00 0.00 61.69 60.65 1y8b s THR 4 Cb -0.08 -2.30 -0.03 0.00 -1.51 0.00 0.00 72.50 68.58 1y8b s THR 4 CO 0.22 0.00 -0.17 -0.51 -2.21 0.00 0.00 174.62 171.95 1y8b s ILE 5 N -2.37 2.86 -0.48 5.08 1.10 -1.21 -5.01 121.20 121.17 1y8b s ILE 5 Ca 0.18 -0.86 -0.16 0.00 -0.51 0.00 0.00 60.65 59.30 1y8b s ILE 5 Cb 0.03 -2.12 0.07 0.00 0.15 0.00 0.00 42.46 40.59 1y8b s ILE 5 CO -0.02 0.55 0.44 -0.89 -2.11 0.00 0.00 174.94 172.91 1y8b s THR 6 N -0.75 5.18 -0.19 4.00 2.01 -1.26 -2.85 115.64 121.78 1y8b s THR 6 Ca 0.12 -1.00 -0.25 0.00 0.31 0.00 0.00 61.69 60.87 1y8b s THR 6 Cb -0.10 -4.17 -0.01 0.00 0.01 0.00 0.00 72.50 68.23 1y8b s THR 6 CO 0.01 -0.63 0.83 -1.58 -0.69 0.00 0.00 174.62 172.56 1y8b s GLN 7 N 1.80 4.27 2.33 4.92 2.00 0.23 -4.78 119.66 130.42 1y8b s GLN 7 Ca 0.06 1.01 0.00 0.00 -2.00 0.00 0.00 55.36 54.42 1y8b s GLN 7 Cb -0.24 -3.59 0.00 0.00 0.80 0.00 0.00 33.01 29.98 1y8b s GLN 7 CO 0.07 -0.37 0.00 0.43 -0.50 0.00 0.00 175.29 174.92 1y8b n SER 8 N 5.41 0.00 0.00 6.67 7.64 -1.26 -0.16 113.62 131.92 1y8b n SER 8 Ca 0.05 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.93 1y8b n SER 8 Cb 0.48 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.68 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 5.02 -3.62 1.43 0.63 -1.26 -5.04 116.66 113.82 1y8b n ARG 9 Ca 0.00 -0.01 -0.27 0.00 -0.92 0.00 0.00 57.85 56.65 1y8b n ARG 9 Cb 0.00 -0.39 -0.03 0.00 0.45 0.00 0.00 32.46 32.49 1y8b n ARG 9 CO 0.00 0.00 0.00 -1.17 -2.51 0.00 0.00 177.63 173.95 1y8b s LEU 10 N -1.44 4.18 0.27 6.15 2.96 0.77 -4.00 118.68 127.56 1y8b s LEU 10 Ca 0.00 0.43 0.06 0.00 -0.22 0.00 0.00 54.13 54.40 1y8b s LEU 10 Cb 0.00 -3.22 -0.03 0.00 0.50 0.00 0.00 46.19 43.44 1y8b s LEU 10 CO 0.00 -0.10 0.31 -0.13 -1.32 0.00 0.00 176.35 175.11 1y8b s ARG 11 N -3.54 3.14 -0.07 1.98 3.00 -1.13 -0.60 118.95 121.72 1y8b s ARG 11 Ca 0.39 -0.95 -0.30 0.00 0.00 0.00 0.00 55.73 54.87 1y8b s ARG 11 Cb -0.11 -2.72 0.09 0.00 0.00 0.00 0.00 34.95 32.21 1y8b s ARG 11 CO 0.30 0.34 0.79 0.96 0.00 0.00 0.00 175.30 177.70 1y8b s ILE 12 N -2.09 0.00 -0.16 1.52 -4.36 -1.13 -4.58 121.20 110.40 1y8b s ILE 12 Ca 0.36 0.00 -0.28 0.00 -0.26 0.00 0.00 60.65 60.47 1y8b s ILE 12 Cb -0.08 -1.00 -0.01 0.00 1.25 0.00 0.00 42.46 42.62 1y8b s ILE 12 CO 0.28 0.00 0.95 -1.81 0.24 0.00 0.00 174.94 174.59 1y8b s ASP 13 N -1.32 7.10 0.19 4.36 1.01 -1.26 -3.30 116.67 123.46 1y8b s ASP 13 Ca -0.06 1.36 -0.19 0.00 0.71 0.00 0.00 52.55 54.36 1y8b s ASP 13 Cb -0.00 -2.51 0.14 0.00 1.01 0.00 0.00 42.92 41.55 1y8b s ASP 13 CO 0.05 -0.48 1.60 0.00 0.21 0.00 0.00 175.17 176.54 1y8b h ALA 14 N 7.27 0.04 -0.30 5.23 0.00 -1.93 -0.14 119.26 129.44 1y8b h ALA 14 Ca -0.27 0.17 0.07 0.00 0.00 0.00 0.00 54.91 54.88 1y8b h ALA 14 Cb 1.12 0.69 -0.07 0.00 0.00 0.00 0.00 17.79 19.53 1y8b h ALA 14 CO 0.88 -0.62 -0.20 -0.91 0.00 0.00 0.00 179.25 178.39 1y8b h ASN 15 N -0.14 -0.66 -0.49 0.00 2.35 -1.97 -1.12 115.58 113.54 1y8b h ASN 15 Ca 0.24 0.14 0.09 0.00 -0.55 0.00 0.00 56.30 56.22 1y8b h ASN 15 Cb 0.53 0.34 -0.10 0.00 0.05 0.00 0.00 38.32 39.13 1y8b h ASN 15 CO -0.64 -0.24 -0.29 0.15 -1.65 0.00 0.00 177.43 174.76 1y8b h PHE 16 N -0.17 -0.78 0.07 1.19 3.04 -1.39 1.04 116.94 119.95 1y8b h PHE 16 Ca 0.16 0.06 0.02 0.00 3.98 0.00 0.00 57.97 62.19 1y8b h PHE 16 Cb 0.42 0.42 -0.03 0.00 2.56 0.00 0.00 35.95 39.31 1y8b h PHE 16 CO -0.39 -0.36 -0.22 -0.22 -2.02 0.00 0.00 178.31 175.10 1y8b h LYS 17 N -0.17 -0.37 0.63 1.11 3.64 -0.63 0.22 116.57 120.99 1y8b h LYS 17 Ca 0.21 0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.59 1y8b h LYS 17 Cb 0.52 0.08 0.01 0.00 -0.41 0.00 0.00 32.23 32.43 1y8b h LYS 17 CO -0.59 -0.25 -0.30 0.00 -2.27 0.00 0.00 179.45 176.04 1y8b h ARG 18 N -0.38 -0.81 -1.03 1.90 2.47 -0.06 1.45 114.38 117.92 1y8b h ARG 18 Ca 0.04 0.06 0.29 0.00 -1.26 0.00 0.00 59.98 59.11 1y8b h ARG 18 Cb 0.43 0.18 -0.13 0.00 -1.65 0.00 0.00 29.97 28.80 1y8b h ARG 18 CO -0.15 -0.54 0.61 0.35 0.56 0.00 0.00 179.97 180.80 1y8b h PHE 19 N -0.98 0.90 0.00 3.04 3.57 0.11 2.35 116.94 125.94 1y8b h PHE 19 Ca -0.09 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.38 1y8b h PHE 19 Cb 0.65 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 39.13 1y8b h PHE 19 CO 0.05 -0.06 -0.40 0.28 -2.23 0.00 0.00 178.31 175.95 1y8b h VAL 20 N 0.42 1.32 0.00 1.41 2.07 -0.40 -2.38 116.25 118.69 1y8b h VAL 20 Ca 0.69 -2.14 -0.01 0.00 0.82 0.00 0.00 66.70 66.06 1y8b h VAL 20 Cb 1.54 2.64 -0.00 0.00 -1.52 0.00 0.00 31.29 33.95 1y8b h VAL 20 CO -0.50 0.45 -0.03 -0.78 0.02 0.00 0.00 177.57 176.73 1y8b h ASP 21 N -1.00 0.00 0.24 0.57 3.58 0.28 0.25 116.42 120.34 1y8b h ASP 21 Ca -0.11 0.00 -0.34 0.00 0.42 0.00 0.00 57.03 57.00 1y8b h ASP 21 Cb 0.99 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 42.01 1y8b h ASP 21 CO -0.06 0.03 -1.96 1.21 -2.88 0.00 0.00 179.24 175.57 1y8b n GLU 22 N -3.14 0.70 -0.06 0.28 4.07 0.79 -4.07 120.64 119.21 1y8b n GLU 22 Ca 0.00 0.25 -0.07 0.00 -0.06 0.00 0.00 57.16 57.28 1y8b n GLU 22 Cb 0.29 -1.71 -0.07 0.00 -0.06 0.00 0.00 31.44 29.90 1y8b n GLU 22 CO 0.00 0.00 0.00 -1.91 -0.06 0.00 0.00 177.13 175.16 1y8b n GLU 23 N -3.25 1.17 -0.03 5.31 2.13 -0.89 -4.65 120.64 120.43 1y8b n GLU 23 Ca -0.28 0.04 -0.01 0.00 0.66 0.00 0.00 57.16 57.57 1y8b n GLU 23 Cb 1.05 -1.25 -0.00 0.00 0.27 0.00 0.00 31.44 31.51 1y8b n GLU 23 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 1y8b h VAL 24 N 0.00 0.00 -0.76 6.31 2.07 -0.65 -3.25 116.25 119.97 1y8b h VAL 24 Ca -0.27 -0.56 0.06 0.00 0.82 0.00 0.00 66.70 66.75 1y8b h VAL 24 Cb 1.50 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 31.21 1y8b h VAL 24 CO -0.02 0.00 0.45 -0.07 0.02 0.00 0.00 177.57 177.95 1y8b h LEU 25 N -0.56 0.70 0.46 2.57 3.38 -1.41 0.22 115.31 120.66 1y8b h LEU 25 Ca 0.00 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1y8b h LEU 25 Cb 0.13 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.76 1y8b h LEU 25 CO 0.00 0.45 -0.22 -0.65 0.09 0.00 0.00 178.44 178.11 1y8b h PRO 26 N 0.83 -0.59 0.00 1.13 0.11 -1.78 -1.93 132.00 129.77 1y8b h PRO 26 Ca 0.33 0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.48 1y8b h PRO 26 Cb 0.17 0.14 0.00 0.00 0.11 0.00 0.00 31.00 31.42 1y8b h PRO 26 CO -0.17 -0.29 0.00 0.41 -0.21 0.00 0.00 178.00 177.74 1y8b n GLY 27 N -0.56 -1.23 1.16 -0.55 0.00 -1.19 -2.27 105.19 100.54 1y8b n GLY 27 Ca -0.11 -0.02 0.12 0.00 0.00 0.00 0.00 46.02 46.01 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 -1.80 0.59 0.00 2.61 -1.04 0.76 -4.94 114.28 110.46 1y8b n THR 28 Ca 0.04 -0.80 0.00 0.00 -2.04 0.00 0.00 64.05 61.25 1y8b n THR 28 Cb 0.24 0.90 0.00 0.00 -1.82 0.00 0.00 70.33 69.65 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 1.48 1.35 3.12 3.41 0.00 -0.76 -4.78 105.19 109.00 1y8b n GLY 29 Ca 0.20 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.86 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 -3.19 -4.66 0.99 4.77 -0.98 -4.89 117.00 109.05 1y8b n LEU 30 Ca 0.00 0.05 -0.24 0.00 -0.03 0.00 0.00 56.01 55.78 1y8b n LEU 30 Cb 0.00 -0.76 -0.07 0.00 -2.33 0.00 0.00 43.42 40.26 1y8b n LEU 30 CO 0.00 -3.59 -0.32 -1.81 -1.33 0.00 0.00 177.39 170.34 1y8b s ASP 31 N -1.33 4.67 0.04 -1.43 1.11 -1.26 -4.43 116.67 114.03 1y8b s ASP 31 Ca 0.44 -0.52 -0.20 0.00 0.18 0.00 0.00 52.55 52.45 1y8b s ASP 31 Cb -0.05 -0.93 -0.15 0.00 1.07 0.00 0.00 42.92 42.86 1y8b s ASP 31 CO 0.70 0.04 1.32 0.00 1.18 0.00 0.00 175.17 178.41 1y8b h ALA 32 N 2.24 0.21 0.44 5.23 0.00 -1.93 -2.70 119.26 122.75 1y8b h ALA 32 Ca -0.46 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.08 1y8b h ALA 32 Cb 1.23 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1y8b h ALA 32 CO 0.59 0.13 -0.21 0.00 0.00 0.00 0.00 179.25 179.75 1y8b h ALA 33 N 0.59 -0.59 -0.85 0.00 0.00 -1.98 -2.42 119.26 114.00 1y8b h ALA 33 Ca 0.02 -0.17 0.22 0.00 0.00 0.00 0.00 54.91 54.97 1y8b h ALA 33 Cb 0.73 0.23 -0.14 0.00 0.00 0.00 0.00 17.79 18.60 1y8b h ALA 33 CO 0.04 -0.60 0.14 0.00 0.00 0.00 0.00 179.25 178.83 1y8b h ALA 34 N -0.86 1.12 0.00 0.00 0.00 -1.99 1.09 119.26 118.62 1y8b h ALA 34 Ca -0.06 0.24 -0.04 0.00 0.00 0.00 0.00 54.91 55.05 1y8b h ALA 34 Cb 0.54 0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 1y8b h ALA 34 CO 0.10 -0.47 -0.19 0.35 0.00 0.00 0.00 179.25 179.04 1y8b h PHE 35 N 0.15 0.00 0.00 0.00 3.57 -1.49 -2.48 116.94 116.70 1y8b h PHE 35 Ca 0.52 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 62.00 1y8b h PHE 35 Cb 1.01 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.75 1y8b h PHE 35 CO -0.34 0.19 -0.19 -1.49 -2.23 0.00 0.00 178.31 174.25 1y8b h TRP 36 N 0.00 0.00 0.18 0.41 -0.00 0.17 -2.65 115.95 114.05 1y8b h TRP 36 Ca -0.00 0.00 -0.30 0.00 -0.00 0.00 0.00 58.89 58.59 1y8b h TRP 36 Cb 0.58 0.00 0.02 0.00 -0.00 0.00 0.00 29.16 29.76 1y8b h TRP 36 CO 0.00 0.08 -1.37 -0.09 -0.00 0.00 0.00 178.44 177.07 1y8b h ARG 37 N 0.00 0.38 0.00 0.49 2.43 -0.68 -3.10 114.38 113.90 1y8b h ARG 37 Ca -0.00 -0.64 -0.17 0.00 -0.81 0.00 0.00 59.98 58.36 1y8b h ARG 37 Cb 1.06 0.24 -0.03 0.00 -0.42 0.00 0.00 29.97 30.83 1y8b h ARG 37 CO 0.01 1.30 -1.13 -2.95 -1.51 0.00 0.00 179.97 175.69 1y8b h ASN 38 N 0.10 0.00 0.29 -3.80 -1.07 -1.62 -3.11 115.58 106.37 1y8b h ASN 38 Ca -0.19 0.00 -0.01 0.00 0.07 0.00 0.00 56.30 56.16 1y8b h ASN 38 Cb 2.05 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 38.31 1y8b h ASN 38 CO 0.23 0.66 -0.14 0.15 0.07 0.00 0.00 177.43 178.40 1y8b h PHE 39 N 0.00 -0.36 -0.40 4.14 3.57 -1.58 -1.77 116.94 120.54 1y8b h PHE 39 Ca -0.11 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.43 1y8b h PHE 39 Cb 1.60 0.12 -0.04 0.00 2.79 0.00 0.00 35.95 40.42 1y8b h PHE 39 CO 0.00 -0.22 0.15 0.22 -2.23 0.00 0.00 178.31 176.23 1y8b h ASP 40 N -0.90 0.17 0.54 0.41 1.82 -1.73 -0.63 116.42 116.11 1y8b h ASP 40 Ca -0.04 0.04 -0.03 0.00 -0.39 0.00 0.00 57.03 56.61 1y8b h ASP 40 Cb 0.30 0.02 0.00 0.00 0.68 0.00 0.00 39.33 40.33 1y8b h ASP 40 CO 0.07 0.14 -0.27 -0.08 -1.61 0.00 0.00 179.24 177.48 1y8b h GLU 41 N 0.32 -0.71 0.09 0.28 4.57 -1.66 -0.89 114.58 116.58 1y8b h GLU 41 Ca 0.18 0.05 0.01 0.00 -1.18 0.00 0.00 59.36 58.42 1y8b h GLU 41 Cb 0.15 0.16 -0.03 0.00 -0.16 0.00 0.00 28.75 28.88 1y8b h GLU 41 CO -0.18 -0.47 -0.33 0.82 -1.18 0.00 0.00 179.01 177.67 1y8b h ILE 42 N -0.74 0.00 -0.68 2.32 2.04 -1.27 -2.62 117.51 116.57 1y8b h ILE 42 Ca -0.07 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.89 1y8b h ILE 42 Cb 0.57 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 36.53 1y8b h ILE 42 CO 0.12 0.00 -0.41 0.58 0.00 0.00 0.00 178.15 178.44 1y8b h VAL 43 N -0.49 0.09 -0.89 1.67 2.07 -1.18 1.25 116.25 118.78 1y8b h VAL 43 Ca -0.01 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.67 1y8b h VAL 43 Cb 0.48 0.09 -0.16 0.00 -1.52 0.00 0.00 31.29 30.18 1y8b h VAL 43 CO -0.17 0.00 -0.29 0.45 0.02 0.00 0.00 177.57 177.58 1y8b h HIS 44 N -0.16 -0.73 0.00 1.57 3.86 -0.79 1.44 115.15 120.34 1y8b h HIS 44 Ca 0.22 0.09 -0.22 0.00 -1.16 0.00 0.00 60.37 59.30 1y8b h HIS 44 Cb 0.56 0.46 -0.04 0.00 1.06 0.00 0.00 27.41 29.45 1y8b h HIS 44 CO -0.74 -0.39 -1.29 0.38 0.86 0.00 0.00 177.93 176.75 1y8b h ASP 45 N -0.02 0.00 0.03 2.45 2.03 -0.80 -3.36 116.42 116.75 1y8b h ASP 45 Ca 0.38 0.00 -0.22 0.00 -0.73 0.00 0.00 57.03 56.46 1y8b h ASP 45 Cb 0.63 0.00 0.02 0.00 -0.83 0.00 0.00 39.33 39.14 1y8b h ASP 45 CO -0.91 0.85 -0.89 -0.07 -1.03 0.00 0.00 179.24 177.19 1y8b h LEU 46 N 0.00 0.72 0.16 0.15 -0.00 0.34 -3.30 115.31 113.39 1y8b h LEU 46 Ca -0.14 -0.78 0.01 0.00 -0.00 0.00 0.00 57.88 56.96 1y8b h LEU 46 Cb 1.78 -0.22 -0.04 0.00 -0.00 0.00 0.00 40.66 42.17 1y8b h LEU 46 CO 0.09 1.42 -0.48 0.00 -0.00 0.00 0.00 178.44 179.46 1y8b h ALA 47 N 0.32 -0.98 0.00 1.53 0.00 0.17 -0.45 119.26 119.85 1y8b h ALA 47 Ca -0.12 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1y8b h ALA 47 Cb 1.59 0.84 0.00 0.00 0.00 0.00 0.00 17.79 20.21 1y8b h ALA 47 CO 0.17 -1.09 0.31 -1.00 0.00 0.00 0.00 179.25 177.65 1y8b h PRO 48 N -0.72 0.00 0.16 0.00 0.13 -1.70 -0.53 132.00 129.34 1y8b h PRO 48 Ca -0.01 0.00 -0.34 0.00 -0.87 0.00 0.00 66.00 64.77 1y8b h PRO 48 Cb 0.70 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.84 1y8b h PRO 48 CO -0.23 0.00 -1.76 0.93 -0.23 0.00 0.00 178.00 176.71 1y8b h GLU 49 N 0.00 0.35 -0.98 0.86 4.39 -1.16 -3.32 114.58 114.72 1y8b h GLU 49 Ca 0.00 -0.59 0.02 0.00 0.34 0.00 0.00 59.36 59.13 1y8b h GLU 49 Cb 0.62 0.22 -0.05 0.00 -0.10 0.00 0.00 28.75 29.44 1y8b h GLU 49 CO 0.00 1.28 0.64 -0.91 -1.16 0.00 0.00 179.01 178.87 1y8b h ASN 50 N 0.03 1.09 0.42 1.42 -0.26 -0.72 -0.56 115.58 117.01 1y8b h ASN 50 Ca -0.36 -0.02 -0.01 0.00 -0.56 0.00 0.00 56.30 55.35 1y8b h ASN 50 Cb 2.03 -0.26 -0.00 0.00 -1.06 0.00 0.00 38.32 39.03 1y8b h ASN 50 CO 0.14 0.77 -0.07 0.08 -1.06 0.00 0.00 177.43 177.29 1y8b h ARG 51 N 1.28 0.00 0.55 0.81 -0.00 -1.68 -3.00 114.38 112.34 1y8b h ARG 51 Ca 0.37 0.00 -0.03 0.00 -0.00 0.00 0.00 59.98 60.33 1y8b h ARG 51 Cb -0.07 0.00 0.01 0.00 -0.00 0.00 0.00 29.97 29.90 1y8b h ARG 51 CO -0.10 0.07 -0.27 0.37 -0.00 0.00 0.00 179.97 180.04 1y8b h GLN 52 N 0.00 -0.72 -0.27 0.08 4.15 -1.19 -0.13 115.11 117.04 1y8b h GLN 52 Ca -0.00 0.05 0.08 0.00 0.77 0.00 0.00 58.65 59.55 1y8b h GLN 52 Cb 0.29 0.16 -0.01 0.00 0.21 0.00 0.00 27.48 28.14 1y8b h GLN 52 CO 0.01 -0.41 0.38 -0.07 -1.93 0.00 0.00 178.83 176.81 1y8b h LEU 53 N -1.00 0.00 0.00 -2.39 4.07 -1.52 2.05 115.31 116.53 1y8b h LEU 53 Ca -0.08 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.87 1y8b h LEU 53 Cb 0.64 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.38 1y8b h LEU 53 CO 0.13 0.00 -0.12 -0.07 -1.08 0.00 0.00 178.44 177.29 1y8b h LEU 54 N 0.00 0.00 -0.62 1.67 3.38 -1.40 -2.24 115.31 116.10 1y8b h LEU 54 Ca 0.13 -0.58 -0.13 0.00 0.09 0.00 0.00 57.88 57.39 1y8b h LEU 54 Cb 0.88 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.61 1y8b h LEU 54 CO -0.00 0.86 -0.63 0.00 0.09 0.00 0.00 178.44 178.76 1y8b h ALA 55 N -0.42 0.85 -0.17 1.53 0.00 -0.22 -2.91 119.26 117.92 1y8b h ALA 55 Ca -0.03 -0.57 -0.18 0.00 0.00 0.00 0.00 54.91 54.13 1y8b h ALA 55 Cb 0.66 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 1y8b h ALA 55 CO -0.02 0.78 -0.63 1.49 0.00 0.00 0.00 179.25 180.88 1y8b h GLU 56 N 0.00 0.61 0.00 0.00 4.81 0.32 -2.79 114.58 117.53 1y8b h GLU 56 Ca -0.01 -0.43 -0.03 0.00 -0.13 0.00 0.00 59.36 58.77 1y8b h GLU 56 Cb 1.19 0.07 -0.00 0.00 0.63 0.00 0.00 28.75 30.63 1y8b h GLU 56 CO 0.08 1.04 -0.13 0.00 -0.73 0.00 0.00 179.01 179.28 1y8b h ARG 57 N 0.45 0.00 -0.08 1.92 3.08 -1.31 -2.44 114.38 116.00 1y8b h ARG 57 Ca -0.01 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.95 1y8b h ARG 57 Cb 1.20 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.24 1y8b h ARG 57 CO 0.12 0.13 -0.36 -0.44 -1.07 0.00 0.00 179.97 178.35 1y8b h ASP 58 N 0.00 0.17 -0.18 7.04 3.32 -1.29 0.19 116.42 125.67 1y8b h ASP 58 Ca -0.00 -0.06 -0.17 0.00 0.02 0.00 0.00 57.03 56.82 1y8b h ASP 58 Cb 0.55 -0.05 0.01 0.00 0.22 0.00 0.00 39.33 40.06 1y8b h ASP 58 CO 0.02 0.52 -0.56 -0.09 -1.72 0.00 0.00 179.24 177.41 1y8b h ARG 59 N 0.14 0.69 0.08 3.56 1.12 -1.46 -0.14 114.38 118.38 1y8b h ARG 59 Ca 0.02 -0.50 -0.00 0.00 -1.11 0.00 0.00 59.98 58.38 1y8b h ARG 59 Cb 0.70 0.09 0.00 0.00 -0.01 0.00 0.00 29.97 30.75 1y8b h ARG 59 CO 0.05 1.12 -0.04 0.82 -3.11 0.00 0.00 179.97 178.82 1y8b h ILE 60 N 0.38 1.18 -0.16 1.20 1.08 -1.45 -1.87 117.51 117.87 1y8b h ILE 60 Ca -0.02 -1.23 0.02 0.00 -0.39 0.00 0.00 64.86 63.24 1y8b h ILE 60 Cb 1.18 1.94 -0.02 0.00 -3.07 0.00 0.00 36.82 36.84 1y8b h ILE 60 CO 0.12 0.29 0.03 -0.61 -0.69 0.00 0.00 178.15 177.28 1y8b h GLN 61 N -0.70 0.09 -1.00 2.37 4.15 -0.72 0.70 115.11 120.01 1y8b h GLN 61 Ca -0.01 -0.01 0.09 0.00 0.77 0.00 0.00 58.65 59.50 1y8b h GLN 61 Cb 0.56 -0.02 -0.08 0.00 0.21 0.00 0.00 27.48 28.15 1y8b h GLN 61 CO 0.02 0.06 0.63 0.00 -1.93 0.00 0.00 178.83 177.61 1y8b h ALA 62 N 1.11 1.45 -0.11 3.38 0.00 -1.07 0.12 119.26 124.14 1y8b h ALA 62 Ca 0.07 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.87 1y8b h ALA 62 Cb 0.06 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1y8b h ALA 62 CO -0.10 0.32 -0.42 0.00 0.00 0.00 0.00 179.25 179.06 1y8b h ALA 63 N 1.50 1.09 0.00 0.00 0.00 -0.44 -2.64 119.26 118.77 1y8b h ALA 63 Ca 0.46 -0.42 -0.11 0.00 0.00 0.00 0.00 54.91 54.85 1y8b h ALA 63 Cb 0.34 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1y8b h ALA 63 CO -0.22 0.60 -0.51 -0.07 0.00 0.00 0.00 179.25 179.05 1y8b h LEU 64 N 0.20 0.00 -1.84 0.00 4.07 0.11 -2.87 115.31 114.98 1y8b h LEU 64 Ca 0.02 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 57.97 1y8b h LEU 64 Cb 0.83 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.57 1y8b h LEU 64 CO 0.07 0.51 -0.01 0.44 -1.08 0.00 0.00 178.44 178.36 1y8b h ASP 65 N 0.00 0.00 0.00 -0.43 3.32 -0.48 -2.49 116.42 116.34 1y8b h ASP 65 Ca -0.01 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.04 1y8b h ASP 65 Cb 1.17 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.72 1y8b h ASP 65 CO 0.07 0.01 -0.04 -0.33 -1.72 0.00 0.00 179.24 177.23 1y8b h GLU 66 N 0.00 0.00 -0.78 3.56 4.39 -1.48 -2.27 114.58 118.00 1y8b h GLU 66 Ca -0.00 0.00 0.17 0.00 0.34 0.00 0.00 59.36 59.87 1y8b h GLU 66 Cb 0.39 0.00 -0.11 0.00 -0.10 0.00 0.00 28.75 28.93 1y8b h GLU 66 CO 0.00 0.13 0.28 -1.49 -1.16 0.00 0.00 179.01 176.77 1y8b h TRP 67 N -1.00 0.46 0.04 4.33 6.55 -1.56 2.03 115.95 126.80 1y8b h TRP 67 Ca -0.00 0.04 -0.00 0.00 0.95 0.00 0.00 58.89 59.87 1y8b h TRP 67 Cb 0.17 -0.08 0.00 0.00 -0.86 0.00 0.00 29.16 28.38 1y8b h TRP 67 CO 0.02 -0.02 -0.02 1.25 -1.05 0.00 0.00 178.44 178.63 1y8b h HIS 68 N 0.37 -0.05 -0.08 0.49 2.76 -1.57 0.33 115.15 117.40 1y8b h HIS 68 Ca 0.45 -0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.60 1y8b h HIS 68 Cb 0.75 0.02 -0.00 0.00 1.55 0.00 0.00 27.41 29.73 1y8b h HIS 68 CO -0.20 0.15 -0.01 -0.09 -1.30 0.00 0.00 177.93 176.48 1y8b h ARG 69 N -0.24 0.15 0.00 5.26 2.43 -0.50 -2.30 114.38 119.18 1y8b h ARG 69 Ca -0.01 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 1y8b h ARG 69 Cb 0.22 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.76 1y8b h ARG 69 CO 0.01 0.44 0.00 0.43 -1.51 0.00 0.00 179.97 179.33 1y8b n SER 70 N -4.82 0.57 -3.94 -3.80 7.64 0.67 -3.80 113.62 106.14 1y8b n SER 70 Ca -0.07 0.69 -0.30 0.00 1.01 0.00 0.00 58.87 60.21 1y8b n SER 70 Cb 0.21 -0.79 -0.12 0.00 -1.01 0.00 0.00 64.21 62.49 1y8b n SER 70 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 1y8b s ASN 71 N -4.06 4.71 0.23 6.43 3.84 0.11 -5.02 114.94 121.20 1y8b s ASN 71 Ca 0.02 -3.46 -0.30 0.00 0.21 0.00 0.00 52.86 49.33 1y8b s ASN 71 Cb 0.08 -1.67 -0.09 0.00 -0.55 0.00 0.00 41.25 39.02 1y8b s ASN 71 CO 0.29 -0.16 1.08 -2.16 -2.79 0.00 0.00 177.10 173.36 1y8b s PRO 72 N -0.91 4.64 0.61 0.43 0.04 -1.25 -4.72 135.00 133.85 1y8b s PRO 72 Ca 0.21 1.73 0.00 0.00 0.04 0.00 0.00 61.00 62.99 1y8b s PRO 72 Cb -0.14 -3.24 0.00 0.00 0.04 0.00 0.00 34.50 31.16 1y8b s PRO 72 CO -0.09 0.19 0.00 0.41 0.04 0.00 0.00 177.00 177.55 1y8b n GLY 73 N 1.59 -1.79 3.87 0.56 0.00 -1.26 -4.96 105.19 103.19 1y8b n GLY 73 Ca 0.00 -1.77 -0.31 0.00 0.00 0.00 0.00 46.02 43.95 1y8b n GLY 73 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1y8b s PRO 74 N 0.00 3.33 0.28 1.61 0.04 -1.26 -5.02 135.00 133.98 1y8b s PRO 74 Ca 0.00 0.70 -0.29 0.00 0.04 0.00 0.00 61.00 61.44 1y8b s PRO 74 Cb 0.00 -2.05 -0.10 0.00 0.04 0.00 0.00 34.50 32.39 1y8b s PRO 74 CO 0.00 -0.75 1.14 0.08 0.04 0.00 0.00 177.00 177.51 1y8b s VAL 75 N -3.21 3.36 -0.27 -0.36 1.01 -1.26 -4.93 120.40 114.74 1y8b s VAL 75 Ca 0.56 1.35 0.12 0.00 0.00 0.00 0.00 61.98 64.01 1y8b s VAL 75 Cb -0.11 -3.86 0.62 0.00 0.00 0.00 0.00 36.38 33.03 1y8b s VAL 75 CO 0.54 0.31 1.60 1.17 0.00 0.00 0.00 175.10 178.71 1y8b n LYS 76 N 1.25 3.04 -3.15 2.72 4.81 -1.26 -4.85 118.16 120.72 1y8b n LYS 76 Ca -0.00 -3.03 0.05 0.00 -0.87 0.00 0.00 58.31 54.45 1y8b n LYS 76 Cb 0.44 -2.00 -0.01 0.00 0.02 0.00 0.00 35.03 33.48 1y8b n LYS 76 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 1y8b s ASP 77 N -1.69 -1.08 0.04 3.14 -1.08 -1.26 -5.04 116.67 109.72 1y8b s ASP 77 Ca 0.48 0.44 -0.16 0.00 -0.52 0.00 0.00 52.55 52.80 1y8b s ASP 77 Cb 0.40 1.81 -0.28 0.00 -1.46 0.00 0.00 42.92 43.38 1y8b s ASP 77 CO 0.09 -0.20 1.09 0.50 0.52 0.00 0.00 175.17 177.17 1y8b h LYS 78 N 7.89 0.60 -0.69 4.34 3.11 -1.96 -2.42 116.57 127.43 1y8b h LYS 78 Ca -0.13 -0.78 -0.02 0.00 -2.81 0.00 0.00 60.65 56.90 1y8b h LYS 78 Cb 1.17 0.25 -0.03 0.00 -1.00 0.00 0.00 32.23 32.62 1y8b h LYS 78 CO 0.09 1.35 0.33 0.00 -2.81 0.00 0.00 179.45 178.41 1y8b h ALA 79 N 0.28 1.28 -0.03 5.00 0.00 -1.98 0.12 119.26 123.94 1y8b h ALA 79 Ca -0.17 -0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.49 1y8b h ALA 79 Cb 1.83 -0.28 0.01 0.00 0.00 0.00 0.00 17.79 19.35 1y8b h ALA 79 CO 0.22 0.55 -0.43 0.00 0.00 0.00 0.00 179.25 179.60 1y8b h ALA 80 N 1.39 0.09 0.60 0.00 0.00 -1.98 -2.14 119.26 117.22 1y8b h ALA 80 Ca 0.24 -0.50 -0.03 0.00 0.00 0.00 0.00 54.91 54.62 1y8b h ALA 80 Cb 0.10 0.01 0.01 0.00 0.00 0.00 0.00 17.79 17.91 1y8b h ALA 80 CO -0.03 0.24 -0.29 1.88 0.00 0.00 0.00 179.25 181.05 1y8b h TYR 81 N -0.20 -0.75 -0.95 0.00 -1.99 -1.27 -0.12 116.97 111.68 1y8b h TYR 81 Ca -0.05 -0.02 0.17 0.00 2.00 0.00 0.00 58.73 60.84 1y8b h TYR 81 Cb 1.13 0.25 -0.10 0.00 2.00 0.00 0.00 36.73 40.00 1y8b h TYR 81 CO 0.15 -0.42 0.55 -0.22 -0.00 0.00 0.00 178.16 178.22 1y8b h LYS 82 N -1.07 0.70 0.42 4.88 3.11 -0.90 0.01 116.57 123.72 1y8b h LYS 82 Ca -0.08 -0.04 -0.02 0.00 -2.81 0.00 0.00 60.65 57.69 1y8b h LYS 82 Cb 0.67 -0.16 0.00 0.00 -1.00 0.00 0.00 32.23 31.75 1y8b h LYS 82 CO 0.14 0.46 -0.20 0.77 -2.81 0.00 0.00 179.45 177.81 1y8b h SER 83 N 0.72 -0.48 -0.93 4.20 0.02 -1.19 0.45 113.55 116.34 1y8b h SER 83 Ca 0.54 -0.01 0.20 0.00 -0.84 0.00 0.00 61.79 61.68 1y8b h SER 83 Cb 0.81 0.12 -0.08 0.00 0.14 0.00 0.00 62.40 63.39 1y8b h SER 83 CO -0.38 -0.31 0.60 0.15 -1.14 0.00 0.00 176.83 175.76 1y8b h PHE 84 N -0.61 0.67 -0.05 3.45 3.57 0.42 -0.63 116.94 123.77 1y8b h PHE 84 Ca -0.06 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.43 1y8b h PHE 84 Cb 0.46 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 38.99 1y8b h PHE 84 CO -0.04 0.17 -0.11 -0.07 -2.23 0.00 0.00 178.31 176.04 1y8b h LEU 85 N 0.50 0.17 -0.92 0.59 3.38 -0.14 -0.47 115.31 118.42 1y8b h LEU 85 Ca 0.50 -0.58 0.26 0.00 0.09 0.00 0.00 57.88 58.14 1y8b h LEU 85 Cb 1.10 -0.05 -0.14 0.00 0.09 0.00 0.00 40.66 41.65 1y8b h LEU 85 CO -0.22 0.72 0.36 0.03 0.09 0.00 0.00 178.44 179.42 1y8b h ARG 86 N -0.37 0.26 0.00 1.13 3.08 0.14 9.16 114.38 127.78 1y8b h ARG 86 Ca -0.00 -0.02 -0.12 0.00 0.07 0.00 0.00 59.98 59.92 1y8b h ARG 86 Cb 0.70 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.67 1y8b h ARG 86 CO 0.02 0.17 -0.84 1.49 -1.07 0.00 0.00 179.97 179.75 1y8b h GLU 87 N 0.27 0.00 0.00 0.04 4.81 -1.39 -3.32 114.58 115.00 1y8b h GLU 87 Ca 0.61 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.84 1y8b h GLU 87 Cb 1.28 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.66 1y8b h GLU 87 CO -0.63 0.37 -1.00 -0.11 -0.73 0.00 0.00 179.01 176.92 1y8b n LEU 88 N -3.06 0.00 -1.03 1.64 7.94 1.00 -4.69 117.00 118.79 1y8b n LEU 88 Ca -0.02 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.88 1y8b n LEU 88 Cb 0.75 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.70 1y8b n LEU 88 CO 0.41 0.00 0.18 0.61 -1.11 0.00 0.00 177.39 177.48 1y8b n GLY 89 N 2.97 0.71 3.74 -3.96 0.00 2.88 -4.72 105.19 106.81 1y8b n GLY 89 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 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 0.87 -1.89 -3.98 1.61 4.01 -1.25 -4.88 117.16 111.65 1y8b n TYR 90 Ca 0.00 0.47 -0.30 0.00 -0.16 0.00 0.00 57.90 57.90 1y8b n TYR 90 Cb 0.17 -3.23 -0.16 0.00 -0.31 0.00 0.00 39.34 35.81 1y8b n TYR 90 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1y8b s LEU 91 N -6.30 2.32 0.11 7.72 1.02 -1.25 -4.84 118.68 117.46 1y8b s LEU 91 Ca 0.38 -0.94 0.05 0.00 0.02 0.00 0.00 54.13 53.64 1y8b s LEU 91 Cb -0.16 -1.21 -0.04 0.00 0.02 0.00 0.00 46.19 44.81 1y8b s LEU 91 CO 0.88 -0.16 -0.12 0.68 0.02 0.00 0.00 176.35 177.65 1y8b s VAL 92 N 1.40 1.12 0.34 -1.59 -7.23 -1.26 -4.79 120.40 108.40 1y8b s VAL 92 Ca -0.02 -1.65 -0.29 0.00 -1.81 0.00 0.00 61.98 58.22 1y8b s VAL 92 Cb -0.17 -1.41 -0.11 0.00 0.56 0.00 0.00 36.38 35.26 1y8b s VAL 92 CO -0.08 -0.47 1.45 -2.16 -0.31 0.00 0.00 175.10 173.53 1y8b s PRO 93 N -2.65 4.20 0.21 4.82 0.04 -1.26 -4.86 135.00 135.50 1y8b s PRO 93 Ca 0.06 2.45 -0.06 0.00 0.04 0.00 0.00 61.00 63.49 1y8b s PRO 93 Cb -0.04 -3.02 -0.03 0.00 0.04 0.00 0.00 34.50 31.45 1y8b s PRO 93 CO 0.02 -0.44 0.26 -0.65 0.04 0.00 0.00 177.00 176.23 1y8b s GLN 94 N -1.60 1.31 0.75 4.56 1.11 -1.26 -5.08 119.66 119.45 1y8b s GLN 94 Ca 0.54 -1.45 -0.17 0.00 0.01 0.00 0.00 55.36 54.28 1y8b s GLN 94 Cb -0.44 0.35 -0.11 0.00 -1.01 0.00 0.00 33.01 31.79 1y8b s GLN 94 CO 0.56 -0.48 -0.17 -2.30 0.01 0.00 0.00 175.29 172.92 1y8b n PRO 95 N -0.30 0.06 0.12 2.91 -0.02 -1.26 -4.87 135.00 131.64 1y8b n PRO 95 Ca -0.00 0.03 0.13 0.00 -2.02 0.00 0.00 63.50 61.64 1y8b n PRO 95 Cb 0.64 -1.25 0.29 0.00 -0.02 0.00 0.00 33.50 33.16 1y8b n PRO 95 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 1y8b h GLU 96 N -0.51 0.00 -3.08 -0.52 4.11 -2.00 -3.47 114.58 109.11 1y8b h GLU 96 Ca -0.43 0.00 0.05 0.00 0.07 0.00 0.00 59.36 59.05 1y8b h GLU 96 Cb 1.37 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.56 1y8b h GLU 96 CO 0.35 0.00 0.19 1.03 0.07 0.00 0.00 179.01 180.65 1y8b s ARG 97 N -3.15 1.77 0.08 1.06 0.52 -1.26 -5.06 118.95 112.90 1y8b s ARG 97 Ca 0.08 -1.03 0.05 0.00 -0.52 0.00 0.00 55.73 54.32 1y8b s ARG 97 Cb 0.11 0.59 -0.03 0.00 0.52 0.00 0.00 34.95 36.14 1y8b s ARG 97 CO 0.65 -0.80 -0.14 0.08 0.02 0.00 0.00 175.30 175.10 1y8b s VAL 98 N -3.91 1.17 -0.55 3.52 1.01 -1.26 -5.06 120.40 115.31 1y8b s VAL 98 Ca 0.12 -1.40 -0.07 0.00 0.00 0.00 0.00 61.98 60.63 1y8b s VAL 98 Cb -0.05 -1.19 0.14 0.00 0.00 0.00 0.00 36.38 35.28 1y8b s VAL 98 CO 0.07 -0.27 0.40 -0.89 0.00 0.00 0.00 175.10 174.42 1y8b s THR 99 N -1.48 4.09 -0.20 3.92 2.01 -1.26 -4.93 115.64 117.79 1y8b s THR 99 Ca 0.01 -2.25 -0.27 0.00 0.31 0.00 0.00 61.69 59.48 1y8b s THR 99 Cb -0.09 -3.68 -0.00 0.00 0.01 0.00 0.00 72.50 68.74 1y8b s THR 99 CO 0.02 -0.82 0.95 -0.69 -0.69 0.00 0.00 174.62 173.39 1y8b s VAL 100 N 0.77 4.77 -0.11 3.82 1.01 -1.26 -4.67 120.40 124.74 1y8b s VAL 100 Ca 0.11 1.85 -0.01 0.00 0.00 0.00 0.00 61.98 63.93 1y8b s VAL 100 Cb -0.22 -4.23 0.03 0.00 0.00 0.00 0.00 36.38 31.96 1y8b s VAL 100 CO -0.03 -0.08 -0.01 -1.61 0.00 0.00 0.00 175.10 173.36 1y8b s GLU 101 N 2.71 0.87 0.10 2.72 2.02 -1.26 -5.11 118.70 120.76 1y8b s GLU 101 Ca 0.42 -0.09 0.09 0.00 0.02 0.00 0.00 54.97 55.40 1y8b s GLU 101 Cb -0.16 -1.35 -0.04 0.00 0.10 0.00 0.00 34.13 32.69 1y8b s GLU 101 CO 0.10 -0.35 -0.22 0.95 0.02 0.00 0.00 175.26 175.75 1y8b s THR 102 N 1.87 1.81 0.84 3.63 -4.23 -1.26 -4.84 115.64 113.46 1y8b s THR 102 Ca 0.04 -1.57 -0.08 0.00 -1.18 0.00 0.00 61.69 58.90 1y8b s THR 102 Cb -0.13 -1.63 0.18 0.00 1.34 0.00 0.00 72.50 72.26 1y8b s THR 102 CO -0.06 -0.02 1.14 1.07 -0.54 0.00 0.00 174.62 176.21 1y8b n THR 103 N 1.08 0.00 -2.16 3.99 5.66 -1.26 -4.94 114.28 116.65 1y8b n THR 103 Ca -0.19 -1.29 -0.37 0.00 -3.05 0.00 0.00 64.05 59.15 1y8b n THR 103 Cb 0.53 -1.18 -0.03 0.00 -1.55 0.00 0.00 70.33 68.10 1y8b n THR 103 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 1y8b s GLY 104 N -5.46 0.38 0.00 1.09 0.00 -1.26 -4.44 107.32 97.63 1y8b s GLY 104 Ca 0.70 -1.03 0.00 0.00 0.00 0.00 0.00 44.72 44.39 1y8b s GLY 104 CO 0.48 3.25 0.49 0.29 0.00 0.00 0.00 173.10 177.61 1y8b n ILE 105 N 7.16 0.00 -3.67 0.90 -6.64 -1.26 -5.04 119.36 110.81 1y8b n ILE 105 Ca 0.21 0.00 -0.13 0.00 -1.77 0.00 0.00 62.75 61.07 1y8b n ILE 105 Cb 0.51 0.18 -0.06 0.00 -1.44 0.00 0.00 39.64 38.82 1y8b n ILE 105 CO 0.00 0.00 0.00 -0.62 -1.77 0.00 0.00 176.55 174.16 1y8b s ASP 106 N -0.36 -0.27 -0.19 7.28 -1.08 -1.26 -4.69 116.67 116.10 1y8b s ASP 106 Ca 0.00 -0.02 -0.14 0.00 -0.52 0.00 0.00 52.55 51.87 1y8b s ASP 106 Cb 0.00 0.42 -0.08 0.00 -1.46 0.00 0.00 42.92 41.80 1y8b s ASP 106 CO 0.00 -0.67 -0.31 -1.20 0.52 0.00 0.00 175.17 173.51 1y8b n SER 107 N 0.49 1.77 0.14 -0.34 7.64 -1.26 -4.15 113.62 117.91 1y8b n SER 107 Ca -0.18 0.30 -0.14 0.00 1.01 0.00 0.00 58.87 59.86 1y8b n SER 107 Cb 0.60 -0.70 -0.08 0.00 -1.01 0.00 0.00 64.21 63.01 1y8b n SER 107 CO 0.00 0.00 0.00 1.05 -3.01 0.00 0.00 175.04 173.08 1y8b h GLU 108 N -0.87 -0.30 -0.16 1.43 4.11 -1.83 1.74 114.58 118.69 1y8b h GLU 108 Ca -0.31 0.02 0.05 0.00 0.07 0.00 0.00 59.36 59.19 1y8b h GLU 108 Cb 1.21 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.52 1y8b h GLU 108 CO -0.19 -0.08 0.33 0.82 0.07 0.00 0.00 179.01 179.97 1y8b h ILE 109 N -0.49 0.19 0.02 -1.06 2.04 -1.83 -1.61 117.51 114.77 1y8b h ILE 109 Ca -0.03 0.00 -0.32 0.00 1.00 0.00 0.00 64.86 65.50 1y8b h ILE 109 Cb 0.37 0.70 -0.04 0.00 -0.74 0.00 0.00 36.82 37.11 1y8b h ILE 109 CO 0.05 0.00 -1.79 0.35 0.00 0.00 0.00 178.15 176.77 1y8b n THR 110 N -3.30 1.57 0.00 -0.27 -2.24 -0.63 -4.96 114.28 104.45 1y8b n THR 110 Ca 0.02 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.55 1y8b n THR 110 Cb 0.43 -1.92 0.00 0.00 -2.10 0.00 0.00 70.33 66.74 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 -4.18 0.00 -3.61 3.42 3.41 0.58 -5.07 113.62 108.17 1y8b n SER 111 Ca -0.39 0.00 -0.04 0.00 -0.26 0.00 0.00 58.87 58.18 1y8b n SER 111 Cb 0.81 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.74 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 0.00 0.67 0.07 4.33 2.00 -1.07 -4.66 119.66 121.00 1y8b s GLN 112 Ca 0.00 -0.31 -0.26 0.00 -2.00 0.00 0.00 55.36 52.79 1y8b s GLN 112 Cb 0.00 0.26 0.09 0.00 0.80 0.00 0.00 33.01 34.16 1y8b s GLN 112 CO 0.00 -0.30 1.18 0.00 -0.50 0.00 0.00 175.29 175.67 1y8b s ALA 113 N -2.81 -2.08 0.00 1.58 0.00 -1.26 -4.33 121.76 112.86 1y8b s ALA 113 Ca 0.10 -0.08 0.00 0.00 0.00 0.00 0.00 51.96 51.98 1y8b s ALA 113 Cb 0.00 0.81 0.00 0.00 0.00 0.00 0.00 23.12 23.93 1y8b s ALA 113 CO -0.04 -1.11 0.00 0.41 0.00 0.00 0.00 175.76 175.02 1y8b n GLY 114 N -0.79 2.24 3.74 0.00 0.00 -1.26 -4.35 105.19 104.76 1y8b n GLY 114 Ca 0.00 -1.57 -0.34 0.00 0.00 0.00 0.00 46.02 44.11 1y8b n GLY 114 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1y8b s PRO 115 N -1.84 2.40 0.04 1.61 0.04 -1.26 -4.78 135.00 131.21 1y8b s PRO 115 Ca 0.00 1.65 0.01 0.00 0.04 0.00 0.00 61.00 62.71 1y8b s PRO 115 Cb 0.00 -1.88 -0.04 0.00 0.04 0.00 0.00 34.50 32.63 1y8b s PRO 115 CO 0.00 -1.62 0.11 -1.14 0.04 0.00 0.00 177.00 174.39 1y8b s GLN 116 N -3.92 3.07 -0.09 4.56 0.74 -0.39 -3.61 119.66 120.03 1y8b s GLN 116 Ca 0.72 -0.56 0.02 0.00 0.05 0.00 0.00 55.36 55.59 1y8b s GLN 116 Cb -0.27 -2.85 0.02 0.00 1.10 0.00 0.00 33.01 31.01 1y8b s GLN 116 CO 0.43 0.61 -0.12 -1.17 -0.55 0.00 0.00 175.29 174.48 1y8b s LEU 117 N -2.18 1.57 0.09 3.68 0.20 -0.87 -1.12 118.68 120.06 1y8b s LEU 117 Ca 0.28 -0.34 -0.13 0.00 0.69 0.00 0.00 54.13 54.62 1y8b s LEU 117 Cb -0.12 -0.92 -0.06 0.00 -0.43 0.00 0.00 46.19 44.66 1y8b s LEU 117 CO 0.20 -0.00 0.48 -0.69 -0.29 0.00 0.00 176.35 176.05 1y8b s VAL 118 N 0.99 4.95 -0.01 1.68 1.01 0.17 -3.34 120.40 125.84 1y8b s VAL 118 Ca -0.08 0.75 0.06 0.00 0.00 0.00 0.00 61.98 62.71 1y8b s VAL 118 Cb -0.15 -3.72 -0.01 0.00 0.00 0.00 0.00 36.38 32.50 1y8b s VAL 118 CO -0.01 0.35 -0.18 0.68 0.00 0.00 0.00 175.10 175.94 1y8b s VAL 119 N -1.34 1.46 -0.14 2.92 -7.23 -1.16 -4.41 120.40 110.49 1y8b s VAL 119 Ca 0.33 -0.80 -0.29 0.00 -1.81 0.00 0.00 61.98 59.41 1y8b s VAL 119 Cb -0.15 -1.21 -0.02 0.00 0.56 0.00 0.00 36.38 35.55 1y8b s VAL 119 CO 0.18 0.40 1.31 -2.16 -0.31 0.00 0.00 175.10 174.52 1y8b s PRO 120 N -0.46 4.24 -0.08 4.82 0.04 -1.26 -3.69 135.00 138.61 1y8b s PRO 120 Ca 0.07 1.74 -0.18 0.00 0.04 0.00 0.00 61.00 62.67 1y8b s PRO 120 Cb -0.07 -3.77 -0.14 0.00 0.04 0.00 0.00 34.50 30.56 1y8b s PRO 120 CO -0.01 -0.70 0.66 0.00 0.04 0.00 0.00 177.00 177.00 1y8b h ALA 121 N 8.29 -0.14 -1.18 8.56 0.00 -1.93 -3.24 119.26 129.62 1y8b h ALA 121 Ca -0.29 -0.23 0.35 0.00 0.00 0.00 0.00 54.91 54.74 1y8b h ALA 121 Cb 1.12 0.05 -0.11 0.00 0.00 0.00 0.00 17.79 18.86 1y8b h ALA 121 CO 0.96 -0.19 0.77 1.98 0.00 0.00 0.00 179.25 182.77 1y8b h MET 122 N -0.93 0.22 -5.20 0.00 1.85 -1.86 -3.28 114.93 105.72 1y8b h MET 122 Ca -0.01 -0.01 -0.66 0.00 -0.61 0.00 0.00 59.70 58.40 1y8b h MET 122 Cb 0.51 -0.05 -0.16 0.00 0.43 0.00 0.00 31.60 32.33 1y8b h MET 122 CO 0.02 0.14 0.25 -0.80 -0.40 0.00 0.00 176.91 176.13 1y8b s ASN 123 N -4.89 6.24 0.29 1.39 0.02 -1.22 -4.82 114.94 111.96 1y8b s ASN 123 Ca -0.08 -0.86 0.26 0.00 -1.02 0.00 0.00 52.86 51.15 1y8b s ASN 123 Cb 0.27 -2.34 0.95 0.00 0.02 0.00 0.00 41.25 40.15 1y8b s ASN 123 CO 0.81 -1.08 1.76 0.00 0.02 0.00 0.00 177.10 178.61 1y8b h ALA 124 N 9.18 1.00 0.01 0.60 0.00 -1.80 -2.55 119.26 125.70 1y8b h ALA 124 Ca -0.28 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.63 1y8b h ALA 124 Cb 1.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1y8b h ALA 124 CO 1.04 0.00 -0.00 -0.09 0.00 0.00 0.00 179.25 180.20 1y8b h ARG 125 N 0.00 -0.01 -0.24 0.00 2.43 -1.90 -2.88 114.38 111.78 1y8b h ARG 125 Ca 0.00 0.00 0.07 0.00 -0.81 0.00 0.00 59.98 59.24 1y8b h ARG 125 Cb 0.52 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.06 1y8b h ARG 125 CO 0.00 -0.01 0.20 1.88 -1.51 0.00 0.00 179.97 180.54 1y8b h TYR 126 N -0.53 0.00 -0.15 2.20 -1.99 -1.89 -1.18 116.97 113.43 1y8b h TYR 126 Ca -0.00 0.00 -0.03 0.00 2.00 0.00 0.00 58.73 60.70 1y8b h TYR 126 Cb 0.01 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 38.74 1y8b h TYR 126 CO 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 178.16 178.14 1y8b h ALA 127 N 1.81 0.20 -0.61 3.88 0.00 -1.56 0.32 119.26 123.32 1y8b h ALA 127 Ca 0.11 -0.22 0.05 0.00 0.00 0.00 0.00 54.91 54.85 1y8b h ALA 127 Cb 0.52 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.20 1y8b h ALA 127 CO -0.00 -0.06 0.33 1.25 0.00 0.00 0.00 179.25 180.77 1y8b h LEU 128 N -0.01 0.49 -0.24 0.00 6.46 -0.99 2.50 115.31 123.52 1y8b h LEU 128 Ca 0.04 0.03 -0.17 0.00 -0.12 0.00 0.00 57.88 57.66 1y8b h LEU 128 Cb 0.43 -0.07 0.00 0.00 -0.73 0.00 0.00 40.66 40.29 1y8b h LEU 128 CO 0.01 0.33 -0.50 0.78 -0.62 0.00 0.00 178.44 178.44 1y8b h ASN 129 N 0.63 0.85 0.05 1.25 2.35 -1.35 -2.46 115.58 116.90 1y8b h ASN 129 Ca 0.27 -0.55 -0.00 0.00 -0.55 0.00 0.00 56.30 55.47 1y8b h ASN 129 Cb 0.15 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.28 1y8b h ASN 129 CO -0.17 1.24 -0.03 0.00 -1.65 0.00 0.00 177.43 176.83 1y8b h ALA 130 N 0.63 -0.07 -1.02 -0.83 0.00 0.18 -3.19 119.26 114.96 1y8b h ALA 130 Ca 0.01 -0.29 0.25 0.00 0.00 0.00 0.00 54.91 54.88 1y8b h ALA 130 Cb 1.11 0.03 -0.10 0.00 0.00 0.00 0.00 17.79 18.82 1y8b h ALA 130 CO 0.11 -0.12 0.64 0.00 0.00 0.00 0.00 179.25 179.88 1y8b h ALA 131 N -0.29 2.04 -0.09 0.00 0.00 0.42 1.67 119.26 123.01 1y8b h ALA 131 Ca -0.01 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1y8b h ALA 131 Cb 0.60 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1y8b h ALA 131 CO 0.01 -0.45 0.00 -1.71 0.00 0.00 0.00 179.25 177.10 1y8b n ASN 132 N -4.71 1.01 0.00 0.00 4.05 -0.93 -3.84 115.26 110.84 1y8b n ASN 132 Ca 0.25 -2.05 0.01 0.00 0.45 0.00 0.00 54.58 53.24 1y8b n ASN 132 Cb 0.79 -0.26 0.04 0.00 1.23 0.00 0.00 39.78 41.59 1y8b n ASN 132 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1y8b n ALA 133 N -0.08 1.57 0.07 5.20 0.00 0.57 -3.19 120.51 124.65 1y8b n ALA 133 Ca 0.04 -0.01 0.18 0.00 0.00 0.00 0.00 53.44 53.65 1y8b n ALA 133 Cb 0.21 -1.02 0.49 0.00 0.00 0.00 0.00 19.45 19.12 1y8b n ALA 133 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1y8b h ARG 134 N 0.00 0.00 -2.26 0.00 2.43 -1.80 -3.27 114.38 109.49 1y8b h ARG 134 Ca 0.00 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 1y8b h ARG 134 Cb 0.00 0.00 -0.23 0.00 -0.42 0.00 0.00 29.97 29.32 1y8b h ARG 134 CO 0.00 0.00 -0.20 1.67 -1.51 0.00 0.00 179.97 179.93 1y8b s TRP 135 N -4.33 -1.00 -0.01 2.20 1.48 -1.19 -3.29 118.94 112.80 1y8b s TRP 135 Ca -0.03 1.88 -0.01 0.00 -1.06 0.00 0.00 56.10 56.88 1y8b s TRP 135 Cb 0.10 0.53 -0.00 0.00 -1.16 0.00 0.00 33.47 32.94 1y8b s TRP 135 CO 0.35 -0.53 -0.02 0.41 -4.06 0.00 0.00 176.95 173.11 1y8b n GLY 136 N 4.98 -0.32 0.00 3.67 0.00 -1.26 -5.01 105.19 107.25 1y8b n GLY 136 Ca -0.15 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1y8b n GLY 136 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1y8b n SER 137 N -2.61 0.00 0.04 1.61 3.41 -1.26 -4.86 113.62 109.95 1y8b n SER 137 Ca -0.01 0.00 0.04 0.00 -0.26 0.00 0.00 58.87 58.65 1y8b n SER 137 Cb 0.02 0.00 0.21 0.00 -0.26 0.00 0.00 64.21 64.18 1y8b n SER 137 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 1y8b n LEU 138 N 0.00 0.15 -0.09 1.04 0.00 -0.50 0.82 117.00 118.43 1y8b n LEU 138 Ca 0.00 0.56 -0.10 0.00 0.00 0.00 0.00 56.01 56.47 1y8b n LEU 138 Cb 0.00 -0.57 -0.04 0.00 0.00 0.00 0.00 43.42 42.81 1y8b n LEU 138 CO 0.00 -0.54 -0.56 -1.22 0.00 0.00 0.00 177.39 175.08 1y8b n TYR 139 N -1.69 0.59 0.35 1.96 4.02 -1.26 -4.16 117.16 116.96 1y8b n TYR 139 Ca 0.01 0.26 0.14 0.00 -0.01 0.00 0.00 57.90 58.29 1y8b n TYR 139 Cb 0.06 -0.75 0.48 0.00 -0.02 0.00 0.00 39.34 39.11 1y8b n TYR 139 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 176.86 175.41 1y8b h ASP 140 N -1.00 0.00 -0.13 7.72 3.32 -1.87 -2.43 116.42 122.03 1y8b h ASP 140 Ca -0.10 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.94 1y8b h ASP 140 Cb 0.84 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.38 1y8b h ASP 140 CO -0.06 0.00 0.01 0.00 -1.72 0.00 0.00 179.24 177.48 1y8b h ALA 141 N 2.15 0.17 0.19 3.45 0.00 0.21 -3.04 119.26 122.39 1y8b h ALA 141 Ca 0.00 -0.17 -0.32 0.00 0.00 0.00 0.00 54.91 54.42 1y8b h ALA 141 Cb 0.62 -0.05 0.02 0.00 0.00 0.00 0.00 17.79 18.38 1y8b h ALA 141 CO 0.00 -0.16 -1.48 -0.07 0.00 0.00 0.00 179.25 177.54 1y8b h LEU 142 N -0.02 0.64 -0.87 0.00 3.38 -1.71 -3.32 115.31 113.41 1y8b h LEU 142 Ca 0.04 -0.75 0.23 0.00 0.09 0.00 0.00 57.88 57.49 1y8b h LEU 142 Cb 0.32 -0.21 -0.14 0.00 0.09 0.00 0.00 40.66 40.71 1y8b h LEU 142 CO 0.00 1.60 0.19 0.22 0.09 0.00 0.00 178.44 180.54 1y8b h TYR 143 N 0.11 0.26 -0.70 1.13 5.03 -1.47 0.38 116.97 121.72 1y8b h TYR 143 Ca -0.24 0.05 -0.47 0.00 2.58 0.00 0.00 58.73 60.65 1y8b h TYR 143 Cb 2.09 0.02 -0.20 0.00 1.55 0.00 0.00 36.73 40.19 1y8b h TYR 143 CO 0.10 -0.23 0.61 0.41 -1.32 0.00 0.00 178.16 177.73 1y8b n GLY 144 N -1.39 4.83 3.23 1.82 0.00 -1.15 -4.66 105.19 107.87 1y8b n GLY 144 Ca 0.20 -1.59 -0.10 0.00 0.00 0.00 0.00 46.02 44.54 1y8b n GLY 144 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1y8b s SER 145 N -0.69 0.19 0.00 1.61 0.15 0.13 -4.65 113.70 110.45 1y8b s SER 145 Ca 0.45 -1.06 0.21 0.00 0.70 0.00 0.00 55.95 56.26 1y8b s SER 145 Cb 0.36 0.36 0.91 0.00 -1.71 0.00 0.00 66.02 65.93 1y8b s SER 145 CO -0.00 -0.80 1.63 0.47 1.20 0.00 0.00 173.24 175.74 1y8b n ASP 146 N -0.15 1.18 0.00 5.45 9.92 -1.14 -3.86 116.55 127.96 1y8b n ASP 146 Ca -0.06 -1.59 0.02 0.00 -0.53 0.00 0.00 54.79 52.62 1y8b n ASP 146 Cb 0.63 -0.07 0.10 0.00 -0.64 0.00 0.00 41.12 41.15 1y8b n ASP 146 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1y8b n ILE 147 N -0.01 0.85 -3.26 0.53 3.06 -1.26 -4.09 119.36 115.18 1y8b n ILE 147 Ca 0.16 0.21 -0.38 0.00 -2.50 0.00 0.00 62.75 60.24 1y8b n ILE 147 Cb 0.26 -1.15 -0.06 0.00 0.54 0.00 0.00 39.64 39.23 1y8b n ILE 147 CO 0.00 0.00 0.00 -0.51 -2.50 0.00 0.00 176.55 173.54 1y8b s ILE 148 N -2.48 5.15 0.19 9.51 1.10 -1.25 -4.94 121.20 128.48 1y8b s ILE 148 Ca 0.04 1.05 -0.09 0.00 -0.51 0.00 0.00 60.65 61.13 1y8b s ILE 148 Cb 0.03 -3.86 0.26 0.00 0.15 0.00 0.00 42.46 39.04 1y8b s ILE 148 CO 0.06 0.29 1.15 -2.65 -2.11 0.00 0.00 174.94 171.68 1y8b n PRO 149 N 3.83 -0.12 0.00 3.50 -0.02 -1.26 -3.94 135.00 136.99 1y8b n PRO 149 Ca -0.06 1.14 0.00 0.00 -2.02 0.00 0.00 63.50 62.57 1y8b n PRO 149 Cb 0.51 -1.70 0.00 0.00 -0.02 0.00 0.00 33.50 32.29 1y8b n PRO 149 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 1y8b n GLN 150 N -5.15 0.00 0.00 -0.52 -0.06 -1.26 -5.08 117.38 105.31 1y8b n GLN 150 Ca 0.10 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.10 1y8b n GLN 150 Cb 0.33 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.51 1y8b n GLN 150 CO 0.00 0.00 0.00 0.39 -0.20 0.00 0.00 177.06 177.25 1y8b n GLU 151 N 0.00 0.00 -3.54 3.69 1.02 -1.25 -5.00 120.64 115.56 1y8b n GLU 151 Ca 0.00 0.00 -0.17 0.00 -0.02 0.00 0.00 57.16 56.97 1y8b n GLU 151 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 1y8b n GLU 151 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1y8b n GLY 152 N 0.85 -1.25 3.64 0.62 0.00 -1.26 -4.59 105.19 103.20 1y8b n GLY 152 Ca 0.00 0.54 -0.20 0.00 0.00 0.00 0.00 46.02 46.36 1y8b n GLY 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y8b n ALA 153 N -2.51 1.06 -2.24 4.61 0.00 -1.26 -4.24 120.51 115.92 1y8b n ALA 153 Ca -0.19 -2.00 0.00 0.00 0.00 0.00 0.00 53.44 51.26 1y8b n ALA 153 Cb 0.62 0.62 0.00 0.00 0.00 0.00 0.00 19.45 20.69 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 -2.06 -3.71 -0.77 0.00 2.81 -1.26 -4.43 117.12 107.70 1y8b n MET 154 Ca 0.11 2.68 -0.44 0.00 -1.81 0.00 0.00 57.70 58.24 1y8b n MET 154 Cb 0.57 -3.49 -0.09 0.00 -0.71 0.00 0.00 33.22 29.49 1y8b n MET 154 CO 0.00 0.00 0.00 1.33 1.51 0.00 0.00 175.97 178.81 1y8b n VAL 155 N 1.90 0.73 -3.82 2.03 0.24 -1.26 -4.76 118.33 113.38 1y8b n VAL 155 Ca 0.00 -0.63 -0.12 0.00 -2.04 0.00 0.00 64.34 61.54 1y8b n VAL 155 Cb 0.00 -2.13 -0.12 0.00 -1.47 0.00 0.00 33.84 30.13 1y8b n VAL 155 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1y8b s SER 156 N 6.22 -0.15 0.00 -1.34 0.15 -1.26 -5.08 113.70 112.23 1y8b s SER 156 Ca 0.64 0.26 0.00 0.00 0.70 0.00 0.00 55.95 57.55 1y8b s SER 156 Cb 0.15 0.34 0.00 0.00 -1.71 0.00 0.00 66.02 64.80 1y8b s SER 156 CO 0.26 -0.13 0.00 0.61 1.20 0.00 0.00 173.24 175.18 1y8b n GLY 157 N 2.66 -2.38 3.57 9.45 0.00 -1.26 -4.90 105.19 112.33 1y8b n GLY 157 Ca -0.15 -0.92 -0.43 0.00 0.00 0.00 0.00 46.02 44.53 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 -0.14 2.87 -0.68 1.61 2.02 -1.26 -4.96 117.35 116.81 1y8b s TYR 158 Ca 0.00 0.41 0.03 0.00 -0.37 0.00 0.00 57.07 57.14 1y8b s TYR 158 Cb 0.00 -4.10 0.17 0.00 -0.40 0.00 0.00 41.96 37.62 1y8b s TYR 158 CO 0.00 -1.19 0.47 -0.51 -1.57 0.00 0.00 175.55 172.76 1y8b s ASP 159 N 2.40 4.90 0.65 2.29 1.01 -1.26 -4.93 116.67 121.72 1y8b s ASP 159 Ca 0.39 -3.56 0.24 0.00 0.71 0.00 0.00 52.55 50.33 1y8b s ASP 159 Cb -0.10 -1.69 1.28 0.00 1.01 0.00 0.00 42.92 43.42 1y8b s ASP 159 CO 0.27 -0.15 1.72 -0.65 0.21 0.00 0.00 175.17 176.56 1y8b h PRO 160 N 5.87 0.00 0.13 8.23 0.11 -1.99 -1.39 132.00 142.95 1y8b h PRO 160 Ca 0.08 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.18 1y8b h PRO 160 Cb 0.81 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.92 1y8b h PRO 160 CO 0.73 0.00 -0.06 1.96 -0.21 0.00 0.00 178.00 180.42 1y8b h GLN 161 N 0.00 -0.16 -0.41 1.05 7.50 -2.01 -2.94 115.11 118.14 1y8b h GLN 161 Ca 0.05 0.01 -0.02 0.00 0.50 0.00 0.00 58.65 59.19 1y8b h GLN 161 Cb 1.08 0.04 -0.02 0.00 0.05 0.00 0.00 27.48 28.62 1y8b h GLN 161 CO -0.00 0.30 0.18 0.00 -1.50 0.00 0.00 178.83 177.81 1y8b h ARG 162 N -0.75 0.57 -0.48 1.46 2.47 -1.70 -1.31 114.38 114.65 1y8b h ARG 162 Ca -0.02 -0.07 0.04 0.00 -1.26 0.00 0.00 59.98 58.68 1y8b h ARG 162 Cb 0.54 -0.11 -0.03 0.00 -1.65 0.00 0.00 29.97 28.72 1y8b h ARG 162 CO 0.03 0.47 0.32 0.78 0.56 0.00 0.00 179.97 182.13 1y8b h GLY 163 N 0.71 0.56 0.58 0.04 0.00 -1.45 0.15 103.07 103.66 1y8b h GLY 163 Ca 0.14 -0.19 -0.02 0.00 0.00 0.00 0.00 47.33 47.27 1y8b h GLY 163 CO -0.02 0.16 -0.04 0.83 0.00 0.00 0.00 176.54 177.47 1y8b h GLU 164 N 0.48 0.09 0.00 4.80 5.08 -1.05 -1.55 114.58 122.43 1y8b h GLU 164 Ca 0.20 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.49 1y8b h GLU 164 Cb 0.20 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.45 1y8b h GLU 164 CO -0.05 0.54 -0.13 1.96 -1.00 0.00 0.00 179.01 180.33 1y8b h GLN 165 N -0.35 0.00 -0.06 2.33 4.20 -1.23 -1.93 115.11 118.06 1y8b h GLN 165 Ca 0.01 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.69 1y8b h GLN 165 Cb 0.52 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.30 1y8b h GLN 165 CO 0.01 0.13 -0.07 0.28 -0.67 0.00 0.00 178.83 178.51 1y8b h VAL 166 N 0.00 1.38 -0.17 -0.54 2.07 -0.45 -2.80 116.25 115.73 1y8b h VAL 166 Ca -0.00 -1.25 -0.01 0.00 0.82 0.00 0.00 66.70 66.26 1y8b h VAL 166 Cb 0.32 2.07 -0.01 0.00 -1.52 0.00 0.00 31.29 32.15 1y8b h VAL 166 CO 0.02 0.35 0.09 0.40 0.02 0.00 0.00 177.57 178.44 1y8b h ILE 167 N -0.29 1.12 -0.95 4.57 2.04 -0.87 -1.86 117.51 121.27 1y8b h ILE 167 Ca 0.01 -0.34 0.23 0.00 1.00 0.00 0.00 64.86 65.76 1y8b h ILE 167 Cb 0.59 1.03 -0.07 0.00 -0.74 0.00 0.00 36.82 37.63 1y8b h ILE 167 CO 0.02 0.11 0.63 0.00 0.00 0.00 0.00 178.15 178.91 1y8b h ALA 168 N 0.96 2.32 -0.02 1.87 0.00 -1.39 0.79 119.26 123.79 1y8b h ALA 168 Ca 0.06 0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.90 1y8b h ALA 168 Cb 0.10 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1y8b h ALA 168 CO -0.01 -0.64 -0.43 2.35 0.00 0.00 0.00 179.25 180.53 1y8b h TRP 169 N 0.35 0.06 0.27 0.00 2.91 -1.06 -2.13 115.95 116.34 1y8b h TRP 169 Ca 0.50 -0.01 -0.01 0.00 1.13 0.00 0.00 58.89 60.50 1y8b h TRP 169 Cb 1.37 -0.01 0.00 0.00 -0.51 0.00 0.00 29.16 30.01 1y8b h TRP 169 CO -0.00 0.47 -0.13 0.28 -1.03 0.00 0.00 178.44 178.03 1y8b h VAL 170 N 0.04 0.05 -0.76 2.65 2.07 0.86 -2.13 116.25 119.04 1y8b h VAL 170 Ca 0.00 -0.76 0.17 0.00 0.82 0.00 0.00 66.70 66.94 1y8b h VAL 170 Cb 0.77 0.09 -0.12 0.00 -1.52 0.00 0.00 31.29 30.51 1y8b h VAL 170 CO 0.06 0.01 0.14 0.03 0.02 0.00 0.00 177.57 177.83 1y8b h ARG 171 N -1.09 0.21 -0.28 1.57 3.08 -1.32 2.71 114.38 119.26 1y8b h ARG 171 Ca -0.04 -0.01 0.03 0.00 0.07 0.00 0.00 59.98 60.03 1y8b h ARG 171 Cb 0.30 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.28 1y8b h ARG 171 CO 0.06 0.14 0.11 -0.09 -1.07 0.00 0.00 179.97 179.12 1y8b h ARG 172 N 0.22 0.23 -0.12 0.04 2.43 -1.45 0.11 114.38 115.84 1y8b h ARG 172 Ca 0.43 -0.01 -0.20 0.00 -0.81 0.00 0.00 59.98 59.39 1y8b h ARG 172 Cb 0.76 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.26 1y8b h ARG 172 CO -0.57 0.15 -0.73 0.35 -1.51 0.00 0.00 179.97 177.67 1y8b h PHE 173 N 0.24 0.76 0.00 2.20 3.57 0.14 -2.83 116.94 121.02 1y8b h PHE 173 Ca 0.12 -0.33 0.00 0.00 3.53 0.00 0.00 57.97 61.29 1y8b h PHE 173 Cb 0.08 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 38.70 1y8b h PHE 173 CO -0.12 1.11 0.00 1.25 -2.23 0.00 0.00 178.31 178.32 1y8b h LEU 174 N 0.39 0.00 0.05 0.59 5.85 0.51 -1.40 115.31 121.30 1y8b h LEU 174 Ca -0.03 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.68 1y8b h LEU 174 Cb 1.32 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.35 1y8b h LEU 174 CO 0.14 0.00 -0.02 -0.78 -0.34 0.00 0.00 178.44 177.43 1y8b h ASP 175 N 0.00 -0.05 -0.38 1.25 3.58 -0.53 -0.30 116.42 119.98 1y8b h ASP 175 Ca 0.00 -0.40 -0.04 0.00 0.42 0.00 0.00 57.03 57.01 1y8b h ASP 175 Cb 0.30 0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.34 1y8b h ASP 175 CO 0.00 0.62 0.11 -0.08 -2.88 0.00 0.00 179.24 177.01 1y8b h GLU 176 N -0.98 0.68 0.05 0.28 4.81 -1.47 0.65 114.58 118.59 1y8b h GLU 176 Ca -0.01 -0.12 -0.00 0.00 -0.13 0.00 0.00 59.36 59.10 1y8b h GLU 176 Cb 0.45 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.72 1y8b h GLU 176 CO 0.01 0.62 -0.02 0.66 -0.73 0.00 0.00 179.01 179.55 1y8b h SER 177 N 0.66 -0.06 -2.16 1.04 4.64 -1.36 -3.38 113.55 112.92 1y8b h SER 177 Ca 0.15 -0.57 -0.59 0.00 -0.47 0.00 0.00 61.79 60.31 1y8b h SER 177 Cb 0.25 0.02 -0.41 0.00 -0.31 0.00 0.00 62.40 61.94 1y8b h SER 177 CO -0.00 0.59 -0.69 0.18 -0.87 0.00 0.00 176.83 176.03 1y8b n LEU 178 N -4.81 3.20 -4.60 5.97 4.32 -0.12 -5.02 117.00 115.94 1y8b n LEU 178 Ca -0.08 -5.34 -0.43 0.00 -0.02 0.00 0.00 56.01 50.13 1y8b n LEU 178 Cb 0.31 -0.42 -0.02 0.00 -1.62 0.00 0.00 43.42 41.67 1y8b n LEU 178 CO 0.30 2.10 1.39 -2.16 -1.22 0.00 0.00 177.39 177.80 1y8b s PRO 179 N -2.37 3.46 0.43 3.23 0.04 0.23 -4.55 135.00 135.46 1y8b s PRO 179 Ca 0.40 1.20 -0.22 0.00 0.04 0.00 0.00 61.00 62.42 1y8b s PRO 179 Cb 0.17 -4.11 -0.13 0.00 0.04 0.00 0.00 34.50 30.47 1y8b s PRO 179 CO -0.04 -1.70 0.43 1.28 0.04 0.00 0.00 177.00 177.00 1y8b n LEU 180 N 9.53 -0.71 -0.34 -3.56 4.77 -1.26 -4.74 117.00 120.68 1y8b n LEU 180 Ca 0.20 0.87 0.18 0.00 -0.03 0.00 0.00 56.01 57.23 1y8b n LEU 180 Cb 0.47 -1.06 0.40 0.00 -2.33 0.00 0.00 43.42 40.90 1y8b n LEU 180 CO 0.69 -3.24 1.16 -0.08 -1.33 0.00 0.00 177.39 174.59 1y8b h GLU 181 N 0.64 0.53 -3.16 3.23 4.81 0.24 -3.39 114.58 117.49 1y8b h GLU 181 Ca -0.40 -0.03 -0.25 0.00 -0.13 0.00 0.00 59.36 58.55 1y8b h GLU 181 Cb 1.41 -0.12 -0.33 0.00 0.63 0.00 0.00 28.75 30.34 1y8b h GLU 181 CO 0.50 0.35 -0.60 1.21 -0.73 0.00 0.00 179.01 179.75 1y8b s ASN 182 N -5.16 0.17 0.00 1.04 3.04 -1.26 -4.99 114.94 107.77 1y8b s ASN 182 Ca -0.11 0.35 0.00 0.00 0.04 0.00 0.00 52.86 53.14 1y8b s ASN 182 Cb 0.28 0.27 0.00 0.00 -1.54 0.00 0.00 41.25 40.25 1y8b s ASN 182 CO 0.80 -0.19 0.00 0.61 -3.04 0.00 0.00 177.10 175.28 1y8b n GLY 183 N 4.62 -0.79 3.49 1.21 0.00 -1.26 -4.65 105.19 107.81 1y8b n GLY 183 Ca -0.19 -2.18 -0.24 0.00 0.00 0.00 0.00 46.02 43.41 1y8b n GLY 183 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1y8b s SER 184 N -3.82 3.59 0.42 1.61 0.15 -1.26 -4.49 113.70 109.90 1y8b s SER 184 Ca 0.00 -1.08 0.22 0.00 0.70 0.00 0.00 55.95 55.79 1y8b s SER 184 Cb 0.00 -0.31 0.33 0.00 -1.71 0.00 0.00 66.02 64.33 1y8b s SER 184 CO 0.00 -0.04 1.60 0.22 1.20 0.00 0.00 173.24 176.21 1y8b h TYR 185 N 2.20 0.00 0.00 3.44 5.03 -1.90 -3.11 116.97 122.63 1y8b h TYR 185 Ca -0.41 0.00 0.00 0.00 2.58 0.00 0.00 58.73 60.90 1y8b h TYR 185 Cb 1.26 0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.54 1y8b h TYR 185 CO 0.79 0.09 0.00 0.00 -1.32 0.00 0.00 178.16 177.72 1y8b n GLN 186 N -3.12 0.14 0.04 1.82 10.64 -1.26 -2.79 117.38 122.84 1y8b n GLN 186 Ca 0.04 0.03 0.11 0.00 -1.83 0.00 0.00 57.00 55.35 1y8b n GLN 186 Cb 0.56 -1.50 -0.03 0.00 -0.86 0.00 0.00 30.24 28.40 1y8b n GLN 186 CO 0.00 0.00 0.00 -0.25 -1.83 0.00 0.00 177.06 174.98 1y8b n ASP 187 N -1.42 0.54 -4.47 2.61 8.00 -1.18 -4.88 116.55 115.75 1y8b n ASP 187 Ca 0.09 -0.06 -0.32 0.00 0.71 0.00 0.00 54.79 55.21 1y8b n ASP 187 Cb 0.28 1.00 0.14 0.00 -0.02 0.00 0.00 41.12 42.52 1y8b n ASP 187 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1y8b n VAL 188 N -2.19 0.00 0.00 2.53 0.31 -1.12 0.29 118.33 118.15 1y8b n VAL 188 Ca 0.00 -0.15 0.00 0.00 -0.01 0.00 0.00 64.34 64.18 1y8b n VAL 188 Cb 0.49 -0.71 0.00 0.00 -0.91 0.00 0.00 33.84 32.71 1y8b n VAL 188 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 1y8b n VAL 189 N -3.80 0.00 -3.68 2.52 0.24 -1.06 -4.61 118.33 107.93 1y8b n VAL 189 Ca 0.08 0.00 -0.14 0.00 -2.04 0.00 0.00 64.34 62.23 1y8b n VAL 189 Cb 0.53 -0.25 -0.08 0.00 -1.47 0.00 0.00 33.84 32.57 1y8b n VAL 189 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1y8b s ALA 190 N -1.46 -1.24 -0.01 2.33 0.00 -1.26 -4.78 121.76 115.34 1y8b s ALA 190 Ca 0.00 1.14 -0.03 0.00 0.00 0.00 0.00 51.96 53.07 1y8b s ALA 190 Cb 0.00 -0.45 -0.04 0.00 0.00 0.00 0.00 23.12 22.63 1y8b s ALA 190 CO 0.00 -0.27 0.19 -0.06 0.00 0.00 0.00 175.76 175.62 1y8b s PHE 191 N -0.41 3.55 0.05 0.00 0.40 -1.25 -3.60 117.98 116.72 1y8b s PHE 191 Ca -0.05 0.37 0.03 0.00 -0.60 0.00 0.00 56.93 56.68 1y8b s PHE 191 Cb -0.03 -1.84 -0.02 0.00 0.51 0.00 0.00 43.02 41.64 1y8b s PHE 191 CO 0.03 0.65 -0.10 0.15 0.70 0.00 0.00 175.22 176.64 1y8b s LYS 192 N -1.94 0.66 -0.50 0.44 1.02 -0.46 -4.61 119.74 114.36 1y8b s LYS 192 Ca 0.27 -0.78 -0.18 0.00 0.02 0.00 0.00 55.97 55.30 1y8b s LYS 192 Cb -0.13 -0.55 0.06 0.00 -0.52 0.00 0.00 37.83 36.70 1y8b s LYS 192 CO 0.19 0.12 0.58 0.08 -0.92 0.00 0.00 175.35 175.40 1y8b s VAL 193 N -1.19 4.95 0.10 3.17 1.01 -0.79 -0.84 120.40 126.82 1y8b s VAL 193 Ca -0.05 -0.65 0.05 0.00 0.00 0.00 0.00 61.98 61.32 1y8b s VAL 193 Cb -0.09 -4.27 -0.04 0.00 0.00 0.00 0.00 36.38 31.98 1y8b s VAL 193 CO 0.01 -0.77 0.03 -0.69 0.00 0.00 0.00 175.10 173.67 1y8b s VAL 194 N 2.41 4.14 -1.28 2.92 1.01 -0.64 -4.77 120.40 124.18 1y8b s VAL 194 Ca 0.12 -0.99 0.00 0.00 0.00 0.00 0.00 61.98 61.12 1y8b s VAL 194 Cb -0.21 -3.00 0.00 0.00 0.00 0.00 0.00 36.38 33.18 1y8b s VAL 194 CO 0.10 0.08 0.00 0.47 0.00 0.00 0.00 175.10 175.76 1y8b n ASP 195 N 0.41 0.00 0.05 3.32 9.92 -1.26 -2.09 116.55 126.90 1y8b n ASP 195 Ca -0.10 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.16 1y8b n ASP 195 Cb 0.52 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.00 1y8b n ASP 195 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1y8b n LYS 196 N -0.23 0.00 -0.26 -1.24 5.02 -1.26 -5.16 118.16 115.02 1y8b n LYS 196 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1y8b n LYS 196 Cb 0.00 -0.24 0.00 0.00 -0.02 0.00 0.00 35.03 34.77 1y8b n LYS 196 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1y8b n GLN 197 N -3.12 0.00 -2.57 1.97 10.64 -0.89 -5.01 117.38 118.39 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 0.12 0.00 -0.03 0.00 -0.86 0.00 0.00 30.24 29.46 1y8b n GLN 197 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 1y8b s LEU 198 N 0.00 4.42 -0.27 2.61 2.01 -1.26 -1.62 118.68 124.57 1y8b s LEU 198 Ca 0.00 1.90 -0.11 0.00 0.01 0.00 0.00 54.13 55.93 1y8b s LEU 198 Cb 0.00 -3.58 -0.05 0.00 0.01 0.00 0.00 46.19 42.57 1y8b s LEU 198 CO 0.00 -0.29 0.18 -0.60 1.01 0.00 0.00 176.35 176.65 1y8b s ARG 199 N 0.55 3.94 -0.28 1.70 3.52 -0.02 -4.69 118.95 123.68 1y8b s ARG 199 Ca 0.53 -0.32 0.02 0.00 -0.13 0.00 0.00 55.73 55.82 1y8b s ARG 199 Cb -0.26 -3.62 0.07 0.00 -1.56 0.00 0.00 34.95 29.58 1y8b s ARG 199 CO 0.30 -0.15 -0.02 0.96 -0.81 0.00 0.00 175.30 175.58 1y8b s ILE 200 N 1.66 1.78 -0.39 4.11 -0.00 -1.26 -1.35 121.20 125.76 1y8b s ILE 200 Ca 0.07 -1.62 -0.29 0.00 -0.00 0.00 0.00 60.65 58.82 1y8b s ILE 200 Cb -0.16 -2.11 0.00 0.00 -0.00 0.00 0.00 42.46 40.20 1y8b s ILE 200 CO 0.10 -0.28 1.53 -1.10 -0.00 0.00 0.00 174.94 175.18 1y8b s GLN 201 N 1.23 3.50 0.89 0.37 1.11 -1.24 -3.47 119.66 122.06 1y8b s GLN 201 Ca -0.00 1.08 -0.10 0.00 0.01 0.00 0.00 55.36 56.34 1y8b s GLN 201 Cb -0.19 -4.08 0.13 0.00 -1.01 0.00 0.00 33.01 27.86 1y8b s GLN 201 CO -0.09 -1.65 1.12 -0.51 0.01 0.00 0.00 175.29 174.17 1y8b s LEU 202 N 5.86 2.71 0.07 2.90 1.43 -1.22 -2.58 118.68 127.85 1y8b s LEU 202 Ca 0.67 1.98 0.02 0.00 -1.03 0.00 0.00 54.13 55.77 1y8b s LEU 202 Cb -0.16 -4.42 -0.25 0.00 0.03 0.00 0.00 46.19 41.39 1y8b s LEU 202 CO 0.33 -2.84 1.12 0.50 0.23 0.00 0.00 176.35 175.69 1y8b h LYS 203 N -1.69 0.13 0.00 1.70 1.63 0.40 -2.67 116.57 116.07 1y8b h LYS 203 Ca -0.45 -0.22 0.00 0.00 -0.85 0.00 0.00 60.65 59.13 1y8b h LYS 203 Cb 1.26 0.08 0.00 0.00 -0.60 0.00 0.00 32.23 32.97 1y8b h LYS 203 CO 0.46 1.05 -1.73 0.09 -3.45 0.00 0.00 179.45 175.87 1y8b n ASN 204 N -3.40 0.70 -2.93 4.20 5.03 -1.26 -4.71 115.26 112.89 1y8b n ASN 204 Ca -0.07 -0.12 -0.10 0.00 0.87 0.00 0.00 54.58 55.17 1y8b n ASN 204 Cb 0.99 1.75 -0.02 0.00 -1.02 0.00 0.00 39.78 41.49 1y8b n ASN 204 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 1y8b s GLY 205 N -3.99 -0.66 -0.43 7.41 0.00 -1.26 -5.10 107.32 103.30 1y8b s GLY 205 Ca -0.05 -0.89 -0.44 0.00 0.00 0.00 0.00 44.72 43.34 1y8b s GLY 205 CO 0.78 3.28 1.75 1.17 0.00 0.00 0.00 173.10 180.08 1y8b n LYS 206 N 2.97 0.39 -3.77 2.90 0.00 -1.01 -4.13 118.16 115.53 1y8b n LYS 206 Ca 0.21 0.14 -0.13 0.00 0.00 0.00 0.00 58.31 58.52 1y8b n LYS 206 Cb 0.54 -1.73 -0.10 0.00 0.00 0.00 0.00 35.03 33.74 1y8b n LYS 206 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.40 176.19 1y8b s GLU 207 N 3.75 0.47 -0.22 1.64 0.41 -1.24 -4.55 118.70 118.96 1y8b s GLU 207 Ca 1.05 0.22 -0.01 0.00 -0.41 0.00 0.00 54.97 55.83 1y8b s GLU 207 Cb -1.34 0.22 0.02 0.00 -1.78 0.00 0.00 34.13 31.25 1y8b s GLU 207 CO 0.73 -0.09 -0.11 -0.08 -0.49 0.00 0.00 175.26 175.23 1y8b s THR 208 N -0.35 2.66 -0.29 3.63 -1.32 -1.23 -3.46 115.64 115.29 1y8b s THR 208 Ca -0.05 -0.91 -0.13 0.00 -1.21 0.00 0.00 61.69 59.39 1y8b s THR 208 Cb -0.03 -2.26 0.11 0.00 -1.51 0.00 0.00 72.50 68.80 1y8b s THR 208 CO 0.02 0.35 0.67 0.42 -2.21 0.00 0.00 174.62 173.87 1y8b s THR 209 N 1.33 -0.53 0.00 5.08 -4.23 -1.26 -4.90 115.64 111.14 1y8b s THR 209 Ca 0.03 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.54 1y8b s THR 209 Cb -0.15 -1.00 0.00 0.00 1.34 0.00 0.00 72.50 72.69 1y8b s THR 209 CO -0.07 0.00 0.00 0.18 -0.54 0.00 0.00 174.62 174.19 1y8b n LEU 210 N 4.91 0.00 0.00 4.79 4.77 -1.26 -0.80 117.00 129.41 1y8b n LEU 210 Ca -0.16 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.82 1y8b n LEU 210 Cb 0.54 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.63 1y8b n LEU 210 CO -0.03 0.00 0.00 -1.14 -1.33 0.00 0.00 177.39 174.89 1y8b n ARG 211 N 0.00 0.00 -4.01 3.23 3.00 -1.26 0.75 116.66 118.36 1y8b n ARG 211 Ca 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 57.85 57.74 1y8b n ARG 211 Cb 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 32.46 32.34 1y8b n ARG 211 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 1y8b s THR 212 N -0.61 0.27 0.24 5.15 -4.23 -1.26 -5.02 115.64 110.18 1y8b s THR 212 Ca 0.00 -0.79 -0.14 0.00 -1.18 0.00 0.00 61.69 59.58 1y8b s THR 212 Cb 0.00 -0.36 0.32 0.00 1.34 0.00 0.00 72.50 73.80 1y8b s THR 212 CO 0.00 -0.34 1.56 -0.65 -0.54 0.00 0.00 174.62 174.65 1y8b h PRO 213 N 4.91 -0.02 0.00 3.99 0.11 -1.95 0.59 132.00 139.62 1y8b h PRO 213 Ca -0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 1y8b h PRO 213 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1y8b h PRO 213 CO 0.43 -0.01 0.54 0.00 -0.21 0.00 0.00 178.00 178.75 1y8b h ALA 214 N 1.61 1.38 0.00 -0.75 0.00 -1.96 1.43 119.26 120.96 1y8b h ALA 214 Ca 0.39 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 55.22 1y8b h ALA 214 Cb 0.64 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1y8b h ALA 214 CO -0.95 -0.38 -0.37 0.37 0.00 0.00 0.00 179.25 177.92 1y8b h GLN 215 N 0.00 0.00 -4.69 0.00 5.75 -0.05 -3.41 115.11 112.71 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 1.09 0.00 -0.20 0.00 1.07 0.00 0.00 27.48 29.44 1y8b h GLN 215 CO 0.00 0.37 -0.10 0.12 -2.65 0.00 0.00 178.83 176.57 1y8b s PHE 216 N -3.18 3.13 0.00 3.99 5.36 0.49 -3.57 117.98 124.20 1y8b s PHE 216 Ca 0.03 -0.71 0.00 0.00 -0.96 0.00 0.00 56.93 55.30 1y8b s PHE 216 Cb 0.08 -3.40 0.00 0.00 -0.34 0.00 0.00 43.02 39.36 1y8b s PHE 216 CO 0.71 -0.94 0.00 0.28 -1.46 0.00 0.00 175.22 173.80 1y8b n VAL 217 N 5.45 0.00 -2.91 3.12 0.31 -1.22 -4.91 118.33 118.17 1y8b n VAL 217 Ca -0.09 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.24 1y8b n VAL 217 Cb 0.45 -0.30 0.00 0.00 -0.91 0.00 0.00 33.84 33.08 1y8b n VAL 217 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1y8b n GLY 218 N 2.56 5.07 3.84 2.92 0.00 -1.25 -2.66 105.19 115.67 1y8b n GLY 218 Ca 0.00 -1.38 -0.06 0.00 0.00 0.00 0.00 46.02 44.58 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 -1.04 0.10 0.03 1.61 1.13 0.47 -3.42 117.35 116.22 1y8b s TYR 219 Ca 0.00 -0.64 -0.03 0.00 -1.41 0.00 0.00 57.07 54.99 1y8b s TYR 219 Cb 0.00 0.77 -0.02 0.00 -1.10 0.00 0.00 41.96 41.62 1y8b s TYR 219 CO 0.00 -1.26 0.03 0.50 -2.51 0.00 0.00 175.55 172.31 1y8b s ARG 220 N -2.24 0.46 1.12 -3.49 6.06 -0.89 0.29 118.95 120.26 1y8b s ARG 220 Ca 0.19 -0.69 0.00 0.00 -2.50 0.00 0.00 55.73 52.72 1y8b s ARG 220 Cb -0.04 0.17 0.00 0.00 0.06 0.00 0.00 34.95 35.14 1y8b s ARG 220 CO 0.08 -0.10 0.00 0.41 -2.50 0.00 0.00 175.30 173.20 1y8b n GLY 221 N 1.15 -1.72 3.85 8.12 0.00 -1.26 -1.03 105.19 114.29 1y8b n GLY 221 Ca -0.21 -1.59 -0.33 0.00 0.00 0.00 0.00 46.02 43.88 1y8b n GLY 221 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1y8b s ASP 222 N -4.00 6.82 0.55 1.61 1.11 -1.14 -4.77 116.67 116.85 1y8b s ASP 222 Ca 0.00 1.23 0.23 0.00 0.18 0.00 0.00 52.55 54.19 1y8b s ASP 222 Cb 0.00 -2.35 1.53 0.00 1.07 0.00 0.00 42.92 43.17 1y8b s ASP 222 CO 0.00 -0.10 2.19 0.00 1.18 0.00 0.00 175.17 178.44 1y8b h ALA 223 N 2.70 1.81 -0.05 5.23 0.00 -1.90 0.73 119.26 127.78 1y8b h ALA 223 Ca -0.48 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1y8b h ALA 223 Cb 1.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1y8b h ALA 223 CO 0.66 -0.04 0.00 0.00 0.00 0.00 0.00 179.25 179.87 1y8b n ALA 224 N -2.44 2.53 -2.71 0.00 0.00 -1.26 -1.88 120.51 114.74 1y8b n ALA 224 Ca -0.02 -0.56 -0.08 0.00 0.00 0.00 0.00 53.44 52.78 1y8b n ALA 224 Cb 0.12 -1.03 0.09 0.00 0.00 0.00 0.00 19.45 18.64 1y8b n ALA 224 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1y8b n ALA 225 N 0.63 -0.81 -2.10 0.00 0.00 0.68 -5.04 120.51 113.86 1y8b n ALA 225 Ca 0.17 -1.26 -0.42 0.00 0.00 0.00 0.00 53.44 51.93 1y8b n ALA 225 Cb 0.44 -1.39 -0.03 0.00 0.00 0.00 0.00 19.45 18.48 1y8b n ALA 225 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1y8b s PRO 226 N 0.22 4.28 0.00 0.00 0.04 0.22 -2.90 135.00 136.87 1y8b s PRO 226 Ca 0.21 2.15 -0.09 0.00 0.04 0.00 0.00 61.00 63.31 1y8b s PRO 226 Cb 0.30 -3.29 -0.05 0.00 0.04 0.00 0.00 34.50 31.50 1y8b s PRO 226 CO -0.08 -0.52 0.85 1.15 0.04 0.00 0.00 177.00 178.45 1y8b h THR 227 N 4.31 0.00 -2.74 1.26 2.02 -1.37 -3.47 112.91 112.92 1y8b h THR 227 Ca -0.42 -0.10 -0.48 0.00 0.77 0.00 0.00 66.41 66.19 1y8b h THR 227 Cb 1.20 0.00 -0.14 0.00 -1.74 0.00 0.00 68.15 67.47 1y8b h THR 227 CO 0.89 0.00 -0.67 0.00 0.37 0.00 0.00 175.52 176.11 1y8b s ILE 229 N -3.09 0.48 -0.12 0.00 1.01 -1.21 -2.10 121.20 116.17 1y8b s ILE 229 Ca 0.30 -0.77 -0.03 0.00 0.00 0.00 0.00 60.65 60.15 1y8b s ILE 229 Cb 0.04 -0.50 -0.03 0.00 0.01 0.00 0.00 42.46 41.98 1y8b s ILE 229 CO 0.12 -0.21 -0.03 -0.22 0.00 0.00 0.00 174.94 174.60 1y8b s LEU 230 N -1.06 3.34 0.13 2.97 2.96 -1.22 -2.69 118.68 123.11 1y8b s LEU 230 Ca -0.06 -0.04 0.08 0.00 -0.22 0.00 0.00 54.13 53.90 1y8b s LEU 230 Cb -0.07 -1.78 -0.04 0.00 0.50 0.00 0.00 46.19 44.80 1y8b s LEU 230 CO 0.00 0.25 -0.19 -0.76 -1.32 0.00 0.00 176.35 174.34 1y8b s LEU 231 N -0.15 2.38 -0.06 -0.68 1.43 0.15 -3.38 118.68 118.37 1y8b s LEU 231 Ca 0.03 -0.78 0.01 0.00 -1.03 0.00 0.00 54.13 52.37 1y8b s LEU 231 Cb -0.13 -0.81 0.02 0.00 0.03 0.00 0.00 46.19 45.30 1y8b s LEU 231 CO 0.02 -0.01 -0.08 -0.54 0.23 0.00 0.00 176.35 175.97 1y8b s LYS 232 N -2.40 1.28 -0.12 1.70 1.02 -1.23 -0.06 119.74 119.92 1y8b s LYS 232 Ca 0.11 -0.25 -0.21 0.00 0.02 0.00 0.00 55.97 55.64 1y8b s LYS 232 Cb -0.07 -1.17 0.05 0.00 -0.52 0.00 0.00 37.83 36.12 1y8b s LYS 232 CO 0.05 -0.06 0.52 1.21 -0.92 0.00 0.00 175.35 176.15 1y8b s ASN 233 N 0.92 -0.50 -0.61 2.83 3.84 -0.47 -4.57 114.94 116.38 1y8b s ASN 233 Ca -0.11 0.77 0.00 0.00 0.21 0.00 0.00 52.86 53.74 1y8b s ASN 233 Cb -0.15 0.79 0.00 0.00 -0.55 0.00 0.00 41.25 41.34 1y8b s ASN 233 CO 0.01 -0.34 0.00 0.59 -2.79 0.00 0.00 177.10 174.56 1y8b n ASN 234 N 2.01 -4.59 0.00 -4.21 5.03 -1.26 -0.22 115.26 112.02 1y8b n ASN 234 Ca -0.17 0.14 0.00 0.00 0.87 0.00 0.00 54.58 55.43 1y8b n ASN 234 Cb 0.56 -3.24 0.00 0.00 -1.02 0.00 0.00 39.78 36.09 1y8b n ASN 234 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1y8b n GLY 235 N 0.40 3.26 3.84 7.41 0.00 -1.26 -4.48 105.19 114.36 1y8b n GLY 235 Ca -0.06 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.62 1y8b n GLY 235 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1y8b s LEU 236 N 0.00 4.22 0.01 0.99 1.43 0.69 -4.16 118.68 121.86 1y8b s LEU 236 Ca 0.00 1.25 -0.06 0.00 -1.03 0.00 0.00 54.13 54.29 1y8b s LEU 236 Cb 0.00 -3.72 -0.05 0.00 0.03 0.00 0.00 46.19 42.46 1y8b s LEU 236 CO 0.00 -0.05 0.26 -1.00 0.23 0.00 0.00 176.35 175.79 1y8b s HIS 237 N -1.71 3.57 -0.06 0.29 3.76 -1.26 -1.37 115.29 118.51 1y8b s HIS 237 Ca 0.47 0.55 0.01 0.00 -0.15 0.00 0.00 55.06 55.94 1y8b s HIS 237 Cb -0.13 -1.97 0.02 0.00 1.11 0.00 0.00 32.58 31.60 1y8b s HIS 237 CO 0.19 0.62 -0.08 0.42 -0.85 0.00 0.00 174.74 175.04 1y8b s ILE 238 N -1.30 0.82 -0.08 0.60 1.01 0.91 -2.11 121.20 121.05 1y8b s ILE 238 Ca 0.27 -0.28 0.03 0.00 0.00 0.00 0.00 60.65 60.67 1y8b s ILE 238 Cb -0.13 -0.80 0.01 0.00 0.01 0.00 0.00 42.46 41.55 1y8b s ILE 238 CO 0.16 0.29 -0.16 -0.70 0.00 0.00 0.00 174.94 174.53 1y8b s GLU 239 N 0.90 2.20 -0.14 2.79 2.12 0.21 0.30 118.70 127.08 1y8b s GLU 239 Ca -0.11 -0.58 -0.15 0.00 0.36 0.00 0.00 54.97 54.49 1y8b s GLU 239 Cb -0.15 -1.76 -0.05 0.00 0.26 0.00 0.00 34.13 32.44 1y8b s GLU 239 CO 0.01 0.06 0.34 -0.51 -0.54 0.00 0.00 175.26 174.62 1y8b s LEU 240 N 0.61 4.27 -0.85 2.70 1.43 -1.09 -0.31 118.68 125.43 1y8b s LEU 240 Ca -0.15 0.62 -0.15 0.00 -1.03 0.00 0.00 54.13 53.42 1y8b s LEU 240 Cb -0.16 -2.46 0.20 0.00 0.03 0.00 0.00 46.19 43.80 1y8b s LEU 240 CO 0.05 0.10 0.84 -1.10 0.23 0.00 0.00 176.35 176.47 1y8b s GLN 241 N 0.37 3.62 0.08 1.70 -1.52 -1.11 -3.36 119.66 119.44 1y8b s GLN 241 Ca 0.19 -2.35 -0.31 0.00 -1.95 0.00 0.00 55.36 50.95 1y8b s GLN 241 Cb -0.14 -4.53 -0.08 0.00 -0.22 0.00 0.00 33.01 28.05 1y8b s GLN 241 CO 0.06 -1.38 1.48 0.42 -0.25 0.00 0.00 175.29 175.62 1y8b s ILE 242 N 0.61 3.26 0.25 1.08 -1.09 -1.17 -2.39 121.20 121.76 1y8b s ILE 242 Ca 0.21 0.80 -0.13 0.00 -2.23 0.00 0.00 60.65 59.31 1y8b s ILE 242 Cb -0.09 -3.52 -0.09 0.00 -1.58 0.00 0.00 42.46 37.18 1y8b s ILE 242 CO -0.09 0.03 0.03 -0.67 -1.23 0.00 0.00 174.94 173.01 1y8b n ASP 243 N 4.77 -1.83 -2.75 3.58 -0.08 -1.06 -4.78 116.55 114.40 1y8b n ASP 243 Ca 0.13 0.48 -0.01 0.00 -1.51 0.00 0.00 54.79 53.89 1y8b n ASP 243 Cb 0.42 -0.54 0.02 0.00 2.34 0.00 0.00 41.12 43.36 1y8b n ASP 243 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1y8b s ALA 244 N -1.05 -4.21 -1.25 -1.67 0.00 -1.26 -4.92 121.76 107.39 1y8b s ALA 244 Ca 0.36 0.84 0.00 0.00 0.00 0.00 0.00 51.96 53.16 1y8b s ALA 244 Cb -0.38 -2.97 0.00 0.00 0.00 0.00 0.00 23.12 19.77 1y8b s ALA 244 CO 0.39 -2.48 0.00 0.09 0.00 0.00 0.00 175.76 173.76 1y8b n ASN 245 N 3.24 -4.26 -4.92 0.00 3.02 -1.26 -4.94 115.26 106.15 1y8b n ASN 245 Ca 0.09 0.18 -0.23 0.00 -0.03 0.00 0.00 54.58 54.59 1y8b n ASN 245 Cb 0.63 -3.64 0.06 0.00 -0.61 0.00 0.00 39.78 36.22 1y8b n ASN 245 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1y8b s GLY 246 N -2.06 1.78 -0.09 7.41 0.00 -1.26 -5.04 107.32 108.06 1y8b s GLY 246 Ca 0.00 -1.24 -0.06 0.00 0.00 0.00 0.00 44.72 43.42 1y8b s GLY 246 CO 0.00 -0.88 0.21 -0.09 0.00 0.00 0.00 173.10 172.33 1y8b h ARG 247 N -0.23 -0.08 0.00 2.90 1.12 -1.99 -3.22 114.38 112.88 1y8b h ARG 247 Ca -0.42 0.01 0.00 0.00 -1.11 0.00 0.00 59.98 58.45 1y8b h ARG 247 Cb 1.30 0.02 0.00 0.00 -0.01 0.00 0.00 29.97 31.28 1y8b h ARG 247 CO 0.53 0.08 0.57 0.82 -3.11 0.00 0.00 179.97 178.85 1y8b h ILE 248 N -1.01 0.00 0.00 1.20 1.08 -1.96 0.54 117.51 117.36 1y8b h ILE 248 Ca -0.01 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.46 1y8b h ILE 248 Cb 0.19 0.34 0.00 0.00 -3.07 0.00 0.00 36.82 34.27 1y8b h ILE 248 CO 0.01 0.00 0.24 0.61 -0.69 0.00 0.00 178.15 178.32 1y8b n GLY 249 N -1.32 -0.49 0.07 5.37 0.00 -1.22 0.69 105.19 108.31 1y8b n GLY 249 Ca -0.01 0.07 0.15 0.00 0.00 0.00 0.00 46.02 46.23 1y8b n GLY 249 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1y8b n LYS 250 N -1.72 1.10 -0.61 1.61 4.81 0.18 -3.42 118.16 120.11 1y8b n LYS 250 Ca -0.00 -0.15 0.02 0.00 -0.87 0.00 0.00 58.31 57.31 1y8b n LYS 250 Cb 0.25 -1.48 0.03 0.00 0.02 0.00 0.00 35.03 33.85 1y8b n LYS 250 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1y8b n ASP 251 N -0.80 0.59 -3.99 3.14 9.92 0.22 -5.07 116.55 120.55 1y8b n ASP 251 Ca 0.23 -2.24 -0.09 0.00 -0.53 0.00 0.00 54.79 52.15 1y8b n ASP 251 Cb 0.14 -0.27 -0.11 0.00 -0.64 0.00 0.00 41.12 40.25 1y8b n ASP 251 CO 0.00 0.00 0.00 -1.81 0.13 0.00 0.00 177.20 175.52 1y8b s ASP 252 N -1.54 0.31 0.00 -2.24 1.11 -1.22 -5.01 116.67 108.08 1y8b s ASP 252 Ca 0.12 -0.51 0.00 0.00 0.18 0.00 0.00 52.55 52.34 1y8b s ASP 252 Cb 0.12 0.09 0.00 0.00 1.07 0.00 0.00 42.92 44.21 1y8b s ASP 252 CO -0.03 -0.29 0.34 -0.81 1.18 0.00 0.00 175.17 175.56 1y8b n PRO 253 N 1.58 0.37 0.00 8.23 -0.04 -1.26 -4.72 135.00 139.16 1y8b n PRO 253 Ca -0.24 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.22 1y8b n PRO 253 Cb 0.55 -1.03 0.00 0.00 -0.04 0.00 0.00 33.50 32.98 1y8b n PRO 253 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1y8b n ALA 254 N -0.35 0.00 -0.41 0.55 0.00 -1.26 -4.91 120.51 114.14 1y8b n ALA 254 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1y8b n ALA 254 Cb 0.02 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.47 1y8b n ALA 254 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1y8b n HIS 255 N -2.00 0.00 -4.10 0.00 8.25 -1.26 -3.36 115.22 112.75 1y8b n HIS 255 Ca 0.00 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.14 1y8b n HIS 255 Cb 0.00 -0.30 -0.16 0.00 1.12 0.00 0.00 29.99 30.65 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 -1.32 1.95 -0.88 1.59 1.01 -1.26 -2.55 121.20 119.73 1y8b s ILE 256 Ca 0.00 -0.88 0.20 0.00 0.00 0.00 0.00 60.65 59.97 1y8b s ILE 256 Cb 0.00 -1.78 -0.22 0.00 0.01 0.00 0.00 42.46 40.47 1y8b s ILE 256 CO 0.00 0.51 0.82 -0.46 0.00 0.00 0.00 174.94 175.81 1y8b n ASN 257 N 4.65 0.90 -3.68 3.58 2.04 -1.00 -4.78 115.26 116.97 1y8b n ASN 257 Ca -0.20 -0.91 0.01 0.00 -0.44 0.00 0.00 54.58 53.04 1y8b n ASN 257 Cb 0.50 1.06 0.01 0.00 -2.53 0.00 0.00 39.78 38.82 1y8b n ASN 257 CO 0.00 0.00 0.00 -0.62 -0.44 0.00 0.00 177.26 176.20 1y8b s ASP 258 N -2.96 -0.01 -0.04 0.53 2.15 -1.21 -4.87 116.67 110.25 1y8b s ASP 258 Ca 0.07 -0.31 -0.01 0.00 0.43 0.00 0.00 52.55 52.72 1y8b s ASP 258 Cb 0.15 0.24 0.03 0.00 -0.30 0.00 0.00 42.92 43.04 1y8b s ASP 258 CO 0.82 -0.47 0.08 -0.69 -0.17 0.00 0.00 175.17 174.74 1y8b s VAL 259 N -2.15 -0.07 -0.20 1.11 1.01 -1.26 -2.74 120.40 116.10 1y8b s VAL 259 Ca 0.25 0.23 -0.03 0.00 0.00 0.00 0.00 61.98 62.43 1y8b s VAL 259 Cb -0.00 -0.16 -0.01 0.00 0.00 0.00 0.00 36.38 36.21 1y8b s VAL 259 CO 0.00 0.09 -0.07 -0.63 0.00 0.00 0.00 175.10 174.49 1y8b s ILE 260 N 1.28 3.22 0.04 2.22 1.09 0.57 -1.41 121.20 128.21 1y8b s ILE 260 Ca -0.07 -0.56 0.06 0.00 -1.10 0.00 0.00 60.65 58.98 1y8b s ILE 260 Cb -0.12 -2.43 -0.02 0.00 -1.06 0.00 0.00 42.46 38.82 1y8b s ILE 260 CO -0.04 0.46 -0.17 0.68 -0.10 0.00 0.00 174.94 175.77 1y8b s VAL 261 N 1.19 1.34 -0.51 2.92 -7.23 -1.26 0.65 120.40 117.49 1y8b s VAL 261 Ca 0.02 -1.07 -0.27 0.00 -1.81 0.00 0.00 61.98 58.85 1y8b s VAL 261 Cb -0.14 -1.19 -0.02 0.00 0.56 0.00 0.00 36.38 35.59 1y8b s VAL 261 CO -0.02 0.09 1.79 -0.70 -0.31 0.00 0.00 175.10 175.95 1y8b s GLU 262 N -1.13 2.93 -0.13 4.82 2.12 -0.90 -4.24 118.70 122.17 1y8b s GLU 262 Ca 0.04 0.86 -0.07 0.00 0.36 0.00 0.00 54.97 56.17 1y8b s GLU 262 Cb -0.08 -4.29 -0.04 0.00 0.26 0.00 0.00 34.13 29.97 1y8b s GLU 262 CO 0.01 -2.36 -0.02 0.00 -0.54 0.00 0.00 175.26 172.36 1y8b h ALA 263 N 13.88 0.01 -2.45 6.30 0.00 -1.70 -3.43 119.26 131.86 1y8b h ALA 263 Ca -0.28 -0.31 -0.77 0.00 0.00 0.00 0.00 54.91 53.55 1y8b h ALA 263 Cb 1.16 0.25 -0.25 0.00 0.00 0.00 0.00 17.79 18.95 1y8b h ALA 263 CO 1.15 0.25 0.00 0.00 0.00 0.00 0.00 179.25 180.65 1y8b s ALA 264 N -2.60 3.85 -1.87 0.00 0.00 -1.23 -4.18 121.76 115.73 1y8b s ALA 264 Ca -0.09 -2.94 0.31 0.00 0.00 0.00 0.00 51.96 49.24 1y8b s ALA 264 Cb 0.01 -3.44 1.79 0.00 0.00 0.00 0.00 23.12 21.48 1y8b s ALA 264 CO 0.16 -2.21 2.16 -0.89 0.00 0.00 0.00 175.76 174.99 1y8b n ILE 265 N 4.61 0.01 -3.60 0.00 2.08 -1.24 -4.24 119.36 116.98 1y8b n ILE 265 Ca 0.02 0.00 -0.15 0.00 0.56 0.00 0.00 62.75 63.18 1y8b n ILE 265 Cb 0.44 -0.51 -0.07 0.00 -0.75 0.00 0.00 39.64 38.75 1y8b n ILE 265 CO 0.00 0.00 0.00 -0.55 0.56 0.00 0.00 176.55 176.56 1y8b s SER 266 N -2.13 -0.72 -0.06 4.38 0.15 -1.26 -3.99 113.70 110.07 1y8b s SER 266 Ca 0.43 1.25 -0.07 0.00 0.70 0.00 0.00 55.95 58.26 1y8b s SER 266 Cb 0.21 1.21 0.02 0.00 -1.71 0.00 0.00 66.02 65.75 1y8b s SER 266 CO 0.38 -0.35 0.18 0.42 1.20 0.00 0.00 173.24 175.08 1y8b s THR 267 N -0.06 0.01 -0.17 6.45 -4.23 0.18 -2.04 115.64 115.78 1y8b s THR 267 Ca -0.03 -0.08 -0.03 0.00 -1.18 0.00 0.00 61.69 60.37 1y8b s THR 267 Cb -0.04 -0.29 -0.02 0.00 1.34 0.00 0.00 72.50 73.50 1y8b s THR 267 CO 0.03 -0.04 -0.06 0.27 -0.54 0.00 0.00 174.62 174.29 1y8b s ILE 268 N -0.07 3.58 -0.00 2.99 -0.00 -1.21 0.11 121.20 126.59 1y8b s ILE 268 Ca -0.02 -0.46 -0.06 0.00 -0.00 0.00 0.00 60.65 60.12 1y8b s ILE 268 Cb -0.02 -2.57 -0.05 0.00 -0.00 0.00 0.00 42.46 39.82 1y8b s ILE 268 CO 0.00 0.48 0.25 -0.76 -0.00 0.00 0.00 174.94 174.91 1y8b s LEU 269 N 0.69 4.37 -0.25 0.37 1.43 -1.12 -3.00 118.68 121.18 1y8b s LEU 269 Ca -0.03 0.52 -0.01 0.00 -1.03 0.00 0.00 54.13 53.58 1y8b s LEU 269 Cb -0.15 -2.62 -0.01 0.00 0.03 0.00 0.00 46.19 43.44 1y8b s LEU 269 CO 0.02 0.27 0.22 0.47 0.23 0.00 0.00 176.35 177.56 1y8b n ASP 270 N 1.16 -3.20 0.00 2.29 8.00 -1.24 -2.65 116.55 120.90 1y8b n ASP 270 Ca -0.12 -0.15 0.00 0.00 0.71 0.00 0.00 54.79 55.23 1y8b n ASP 270 Cb 0.53 -1.74 0.00 0.00 -0.02 0.00 0.00 41.12 39.89 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 0.00 0.00 0.26 0.00 1.02 -1.26 -4.58 120.64 116.09 1y8b n GLU 272 Ca 0.00 0.00 0.17 0.00 -0.02 0.00 0.00 57.16 57.31 1y8b n GLU 272 Cb 0.00 -0.37 0.79 0.00 -0.02 0.00 0.00 31.44 31.84 1y8b n GLU 272 CO 0.00 0.00 0.00 0.38 1.18 0.00 0.00 177.13 178.69 1y8b h ASP 273 N 0.00 0.00 0.00 1.62 2.03 -1.98 -3.35 116.42 114.73 1y8b h ASP 273 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1y8b h ASP 273 Cb 0.13 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.63 1y8b h ASP 273 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 179.24 177.01 1y8b n SER 274 N -2.86 0.00 -4.95 4.15 7.64 -1.26 -3.58 113.62 112.76 1y8b n SER 274 Ca -0.00 0.00 -0.23 0.00 1.01 0.00 0.00 58.87 59.65 1y8b n SER 274 Cb 0.20 -0.17 -0.00 0.00 -1.01 0.00 0.00 64.21 63.24 1y8b n SER 274 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1y8b s VAL 275 N -0.33 4.52 -0.29 0.44 0.11 -1.26 -4.95 120.40 118.65 1y8b s VAL 275 Ca 0.00 -0.48 0.04 0.00 -2.93 0.00 0.00 61.98 58.62 1y8b s VAL 275 Cb 0.00 -3.66 0.18 0.00 -1.53 0.00 0.00 36.38 31.37 1y8b s VAL 275 CO 0.00 -0.45 0.52 0.00 -3.33 0.00 0.00 175.10 171.84 1y8b s ALA 276 N -2.44 -1.92 0.03 1.54 0.00 -1.26 -4.02 121.76 113.68 1y8b s ALA 276 Ca 0.44 0.71 -0.16 0.00 0.00 0.00 0.00 51.96 52.95 1y8b s ALA 276 Cb -0.10 -2.36 0.03 0.00 0.00 0.00 0.00 23.12 20.69 1y8b s ALA 276 CO 0.37 -1.81 0.34 0.00 0.00 0.00 0.00 175.76 174.66 1y8b s ALA 277 N 2.70 -0.82 -0.30 0.00 0.00 -1.26 -4.93 121.76 117.15 1y8b s ALA 277 Ca 0.10 0.18 0.05 0.00 0.00 0.00 0.00 51.96 52.29 1y8b s ALA 277 Cb -0.11 0.28 0.20 0.00 0.00 0.00 0.00 23.12 23.48 1y8b s ALA 277 CO -0.27 -0.40 0.62 0.54 0.00 0.00 0.00 175.76 176.25 1y8b s VAL 278 N -2.27 -0.96 0.03 0.00 0.11 -1.26 -5.03 120.40 111.01 1y8b s VAL 278 Ca -0.07 0.00 -0.12 0.00 -2.93 0.00 0.00 61.98 58.87 1y8b s VAL 278 Cb -0.02 -0.85 0.01 0.00 -1.53 0.00 0.00 36.38 34.00 1y8b s VAL 278 CO -0.01 0.00 0.25 -0.62 -3.33 0.00 0.00 175.10 171.39 1y8b s ASP 279 N 2.72 -0.05 0.13 3.54 -1.08 -1.26 -4.72 116.67 115.95 1y8b s ASP 279 Ca 0.11 -0.24 -0.20 0.00 -0.52 0.00 0.00 52.55 51.70 1y8b s ASP 279 Cb -0.09 0.32 -0.01 0.00 -1.46 0.00 0.00 42.92 41.68 1y8b s ASP 279 CO -0.24 -0.56 1.69 0.00 0.52 0.00 0.00 175.17 176.58 1y8b h ALA 280 N 3.43 0.13 0.00 3.66 0.00 -1.91 -1.33 119.26 123.24 1y8b h ALA 280 Ca -0.32 0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.64 1y8b h ALA 280 Cb 1.19 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 19.17 1y8b h ALA 280 CO 0.46 -0.48 -0.17 0.93 0.00 0.00 0.00 179.25 179.98 1y8b h GLU 281 N -0.02 0.00 -0.23 0.00 5.08 -1.96 -3.27 114.58 114.17 1y8b h GLU 281 Ca 0.11 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.52 1y8b h GLU 281 Cb 0.19 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.39 1y8b h GLU 281 CO -0.24 0.17 -0.05 0.22 -1.00 0.00 0.00 179.01 178.11 1y8b h ASP 282 N 0.00 -0.20 -1.00 1.42 1.82 -1.62 -1.83 116.42 115.00 1y8b h ASP 282 Ca -0.00 0.07 0.26 0.00 -0.39 0.00 0.00 57.03 56.97 1y8b h ASP 282 Cb 0.98 0.14 -0.19 0.00 0.68 0.00 0.00 39.33 40.94 1y8b h ASP 282 CO 0.02 -0.07 -0.01 0.11 -1.61 0.00 0.00 179.24 177.68 1y8b h LYS 283 N 0.01 0.00 -0.62 0.28 1.79 -1.57 1.08 116.57 117.53 1y8b h LYS 283 Ca 0.11 -0.00 0.12 0.00 -2.18 0.00 0.00 60.65 58.70 1y8b h LYS 283 Cb 0.17 -0.00 -0.09 0.00 -1.58 0.00 0.00 32.23 30.73 1y8b h LYS 283 CO -0.23 0.00 0.14 0.82 -1.08 0.00 0.00 179.45 179.09 1y8b h ILE 284 N 0.00 0.63 -0.00 1.86 1.08 -1.53 0.66 117.51 120.20 1y8b h ILE 284 Ca 0.59 -0.09 -0.00 0.00 -0.39 0.00 0.00 64.86 64.97 1y8b h ILE 284 Cb 1.18 0.34 -0.00 0.00 -3.07 0.00 0.00 36.82 35.27 1y8b h ILE 284 CO -0.95 0.05 -0.00 -0.07 -0.69 0.00 0.00 178.15 176.49 1y8b h LEU 285 N 0.26 0.01 0.55 1.44 3.38 0.11 0.30 115.31 121.36 1y8b h LEU 285 Ca 0.33 -0.34 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 1y8b h LEU 285 Cb 0.49 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.24 1y8b h LEU 285 CO -0.41 0.35 -0.33 0.25 0.09 0.00 0.00 178.44 178.38 1y8b h LEU 286 N -0.33 -0.82 -1.66 1.67 5.85 -0.28 -2.39 115.31 117.35 1y8b h LEU 286 Ca 0.00 0.05 0.03 0.00 0.84 0.00 0.00 57.88 58.80 1y8b h LEU 286 Cb 0.34 0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.59 1y8b h LEU 286 CO 0.00 -0.52 0.28 0.22 -0.34 0.00 0.00 178.44 178.09 1y8b h TYR 287 N -0.83 0.43 -0.52 1.25 3.20 0.25 -2.84 116.97 117.91 1y8b h TYR 287 Ca -0.07 0.01 0.08 0.00 3.14 0.00 0.00 58.73 61.89 1y8b h TYR 287 Cb 0.67 -0.14 -0.10 0.00 1.54 0.00 0.00 36.73 38.70 1y8b h TYR 287 CO -0.09 0.25 -0.45 -0.09 -1.64 0.00 0.00 178.16 176.14 1y8b h ARG 288 N 0.45 -0.26 -0.42 1.82 2.43 -0.39 -1.56 114.38 116.44 1y8b h ARG 288 Ca 0.17 0.02 0.05 0.00 -0.81 0.00 0.00 59.98 59.41 1y8b h ARG 288 Cb 0.14 0.06 -0.08 0.00 -0.42 0.00 0.00 29.97 29.67 1y8b h ARG 288 CO -0.04 -0.17 -0.50 -0.91 -1.51 0.00 0.00 179.97 176.84 1y8b h ASN 289 N -0.27 -1.68 -0.56 -3.80 2.35 -1.50 1.83 115.58 111.95 1y8b h ASN 289 Ca 0.15 0.22 0.09 0.00 -0.55 0.00 0.00 56.30 56.22 1y8b h ASN 289 Cb 0.57 0.69 -0.11 0.00 0.05 0.00 0.00 38.32 39.53 1y8b h ASN 289 CO -0.65 -0.34 -0.42 -0.07 -1.65 0.00 0.00 177.43 174.30 1y8b h LEU 290 N -0.31 -1.44 -1.43 1.61 4.07 -1.44 0.98 115.31 117.35 1y8b h LEU 290 Ca 0.07 0.24 -0.02 0.00 0.08 0.00 0.00 57.88 58.25 1y8b h LEU 290 Cb 0.51 0.66 -0.00 0.00 1.08 0.00 0.00 40.66 42.90 1y8b h LEU 290 CO -0.56 -0.34 -0.09 -0.07 -1.08 0.00 0.00 178.44 176.30 1y8b h LEU 291 N -0.23 0.00 0.00 1.67 -0.00 -0.40 -2.80 115.31 113.55 1y8b h LEU 291 Ca 0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.06 1y8b h LEU 291 Cb 0.56 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.22 1y8b h LEU 291 CO -0.67 0.09 -0.09 1.23 -0.00 0.00 0.00 178.44 179.00 1y8b h GLY 292 N 1.87 0.00 1.35 0.83 0.00 0.80 -3.30 103.07 104.62 1y8b h GLY 292 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1y8b h GLY 292 CO 0.01 0.00 0.23 1.47 0.00 0.00 0.00 176.54 178.25 1y8b n LEU 293 N -3.98 0.33 0.30 3.11 -0.00 0.28 -1.04 117.00 116.01 1y8b n LEU 293 Ca -0.01 0.56 0.18 0.00 -0.00 0.00 0.00 56.01 56.74 1y8b n LEU 293 Cb 0.05 -0.54 0.92 0.00 -0.00 0.00 0.00 43.42 43.85 1y8b n LEU 293 CO 0.02 -0.68 1.15 -0.03 -0.00 0.00 0.00 177.39 177.85 1y8b h MET 294 N 0.00 0.00 0.10 1.47 4.05 -1.57 -0.85 114.93 118.13 1y8b h MET 294 Ca 0.00 0.00 -0.27 0.00 -0.28 0.00 0.00 59.70 59.15 1y8b h MET 294 Cb 0.46 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 31.26 1y8b h MET 294 CO 0.00 0.00 -1.39 1.96 0.23 0.00 0.00 176.91 177.71 1y8b h GLN 295 N 0.00 0.22 0.00 0.39 7.50 -1.32 -3.49 115.11 118.42 1y8b h GLN 295 Ca 0.03 -0.38 0.00 0.00 0.50 0.00 0.00 58.65 58.80 1y8b h GLN 295 Cb 0.51 0.14 0.00 0.00 0.05 0.00 0.00 27.48 28.18 1y8b h GLN 295 CO -0.00 1.18 0.00 0.41 -1.50 0.00 0.00 178.83 178.92 1y8b n GLY 296 N 1.73 1.49 0.42 3.46 0.00 -0.32 -4.95 105.19 107.01 1y8b n GLY 296 Ca -0.25 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.77 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 -1.17 0.00 -1.41 2.61 5.66 -1.26 -4.83 114.28 113.88 1y8b n THR 297 Ca 0.00 0.00 -0.41 0.00 -3.05 0.00 0.00 64.05 60.59 1y8b n THR 297 Cb 0.00 0.00 0.01 0.00 -1.55 0.00 0.00 70.33 68.79 1y8b n THR 297 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1y8b n LEU 298 N 0.00 -0.75 -4.19 1.09 -0.00 -1.26 -4.47 117.00 107.42 1y8b n LEU 298 Ca -0.00 0.84 -0.11 0.00 -0.00 0.00 0.00 56.01 56.74 1y8b n LEU 298 Cb 0.42 -1.06 -0.10 0.00 -0.00 0.00 0.00 43.42 42.68 1y8b n LEU 298 CO -0.00 -3.33 -0.31 0.00 -0.00 0.00 0.00 177.39 173.75 1y8b s GLN 299 N -1.50 1.01 -0.16 1.47 -2.07 -1.26 -4.16 119.66 112.99 1y8b s GLN 299 Ca 0.63 -1.48 -0.05 0.00 -1.82 0.00 0.00 55.36 52.63 1y8b s GLN 299 Cb -0.58 0.01 -0.03 0.00 -1.09 0.00 0.00 33.01 31.33 1y8b s GLN 299 CO 0.59 -0.20 0.01 -2.00 -1.32 0.00 0.00 175.29 172.37 1y8b s GLU 300 N -3.99 3.77 0.51 9.60 2.12 -1.21 -5.03 118.70 124.47 1y8b s GLU 300 Ca 0.24 -0.43 -0.06 0.00 0.36 0.00 0.00 54.97 55.08 1y8b s GLU 300 Cb 0.07 -3.04 -0.03 0.00 0.26 0.00 0.00 34.13 31.39 1y8b s GLU 300 CO 0.03 0.29 0.82 0.15 -0.54 0.00 0.00 175.26 176.00 1y8b s LYS 301 N 0.27 3.44 0.49 4.30 3.01 -1.26 -4.24 119.74 125.76 1y8b s LYS 301 Ca 0.00 0.19 -0.22 0.00 -1.01 0.00 0.00 55.97 54.93 1y8b s LYS 301 Cb -0.13 -2.34 -0.07 0.00 -1.01 0.00 0.00 37.83 34.28 1y8b s LYS 301 CO 0.02 -0.31 1.18 -1.64 0.51 0.00 0.00 175.35 175.11 1y8b s MET 302 N -4.80 3.57 -0.20 1.68 -1.94 -1.26 -4.83 119.30 111.51 1y8b s MET 302 Ca 0.49 1.78 -0.17 0.00 -1.71 0.00 0.00 55.69 56.08 1y8b s MET 302 Cb -0.10 -2.28 -0.03 0.00 2.01 0.00 0.00 34.83 34.42 1y8b s MET 302 CO 0.45 -0.71 0.47 -1.21 -0.01 0.00 0.00 175.02 174.01 1y8b s GLU 303 N -2.88 4.19 0.61 2.03 0.41 -1.26 -4.80 118.70 117.00 1y8b s GLU 303 Ca 0.67 0.34 -0.18 0.00 -0.41 0.00 0.00 54.97 55.39 1y8b s GLU 303 Cb -0.29 -3.55 -0.07 0.00 -1.78 0.00 0.00 34.13 28.44 1y8b s GLU 303 CO 0.34 -0.10 0.56 1.17 -0.49 0.00 0.00 175.26 176.74 1y8b n LYS 304 N 4.64 0.50 0.00 1.61 4.81 -1.26 0.24 118.16 128.70 1y8b n LYS 304 Ca -0.06 0.20 0.00 0.00 -0.87 0.00 0.00 58.31 57.58 1y8b n LYS 304 Cb 0.51 -1.77 0.00 0.00 0.02 0.00 0.00 35.03 33.79 1y8b n LYS 304 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1y8b n ASN 305 N 0.22 0.00 -0.44 3.14 4.13 -1.26 -3.36 115.26 117.69 1y8b n ASN 305 Ca 0.11 0.00 0.38 0.00 1.68 0.00 0.00 54.58 56.75 1y8b n ASN 305 Cb 0.48 0.00 0.69 0.00 -1.54 0.00 0.00 39.78 39.41 1y8b n ASN 305 CO 0.00 0.00 0.00 1.23 0.28 0.00 0.00 177.26 178.77 1y8b h GLY 306 N 0.00 0.62 -5.65 7.41 0.00 -2.00 -3.46 103.07 99.99 1y8b h GLY 306 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 47.33 47.26 1y8b h GLY 306 CO 0.00 -0.15 -0.97 0.54 0.00 0.00 0.00 176.54 175.96 1y8b n ARG 307 N -4.36 -2.36 -3.04 4.80 3.00 0.67 -4.92 116.66 110.44 1y8b n ARG 307 Ca 0.33 2.06 -0.21 0.00 -0.01 0.00 0.00 57.85 60.02 1y8b n ARG 307 Cb 1.41 -3.33 0.01 0.00 0.00 0.00 0.00 32.46 30.54 1y8b n ARG 307 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.63 176.49 1y8b s GLN 308 N -1.07 2.93 0.17 5.56 2.00 -1.25 -4.78 119.66 123.22 1y8b s GLN 308 Ca -0.05 -0.81 -0.28 0.00 -2.00 0.00 0.00 55.36 52.23 1y8b s GLN 308 Cb 0.00 -2.64 -0.08 0.00 0.80 0.00 0.00 33.01 31.09 1y8b s GLN 308 CO 0.43 -0.28 0.86 -1.50 -0.50 0.00 0.00 175.29 174.31 1y8b s ILE 309 N -2.47 4.32 0.05 -2.34 2.07 -1.26 -4.48 121.20 117.09 1y8b s ILE 309 Ca 0.50 1.90 -0.16 0.00 -1.41 0.00 0.00 60.65 61.48 1y8b s ILE 309 Cb -0.10 -4.24 -0.06 0.00 0.13 0.00 0.00 42.46 38.19 1y8b s ILE 309 CO 0.35 0.47 0.49 -0.69 -1.91 0.00 0.00 174.94 173.65 1y8b s VAL 310 N -0.86 4.89 -0.18 4.00 1.01 -1.26 -4.93 120.40 123.07 1y8b s VAL 310 Ca 0.40 0.98 -0.02 0.00 0.00 0.00 0.00 61.98 63.35 1y8b s VAL 310 Cb -0.24 -3.79 0.05 0.00 0.00 0.00 0.00 36.38 32.40 1y8b s VAL 310 CO 0.29 0.52 -0.00 -0.13 0.00 0.00 0.00 175.10 175.77 1y8b s ARG 311 N -1.23 1.00 0.06 2.72 0.52 -1.26 -5.02 118.95 115.73 1y8b s ARG 311 Ca 0.28 -0.47 0.00 0.00 -0.52 0.00 0.00 55.73 55.03 1y8b s ARG 311 Cb -0.18 -2.02 -0.04 0.00 0.52 0.00 0.00 34.95 33.24 1y8b s ARG 311 CO 0.17 -0.54 0.18 0.21 0.02 0.00 0.00 175.30 175.34 1y8b s LYS 312 N 1.74 3.33 -0.23 3.54 2.20 -1.26 -3.31 119.74 125.76 1y8b s LYS 312 Ca -0.00 -0.47 -0.07 0.00 -0.36 0.00 0.00 55.97 55.06 1y8b s LYS 312 Cb -0.16 -2.99 -0.03 0.00 -1.51 0.00 0.00 37.83 33.14 1y8b s LYS 312 CO -0.07 0.61 0.05 -1.17 -0.36 0.00 0.00 175.35 174.41 1y8b s LEU 313 N -2.42 3.42 0.00 5.43 0.20 -1.26 -5.07 118.68 118.99 1y8b s LEU 313 Ca 0.33 -0.18 0.00 0.00 0.69 0.00 0.00 54.13 54.97 1y8b s LEU 313 Cb -0.13 -1.90 0.00 0.00 -0.43 0.00 0.00 46.19 43.73 1y8b s LEU 313 CO 0.26 0.01 0.00 0.59 -0.29 0.00 0.00 176.35 176.92 1y8b n ASN 314 N 4.62 0.00 0.00 3.68 5.03 -1.26 -4.81 115.26 122.51 1y8b n ASN 314 Ca -0.16 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.29 1y8b n ASN 314 Cb 0.52 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.28 1y8b n ASN 314 CO 0.00 0.00 0.00 -0.67 -1.83 0.00 0.00 177.26 174.76 1y8b n ASP 315 N 0.00 0.41 -0.27 6.41 2.03 -1.26 -4.82 116.55 119.04 1y8b n ASP 315 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1y8b n ASP 315 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1y8b n ASP 315 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 1y8b n ASP 316 N 0.00 0.95 -3.71 1.67 5.75 -1.26 -4.78 116.55 115.17 1y8b n ASP 316 Ca 0.00 -0.14 -0.12 0.00 -0.01 0.00 0.00 54.79 54.52 1y8b n ASP 316 Cb 0.00 0.00 -0.13 0.00 -1.03 0.00 0.00 41.12 39.96 1y8b n ASP 316 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1y8b s ARG 317 N 1.50 0.22 0.41 0.11 0.52 -1.26 -5.09 118.95 115.35 1y8b s ARG 317 Ca 0.00 0.63 -0.09 0.00 -0.52 0.00 0.00 55.73 55.75 1y8b s ARG 317 Cb 0.00 -0.08 -0.06 0.00 0.52 0.00 0.00 34.95 35.34 1y8b s ARG 317 CO 0.00 -0.19 0.75 -1.58 0.02 0.00 0.00 175.30 174.30 1y8b s HIS 318 N 1.57 3.49 0.06 -0.53 2.46 -1.26 -4.36 115.29 116.72 1y8b s HIS 318 Ca -0.07 0.97 -0.07 0.00 0.47 0.00 0.00 55.06 56.36 1y8b s HIS 318 Cb -0.11 -2.39 -0.01 0.00 -0.13 0.00 0.00 32.58 29.95 1y8b s HIS 318 CO -0.09 -0.11 0.15 0.71 -2.47 0.00 0.00 174.74 172.92 1y8b s TYR 319 N -2.41 0.18 0.05 3.88 2.02 -0.29 -4.98 117.35 115.80 1y8b s TYR 319 Ca 0.50 -0.55 -0.18 0.00 -0.37 0.00 0.00 57.07 56.47 1y8b s TYR 319 Cb -0.10 -0.11 -0.06 0.00 -0.40 0.00 0.00 41.96 41.28 1y8b s TYR 319 CO 0.34 -0.46 0.51 0.99 -1.57 0.00 0.00 175.55 175.36 1y8b s THR 320 N -3.33 4.84 0.67 -0.71 2.01 0.83 0.23 115.64 120.17 1y8b s THR 320 Ca 0.01 1.08 -0.10 0.00 0.31 0.00 0.00 61.69 62.99 1y8b s THR 320 Cb 0.03 -3.83 0.01 0.00 0.01 0.00 0.00 72.50 68.71 1y8b s THR 320 CO -0.08 0.55 1.05 0.00 -0.69 0.00 0.00 174.62 175.45 1y8b s ALA 321 N -1.11 3.00 0.55 7.40 0.00 0.78 0.18 121.76 132.56 1y8b s ALA 321 Ca 0.27 -0.40 0.25 0.00 0.00 0.00 0.00 51.96 52.09 1y8b s ALA 321 Cb -0.18 -2.94 1.47 0.00 0.00 0.00 0.00 23.12 21.47 1y8b s ALA 321 CO 0.17 -1.03 2.05 0.00 0.00 0.00 0.00 175.76 176.96 1y8b h ALA 322 N -0.52 2.16 -0.25 0.00 0.00 -1.82 0.62 119.26 119.44 1y8b h ALA 322 Ca -0.45 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1y8b h ALA 322 Cb 1.25 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1y8b h ALA 322 CO 0.63 -0.42 0.00 -0.25 0.00 0.00 0.00 179.25 179.21 1y8b n ASP 323 N -4.17 1.44 0.00 0.00 9.92 -1.26 -4.84 116.55 117.64 1y8b n ASP 323 Ca 0.05 -2.02 0.00 0.00 -0.53 0.00 0.00 54.79 52.29 1y8b n ASP 323 Cb 0.43 -0.19 0.00 0.00 -0.64 0.00 0.00 41.12 40.71 1y8b n ASP 323 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1y8b n GLY 324 N 0.87 1.19 3.74 0.44 0.00 0.22 -5.02 105.19 106.62 1y8b n GLY 324 Ca 0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.82 1y8b n GLY 324 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1y8b s SER 325 N -3.11 2.94 -0.39 1.61 0.01 -1.24 -4.52 113.70 109.00 1y8b s SER 325 Ca 0.00 0.94 -0.12 0.00 1.31 0.00 0.00 55.95 58.08 1y8b s SER 325 Cb 0.00 -1.47 0.03 0.00 0.21 0.00 0.00 66.02 64.78 1y8b s SER 325 CO 0.00 -2.91 0.23 -1.61 0.41 0.00 0.00 173.24 169.36 1y8b s GLU 326 N -5.24 2.83 0.32 12.44 0.41 -1.26 0.28 118.70 128.48 1y8b s GLU 326 Ca 0.66 -1.09 0.08 0.00 -0.41 0.00 0.00 54.97 54.20 1y8b s GLU 326 Cb -0.15 -3.79 -0.03 0.00 -1.78 0.00 0.00 34.13 28.38 1y8b s GLU 326 CO 0.55 -0.73 0.21 0.96 -0.49 0.00 0.00 175.26 175.76 1y8b s ILE 327 N 1.57 3.45 -0.04 -1.63 -4.36 0.14 -4.87 121.20 115.45 1y8b s ILE 327 Ca 0.03 -1.52 -0.06 0.00 -0.26 0.00 0.00 60.65 58.84 1y8b s ILE 327 Cb -0.19 -3.12 0.01 0.00 1.25 0.00 0.00 42.46 40.41 1y8b s ILE 327 CO 0.07 -0.21 0.15 -0.94 0.24 0.00 0.00 174.94 174.25 1y8b s SER 328 N -3.91 -0.10 -0.31 4.36 1.04 -1.26 -1.14 113.70 112.38 1y8b s SER 328 Ca 0.38 0.15 -0.05 0.00 0.48 0.00 0.00 55.95 56.91 1y8b s SER 328 Cb -0.05 0.28 0.04 0.00 0.10 0.00 0.00 66.02 66.39 1y8b s SER 328 CO 0.25 -0.15 0.06 -0.76 0.98 0.00 0.00 173.24 173.61 1y8b s LEU 329 N -0.38 4.03 0.00 2.42 1.02 -1.26 -5.01 118.68 119.49 1y8b s LEU 329 Ca -0.05 -1.10 0.00 0.00 0.02 0.00 0.00 54.13 53.01 1y8b s LEU 329 Cb -0.03 -1.81 0.00 0.00 0.02 0.00 0.00 46.19 44.37 1y8b s LEU 329 CO 0.01 -0.27 0.00 0.00 0.02 0.00 0.00 176.35 176.10 1y8b n HIS 330 N 4.75 0.00 0.00 0.29 1.44 -1.26 -4.67 115.22 115.77 1y8b n HIS 330 Ca -0.13 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.58 1y8b n HIS 330 Cb 0.45 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.56 1y8b n HIS 330 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1y8b n GLY 331 N 0.00 0.86 3.19 -1.39 0.00 -1.26 -4.87 105.19 101.73 1y8b n GLY 331 Ca 0.00 -0.06 -0.22 0.00 0.00 0.00 0.00 46.02 45.74 1y8b n GLY 331 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1y8b n ARG 332 N 0.00 0.51 -2.04 1.61 1.85 -1.26 -4.55 116.66 112.78 1y8b n ARG 332 Ca 0.00 -3.30 -0.41 0.00 -1.00 0.00 0.00 57.85 53.14 1y8b n ARG 332 Cb 0.00 2.15 -0.02 0.00 -1.05 0.00 0.00 32.46 33.54 1y8b n ARG 332 CO 0.00 0.00 0.00 -1.12 -0.01 0.00 0.00 177.63 176.50 1y8b s SER 333 N -3.36 6.67 0.11 2.89 0.01 -1.25 -4.90 113.70 113.87 1y8b s SER 333 Ca 0.27 2.74 -0.31 0.00 1.31 0.00 0.00 55.95 59.96 1y8b s SER 333 Cb 0.01 -2.64 -0.11 0.00 0.21 0.00 0.00 66.02 63.49 1y8b s SER 333 CO 0.19 -0.63 1.84 0.18 0.41 0.00 0.00 173.24 175.23 1y8b n LEU 334 N 1.19 3.99 -4.25 2.44 4.32 -1.26 -4.83 117.00 118.61 1y8b n LEU 334 Ca 0.02 0.99 -0.35 0.00 -0.02 0.00 0.00 56.01 56.65 1y8b n LEU 334 Cb 0.41 -1.53 -0.14 0.00 -1.62 0.00 0.00 43.42 40.53 1y8b n LEU 334 CO 0.60 0.15 -0.42 -1.48 -1.22 0.00 0.00 177.39 175.03 1y8b s LEU 335 N 2.81 2.85 0.53 2.23 0.05 -1.26 0.51 118.68 126.39 1y8b s LEU 335 Ca 0.83 -0.57 0.06 0.00 0.05 0.00 0.00 54.13 54.50 1y8b s LEU 335 Cb -0.50 -1.67 0.05 0.00 -2.05 0.00 0.00 46.19 42.02 1y8b s LEU 335 CO 0.38 -0.05 0.72 -0.36 -0.55 0.00 0.00 176.35 176.50 1y8b s PHE 336 N 1.40 2.22 -0.27 3.48 0.08 0.31 -4.77 117.98 120.43 1y8b s PHE 336 Ca 0.04 -0.43 -0.05 0.00 0.12 0.00 0.00 56.93 56.61 1y8b s PHE 336 Cb -0.15 -2.46 0.01 0.00 -0.57 0.00 0.00 43.02 39.85 1y8b s PHE 336 CO -0.05 -0.88 0.03 0.42 -0.10 0.00 0.00 175.22 174.63 1y8b s ILE 337 N -2.61 3.64 -0.33 0.64 -1.09 0.87 -2.79 121.20 119.52 1y8b s ILE 337 Ca 0.59 -0.71 0.04 0.00 -2.23 0.00 0.00 60.65 58.34 1y8b s ILE 337 Cb -0.08 -2.83 0.10 0.00 -1.58 0.00 0.00 42.46 38.07 1y8b s ILE 337 CO 0.37 0.18 0.05 -0.60 -1.23 0.00 0.00 174.94 173.71 1y8b s ARG 338 N 1.46 1.44 -0.11 2.79 3.00 -1.09 -2.19 118.95 124.26 1y8b s ARG 338 Ca 0.03 -1.79 -0.04 0.00 -1.00 0.00 0.00 55.73 52.93 1y8b s ARG 338 Cb -0.16 -3.09 -0.04 0.00 0.00 0.00 0.00 34.95 31.66 1y8b s ARG 338 CO -0.00 -0.93 0.04 -0.80 0.00 0.00 0.00 175.30 173.60 1y8b s ASN 339 N 0.97 5.49 -0.05 -2.12 0.01 -1.26 -4.20 114.94 113.78 1y8b s ASN 339 Ca 0.10 0.18 -0.04 0.00 -0.71 0.00 0.00 52.86 52.39 1y8b s ASN 339 Cb -0.19 -1.69 -0.04 0.00 0.41 0.00 0.00 41.25 39.74 1y8b s ASN 339 CO -0.09 0.34 0.16 0.54 -1.51 0.00 0.00 177.10 176.54 1y8b s VAL 340 N -0.63 5.43 0.00 1.60 0.11 -1.26 -4.75 120.40 120.90 1y8b s VAL 340 Ca 0.11 -0.03 0.00 0.00 -2.93 0.00 0.00 61.98 59.13 1y8b s VAL 340 Cb -0.12 -3.47 0.00 0.00 -1.53 0.00 0.00 36.38 31.26 1y8b s VAL 340 CO 0.02 0.44 0.00 0.61 -3.33 0.00 0.00 175.10 172.84 1y8b n GLY 341 N 1.36 -1.81 0.00 6.54 0.00 -1.26 -4.81 105.19 105.20 1y8b n GLY 341 Ca -0.14 0.74 0.00 0.00 0.00 0.00 0.00 46.02 46.62 1y8b n GLY 341 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1y8b n HIS 342 N 0.00 0.00 0.23 1.61 -0.00 -1.26 -3.55 115.22 112.24 1y8b n HIS 342 Ca 0.00 0.00 0.12 0.00 -0.00 0.00 0.00 57.72 57.84 1y8b n HIS 342 Cb 0.00 0.00 0.40 0.00 -0.00 0.00 0.00 29.99 30.39 1y8b n HIS 342 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.34 176.27 1y8b h LEU 343 N 0.00 0.00 0.01 0.27 4.07 -1.92 -3.18 115.31 114.56 1y8b h LEU 343 Ca 0.00 0.00 -0.19 0.00 0.08 0.00 0.00 57.88 57.77 1y8b h LEU 343 Cb 0.00 0.00 0.02 0.00 1.08 0.00 0.00 40.66 41.76 1y8b h LEU 343 CO 0.00 0.15 -0.73 0.24 -1.08 0.00 0.00 178.44 177.01 1y8b h MET 344 N 0.00 0.48 -2.12 1.13 2.86 -1.98 -3.50 114.93 111.81 1y8b h MET 344 Ca -0.00 -0.53 0.00 0.00 -2.06 0.00 0.00 59.70 57.11 1y8b h MET 344 Cb 0.82 0.15 0.00 0.00 0.06 0.00 0.00 31.60 32.63 1y8b h MET 344 CO 0.02 1.17 -0.33 2.41 1.06 0.00 0.00 176.91 181.24 1y8b n THR 345 N -4.12 -5.85 -3.69 2.22 -1.04 -1.20 -4.71 114.28 95.89 1y8b n THR 345 Ca -0.11 1.19 -0.16 0.00 -2.04 0.00 0.00 64.05 62.92 1y8b n THR 345 Cb 0.74 -3.16 -0.16 0.00 -1.82 0.00 0.00 70.33 65.93 1y8b n THR 345 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1y8b s ILE 346 N -0.25 -0.19 0.03 12.58 1.01 -1.26 -4.99 121.20 128.13 1y8b s ILE 346 Ca 0.00 0.32 -0.30 0.00 0.00 0.00 0.00 60.65 60.67 1y8b s ILE 346 Cb 0.00 -0.25 -0.05 0.00 0.01 0.00 0.00 42.46 42.17 1y8b s ILE 346 CO 0.00 0.14 1.22 -2.16 0.00 0.00 0.00 174.94 174.13 1y8b s PRO 347 N 1.99 4.40 0.00 2.79 0.04 -1.26 -4.27 135.00 138.69 1y8b s PRO 347 Ca 0.00 1.76 0.00 0.00 0.04 0.00 0.00 61.00 62.80 1y8b s PRO 347 Cb -0.12 -3.42 0.00 0.00 0.04 0.00 0.00 34.50 31.00 1y8b s PRO 347 CO -0.05 -0.33 0.00 0.28 0.04 0.00 0.00 177.00 176.94 1y8b n VAL 348 N 4.16 0.00 -4.31 -0.36 0.31 -1.26 -4.64 118.33 112.24 1y8b n VAL 348 Ca 0.10 0.00 -0.18 0.00 -0.01 0.00 0.00 64.34 64.25 1y8b n VAL 348 Cb 0.46 -0.18 -0.10 0.00 -0.91 0.00 0.00 33.84 33.10 1y8b n VAL 348 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1y8b s ILE 349 N -1.41 1.58 -0.07 2.52 1.01 -1.26 -4.52 121.20 119.05 1y8b s ILE 349 Ca 0.00 -2.06 -0.17 0.00 0.00 0.00 0.00 60.65 58.43 1y8b s ILE 349 Cb 0.00 -1.89 -0.05 0.00 0.01 0.00 0.00 42.46 40.53 1y8b s ILE 349 CO 0.00 -0.55 0.44 0.26 0.00 0.00 0.00 174.94 175.08 1y8b s TRP 350 N -2.76 3.60 0.77 3.97 0.52 -1.26 -4.71 118.94 119.06 1y8b s TRP 350 Ca 0.18 0.91 -0.12 0.00 0.02 0.00 0.00 56.10 57.10 1y8b s TRP 350 Cb -0.02 -2.43 0.05 0.00 -1.15 0.00 0.00 33.47 29.93 1y8b s TRP 350 CO 0.05 0.37 1.14 0.34 0.02 0.00 0.00 176.95 178.87 1y8b s ASP 351 N -0.09 4.88 0.29 2.95 -1.08 -1.26 -2.86 116.67 119.51 1y8b s ASP 351 Ca 0.24 0.93 0.14 0.00 -0.52 0.00 0.00 52.55 53.35 1y8b s ASP 351 Cb -0.16 -1.55 0.34 0.00 -1.46 0.00 0.00 42.92 40.09 1y8b s ASP 351 CO 0.11 -1.68 1.58 0.77 0.52 0.00 0.00 175.17 176.47 1y8b h SER 352 N -0.90 0.00 0.56 -0.34 4.64 -1.94 -3.06 113.55 112.51 1y8b h SER 352 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1y8b h SER 352 Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 1y8b h SER 352 CO 0.65 0.56 -1.04 -0.62 -0.87 0.00 0.00 176.83 175.51 1y8b n GLU 353 N -3.51 0.37 -1.99 4.77 1.02 -1.26 -4.98 120.64 115.05 1y8b n GLU 353 Ca 0.00 0.02 -0.01 0.00 -0.02 0.00 0.00 57.16 57.15 1y8b n GLU 353 Cb 0.65 -1.64 0.00 0.00 -0.02 0.00 0.00 31.44 30.43 1y8b n GLU 353 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1y8b n GLY 354 N 1.32 -0.49 3.67 0.62 0.00 -1.16 -4.98 105.19 104.18 1y8b n GLY 354 Ca 0.01 0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.41 7.00 0.65 1.61 0.02 -1.26 -4.87 114.94 115.68 1y8b s ASN 355 Ca 0.02 1.24 0.12 0.00 -1.02 0.00 0.00 52.86 53.21 1y8b s ASN 355 Cb -0.00 -2.48 0.53 0.00 0.02 0.00 0.00 41.25 39.32 1y8b s ASN 355 CO 0.23 -0.46 1.26 -0.08 0.02 0.00 0.00 177.10 178.07 1y8b h GLU 356 N 7.37 0.00 -3.22 -0.60 4.22 -2.03 -2.79 114.58 117.52 1y8b h GLU 356 Ca -0.27 0.00 -0.62 0.00 0.08 0.00 0.00 59.36 58.55 1y8b h GLU 356 Cb 1.12 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 29.96 1y8b h GLU 356 CO 0.87 0.00 -0.72 0.96 -2.18 0.00 0.00 179.01 177.94 1y8b s ILE 357 N -4.13 1.61 0.00 2.32 -4.36 -1.26 -5.10 121.20 110.27 1y8b s ILE 357 Ca -0.01 -2.55 0.00 0.00 -0.26 0.00 0.00 60.65 57.82 1y8b s ILE 357 Cb 0.05 -2.14 0.00 0.00 1.25 0.00 0.00 42.46 41.62 1y8b s ILE 357 CO 0.17 -0.84 0.00 -2.65 0.24 0.00 0.00 174.94 171.86 1y8b n PRO 358 N 3.65 0.05 -1.21 0.37 -0.02 -1.06 -4.99 135.00 131.79 1y8b n PRO 358 Ca 0.06 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.54 1y8b n PRO 358 Cb 0.35 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.83 1y8b n PRO 358 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1y8b n GLU 359 N 0.00 0.00 0.00 -0.52 4.07 -1.26 -4.95 120.64 117.98 1y8b n GLU 359 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 1y8b n GLU 359 Cb 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.38 1y8b n GLU 359 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1y8b n GLY 360 N 0.00 0.53 0.13 8.31 0.00 -1.26 -4.03 105.19 108.86 1y8b n GLY 360 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 1y8b n GLY 360 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 1y8b h ILE 361 N 1.26 0.00 -0.96 -0.61 3.07 -1.87 -3.33 117.51 115.07 1y8b h ILE 361 Ca 0.00 -0.76 0.28 0.00 1.55 0.00 0.00 64.86 65.93 1y8b h ILE 361 Cb 0.45 1.52 -0.04 0.00 -0.27 0.00 0.00 36.82 38.48 1y8b h ILE 361 CO 0.00 0.00 1.04 0.17 -1.05 0.00 0.00 178.15 178.31 1y8b h LEU 362 N 0.00 0.00 -0.32 0.16 -0.00 -1.92 2.17 115.31 115.40 1y8b h LEU 362 Ca 0.00 0.00 -0.19 0.00 -0.00 0.00 0.00 57.88 57.69 1y8b h LEU 362 Cb 0.88 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.53 1y8b h LEU 362 CO 0.00 0.00 -0.85 0.44 -0.00 0.00 0.00 178.44 178.03 1y8b h ASP 363 N 0.00 0.20 -0.26 0.17 3.32 -1.95 -2.83 116.42 115.06 1y8b h ASP 363 Ca 0.46 -0.16 0.00 0.00 0.02 0.00 0.00 57.03 57.35 1y8b h ASP 363 Cb 2.54 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 42.01 1y8b h ASP 363 CO -0.00 0.96 0.17 1.23 -1.72 0.00 0.00 179.24 179.87 1y8b h GLY 364 N 1.95 0.37 1.52 2.75 0.00 0.33 2.28 103.07 112.27 1y8b h GLY 364 Ca -0.03 -0.13 -0.11 0.00 0.00 0.00 0.00 47.33 47.05 1y8b h GLY 364 CO 0.13 0.13 -0.30 -2.08 0.00 0.00 0.00 176.54 174.42 1y8b h VAL 365 N 0.35 1.28 0.00 4.60 2.07 -1.58 -3.09 116.25 119.88 1y8b h VAL 365 Ca 0.10 -1.39 -0.03 0.00 0.82 0.00 0.00 66.70 66.20 1y8b h VAL 365 Cb -0.03 1.40 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 1y8b h VAL 365 CO -0.03 0.44 -0.26 0.24 0.02 0.00 0.00 177.57 177.98 1y8b h MET 366 N 0.47 0.00 -0.04 1.57 2.07 -1.17 -3.05 114.93 114.78 1y8b h MET 366 Ca 0.06 0.00 0.01 0.00 -2.07 0.00 0.00 59.70 57.70 1y8b h MET 366 Cb 0.76 0.00 -0.00 0.00 -1.87 0.00 0.00 31.60 30.49 1y8b h MET 366 CO 0.06 0.50 0.76 0.00 1.07 0.00 0.00 176.91 179.29 1y8b h THR 367 N -1.00 0.01 0.01 2.22 1.03 0.37 0.28 112.91 115.82 1y8b h THR 367 Ca -0.05 0.00 -0.21 0.00 -0.01 0.00 0.00 66.41 66.14 1y8b h THR 367 Cb 0.62 0.25 -0.03 0.00 -1.07 0.00 0.00 68.15 67.92 1y8b h THR 367 CO -0.03 0.00 -1.13 1.23 -0.01 0.00 0.00 175.52 175.58 1y8b h GLY 368 N 0.00 0.02 -0.62 2.99 0.00 -1.61 -3.37 103.07 100.48 1y8b h GLY 368 Ca 0.02 -0.05 0.19 0.00 0.00 0.00 0.00 47.33 47.48 1y8b h GLY 368 CO -0.00 0.05 -0.09 0.00 0.00 0.00 0.00 176.54 176.49 1y8b h ALA 369 N -0.40 0.74 -0.91 3.60 0.00 -0.33 1.24 119.26 123.20 1y8b h ALA 369 Ca -0.31 0.30 0.26 0.00 0.00 0.00 0.00 54.91 55.17 1y8b h ALA 369 Cb 1.31 0.56 -0.04 0.00 0.00 0.00 0.00 17.79 19.62 1y8b h ALA 369 CO -0.17 -0.44 0.92 0.82 0.00 0.00 0.00 179.25 180.38 1y8b h ILE 370 N 0.04 0.18 0.00 0.00 2.04 -1.66 1.71 117.51 119.81 1y8b h ILE 370 Ca 0.44 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.28 1y8b h ILE 370 Cb 0.76 0.28 -0.00 0.00 -0.74 0.00 0.00 36.82 37.12 1y8b h ILE 370 CO -0.81 0.00 -0.11 0.00 0.00 0.00 0.00 178.15 177.23 1y8b h ALA 371 N 1.02 1.16 -0.10 1.87 0.00 0.14 -2.08 119.26 121.27 1y8b h ALA 371 Ca 0.43 -0.10 0.03 0.00 0.00 0.00 0.00 54.91 55.27 1y8b h ALA 371 Cb 2.26 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 20.03 1y8b h ALA 371 CO -0.00 0.14 0.07 1.25 0.00 0.00 0.00 179.25 180.71 1y8b h LEU 372 N 0.00 0.00 0.35 0.00 6.46 0.25 -1.61 115.31 120.76 1y8b h LEU 372 Ca -0.00 0.00 -0.02 0.00 -0.12 0.00 0.00 57.88 57.74 1y8b h LEU 372 Cb 0.41 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.34 1y8b h LEU 372 CO 0.01 0.00 -0.17 0.22 -0.62 0.00 0.00 178.44 177.89 1y8b h TYR 373 N 0.00 -0.44 -0.05 1.25 3.20 -1.51 -2.06 116.97 117.37 1y8b h TYR 373 Ca 0.05 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 61.92 1y8b h TYR 373 Cb 0.19 0.14 -0.00 0.00 1.54 0.00 0.00 36.73 38.60 1y8b h TYR 373 CO 0.00 -0.27 0.33 -0.44 -1.64 0.00 0.00 178.16 176.14 1y8b h ASP 374 N -0.94 0.00 0.17 -2.11 3.32 -1.60 0.15 116.42 115.41 1y8b h ASP 374 Ca -0.05 0.00 -0.33 0.00 0.02 0.00 0.00 57.03 56.67 1y8b h ASP 374 Cb 0.36 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.92 1y8b h ASP 374 CO 0.08 0.00 -1.67 -0.07 -1.72 0.00 0.00 179.24 175.85 1y8b h LEU 375 N 0.00 0.56 0.08 1.55 3.38 -1.25 -3.30 115.31 116.33 1y8b h LEU 375 Ca 0.02 -0.92 -0.26 0.00 0.09 0.00 0.00 57.88 56.82 1y8b h LEU 375 Cb 0.68 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 1y8b h LEU 375 CO -0.00 1.75 -1.34 0.11 0.09 0.00 0.00 178.44 179.05 1y8b h LYS 376 N 0.01 0.17 0.02 1.13 1.57 -0.52 -3.39 116.57 115.55 1y8b h LYS 376 Ca -0.34 -0.28 0.00 0.00 -1.87 0.00 0.00 60.65 58.16 1y8b h LYS 376 Cb 2.02 0.11 -0.00 0.00 0.08 0.00 0.00 32.23 34.43 1y8b h LYS 376 CO 0.15 1.14 -0.04 -0.39 -0.57 0.00 0.00 179.45 179.73 1y8b h VAL 377 N -0.49 0.00 -3.33 0.50 -1.51 -0.96 -3.45 116.25 107.01 1y8b h VAL 377 Ca -0.31 0.00 -0.40 0.00 -1.23 0.00 0.00 66.70 64.76 1y8b h VAL 377 Cb 1.62 0.00 -0.01 0.00 -2.13 0.00 0.00 31.29 30.77 1y8b h VAL 377 CO -0.01 0.00 -0.53 0.00 -1.23 0.00 0.00 177.57 175.79 1y8b n GLN 378 N -2.64 -2.26 -0.02 5.19 -0.00 -1.24 -4.82 117.38 111.57 1y8b n GLN 378 Ca -0.01 0.96 0.01 0.00 -0.00 0.00 0.00 57.00 57.96 1y8b n GLN 378 Cb 0.03 -5.66 -0.08 0.00 -0.00 0.00 0.00 30.24 24.53 1y8b n GLN 378 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 1y8b n LYS 379 N -3.17 1.25 -3.16 2.61 5.02 -1.26 -4.90 118.16 114.54 1y8b n LYS 379 Ca -0.22 -0.06 0.04 0.00 -2.02 0.00 0.00 58.31 56.05 1y8b n LYS 379 Cb 0.67 -1.25 -0.00 0.00 -0.02 0.00 0.00 35.03 34.43 1y8b n LYS 379 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1y8b s ASN 380 N -3.64 -1.59 -0.14 4.39 3.04 -1.26 -5.12 114.94 110.60 1y8b s ASN 380 Ca -0.04 0.06 -0.04 0.00 0.04 0.00 0.00 52.86 52.88 1y8b s ASN 380 Cb 0.05 2.01 0.07 0.00 -1.54 0.00 0.00 41.25 41.84 1y8b s ASN 380 CO 0.42 -0.28 0.19 -0.94 -3.04 0.00 0.00 177.10 173.45 1y8b s SER 381 N 2.70 1.09 0.11 -4.21 1.04 -1.26 -5.00 113.70 108.17 1y8b s SER 381 Ca 0.11 0.06 -0.22 0.00 0.48 0.00 0.00 55.95 56.39 1y8b s SER 381 Cb -0.09 0.32 -0.10 0.00 0.10 0.00 0.00 66.02 66.24 1y8b s SER 381 CO -0.23 -0.29 1.73 0.03 0.98 0.00 0.00 173.24 175.46 1y8b h ARG 382 N 8.34 0.01 -0.41 4.02 2.47 -1.96 -2.99 114.38 123.87 1y8b h ARG 382 Ca -0.15 -0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.57 1y8b h ARG 382 Cb 1.13 -0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.45 1y8b h ARG 382 CO 0.21 0.01 0.00 2.41 0.56 0.00 0.00 179.97 183.16 1y8b n THR 383 N -5.12 2.01 -0.64 2.04 -1.04 -1.26 -4.91 114.28 105.35 1y8b n THR 383 Ca -0.05 -1.50 -0.02 0.00 -2.04 0.00 0.00 64.05 60.44 1y8b n THR 383 Cb 0.06 -0.03 -0.01 0.00 -1.82 0.00 0.00 70.33 68.53 1y8b n THR 383 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1y8b n GLY 384 N 0.20 0.23 0.92 3.41 0.00 -1.13 -4.62 105.19 104.21 1y8b n GLY 384 Ca 0.21 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.21 1y8b n GLY 384 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1y8b n SER 385 N 1.20 -0.55 -4.05 1.61 3.41 -1.26 -4.83 113.62 109.15 1y8b n SER 385 Ca -0.02 -1.38 -0.22 0.00 -0.26 0.00 0.00 58.87 56.99 1y8b n SER 385 Cb 0.17 0.92 -0.16 0.00 -0.26 0.00 0.00 64.21 64.89 1y8b n SER 385 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1y8b s VAL 386 N -2.75 1.01 -0.29 -3.33 1.01 -1.26 -4.95 120.40 109.84 1y8b s VAL 386 Ca 0.04 -0.49 -0.08 0.00 0.00 0.00 0.00 61.98 61.45 1y8b s VAL 386 Cb -0.01 -0.89 -0.01 0.00 0.00 0.00 0.00 36.38 35.47 1y8b s VAL 386 CO 0.03 0.31 0.11 -0.31 0.00 0.00 0.00 175.10 175.24 1y8b s TYR 387 N 0.15 3.15 -0.37 5.22 1.51 -1.26 -2.71 117.35 123.04 1y8b s TYR 387 Ca -0.03 -0.65 -0.11 0.00 -1.01 0.00 0.00 57.07 55.27 1y8b s TYR 387 Cb -0.10 -2.30 0.02 0.00 -0.11 0.00 0.00 41.96 39.47 1y8b s TYR 387 CO 0.01 -0.47 0.20 0.42 -1.11 0.00 0.00 175.55 174.61 1y8b s ILE 388 N 1.58 4.61 -0.29 2.71 1.01 -1.14 -0.09 121.20 129.59 1y8b s ILE 388 Ca 0.04 -0.79 0.03 0.00 0.00 0.00 0.00 60.65 59.94 1y8b s ILE 388 Cb -0.17 -3.54 0.08 0.00 0.01 0.00 0.00 42.46 38.84 1y8b s ILE 388 CO 0.05 -0.19 -0.04 0.54 0.00 0.00 0.00 174.94 175.29 1y8b s VAL 389 N 1.57 2.19 -0.18 2.92 0.11 -0.93 -2.05 120.40 124.02 1y8b s VAL 389 Ca 0.03 -1.92 -0.05 0.00 -2.93 0.00 0.00 61.98 57.11 1y8b s VAL 389 Cb -0.19 -2.43 0.09 0.00 -1.53 0.00 0.00 36.38 32.32 1y8b s VAL 389 CO 0.07 -0.27 0.31 -0.54 -3.33 0.00 0.00 175.10 171.34 1y8b s LYS 390 N 1.03 0.23 -0.26 1.54 1.02 -1.26 -4.35 119.74 117.69 1y8b s LYS 390 Ca -0.01 0.69 -0.07 0.00 0.02 0.00 0.00 55.97 56.60 1y8b s LYS 390 Cb -0.20 -0.22 -0.06 0.00 -0.52 0.00 0.00 37.83 36.83 1y8b s LYS 390 CO -0.06 -0.40 1.25 -2.30 -0.92 0.00 0.00 175.35 172.92 1y8b n PRO 391 N 5.36 0.02 0.00 -1.68 -0.02 -1.26 -4.85 135.00 132.57 1y8b n PRO 391 Ca -0.06 -0.42 0.00 0.00 -2.02 0.00 0.00 63.50 61.00 1y8b n PRO 391 Cb 0.50 -1.72 0.00 0.00 -0.02 0.00 0.00 33.50 32.26 1y8b n PRO 391 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1y8b n LYS 392 N 5.37 0.84 -0.26 -0.52 5.02 -1.26 -4.79 118.16 122.56 1y8b n LYS 392 Ca 0.10 0.00 -0.15 0.00 -2.02 0.00 0.00 58.31 56.24 1y8b n LYS 392 Cb 0.48 0.00 0.15 0.00 -0.02 0.00 0.00 35.03 35.64 1y8b n LYS 392 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 1y8b n MET 393 N -0.14 -2.29 0.00 1.97 2.81 -1.26 -5.02 117.12 113.19 1y8b n MET 393 Ca 0.00 -0.72 0.00 0.00 -1.81 0.00 0.00 57.70 55.17 1y8b n MET 393 Cb 0.00 -1.15 0.00 0.00 -0.71 0.00 0.00 33.22 31.36 1y8b n MET 393 CO 0.00 0.00 0.00 1.58 1.51 0.00 0.00 175.97 179.06 1y8b n HIS 394 N -4.33 0.00 -0.31 2.03 -0.00 -1.26 -4.74 115.22 106.61 1y8b n HIS 394 Ca 0.07 0.00 -0.12 0.00 0.46 0.00 0.00 57.72 58.13 1y8b n HIS 394 Cb 0.30 0.32 -0.02 0.00 -0.12 0.00 0.00 29.99 30.47 1y8b n HIS 394 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1y8b n GLY 395 N 1.91 0.01 0.54 1.57 0.00 -1.26 -4.06 105.19 103.90 1y8b n GLY 395 Ca 0.00 0.17 0.32 0.00 0.00 0.00 0.00 46.02 46.51 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 0.82 0.00 0.00 1.61 0.11 -1.89 1.75 132.00 134.40 1y8b h PRO 396 Ca -0.08 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.94 1y8b h PRO 396 Cb 0.25 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.35 1y8b h PRO 396 CO 0.16 0.00 -0.90 1.96 -0.21 0.00 0.00 178.00 179.02 1y8b h GLN 397 N 0.00 0.00 0.01 1.05 1.08 -1.97 -3.29 115.11 111.99 1y8b h GLN 397 Ca 0.52 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.72 1y8b h GLN 397 Cb 2.70 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 30.13 1y8b h GLN 397 CO -0.01 0.22 -0.01 0.93 -0.95 0.00 0.00 178.83 179.02 1y8b h GLU 398 N 0.00 -0.02 -0.97 1.46 4.39 0.24 -3.23 114.58 116.45 1y8b h GLU 398 Ca -0.06 0.00 0.28 0.00 0.34 0.00 0.00 59.36 59.92 1y8b h GLU 398 Cb 1.30 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.91 1y8b h GLU 398 CO 0.03 0.57 0.76 0.28 -1.16 0.00 0.00 179.01 179.49 1y8b h VAL 399 N -0.99 0.40 -0.47 3.13 2.07 -1.52 1.06 116.25 119.93 1y8b h VAL 399 Ca -0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.50 1y8b h VAL 399 Cb 0.59 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 30.79 1y8b h VAL 399 CO 0.00 0.00 0.23 0.00 0.02 0.00 0.00 177.57 177.83 1y8b h ALA 400 N 1.39 1.53 0.00 1.67 0.00 -1.62 0.40 119.26 122.63 1y8b h ALA 400 Ca 0.46 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 55.21 1y8b h ALA 400 Cb 1.98 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 19.56 1y8b h ALA 400 CO -0.00 0.38 -0.35 0.74 0.00 0.00 0.00 179.25 180.02 1y8b h PHE 401 N 0.66 0.00 0.03 0.00 -1.00 0.11 0.58 116.94 117.32 1y8b h PHE 401 Ca 0.17 0.00 -0.07 0.00 2.81 0.00 0.00 57.97 60.87 1y8b h PHE 401 Cb 0.06 0.00 0.01 0.00 3.61 0.00 0.00 35.95 39.62 1y8b h PHE 401 CO 0.00 0.35 -0.31 0.00 -1.61 0.00 0.00 178.31 176.74 1y8b h ALA 402 N 1.65 -0.00 -0.10 2.45 0.00 -0.93 -3.28 119.26 119.05 1y8b h ALA 402 Ca -0.00 -0.53 -0.14 0.00 0.00 0.00 0.00 54.91 54.23 1y8b h ALA 402 Cb 0.64 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1y8b h ALA 402 CO 0.05 0.13 -0.57 -0.91 0.00 0.00 0.00 179.25 177.94 1y8b h ASN 403 N -0.61 0.35 -0.96 0.00 4.21 -0.88 -2.92 115.58 114.77 1y8b h ASN 403 Ca -0.05 -0.19 0.21 0.00 1.21 0.00 0.00 56.30 57.48 1y8b h ASN 403 Cb 1.15 -0.10 -0.08 0.00 -1.12 0.00 0.00 38.32 38.16 1y8b h ASN 403 CO 0.06 0.85 0.62 0.11 -1.29 0.00 0.00 177.43 177.77 1y8b h LYS 404 N 0.24 0.50 0.00 0.81 1.79 0.09 0.64 116.57 120.64 1y8b h LYS 404 Ca -0.00 -0.03 -0.12 0.00 -2.18 0.00 0.00 60.65 58.32 1y8b h LYS 404 Cb 1.07 -0.11 -0.02 0.00 -1.58 0.00 0.00 32.23 31.59 1y8b h LYS 404 CO 0.09 0.33 -0.58 -0.07 -1.08 0.00 0.00 179.45 178.14 1y8b h LEU 405 N 0.52 0.00 -0.65 2.94 3.38 -1.57 -3.27 115.31 116.66 1y8b h LEU 405 Ca 0.53 0.00 0.10 0.00 0.09 0.00 0.00 57.88 58.59 1y8b h LEU 405 Cb 1.15 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 41.79 1y8b h LEU 405 CO -0.26 0.58 -0.43 0.15 0.09 0.00 0.00 178.44 178.57 1y8b h PHE 406 N 0.00 -1.27 0.00 1.13 3.57 0.32 2.57 116.94 123.26 1y8b h PHE 406 Ca -0.01 0.09 -0.00 0.00 3.53 0.00 0.00 57.97 61.58 1y8b h PHE 406 Cb 1.17 0.64 -0.00 0.00 2.79 0.00 0.00 35.95 40.56 1y8b h PHE 406 CO 0.00 -0.41 -0.01 0.00 -2.23 0.00 0.00 178.31 175.65 1y8b h THR 407 N -0.19 0.23 0.00 4.41 1.03 -1.61 0.67 112.91 117.47 1y8b h THR 407 Ca 0.20 -0.10 -0.08 0.00 -0.01 0.00 0.00 66.41 66.42 1y8b h THR 407 Cb 0.56 1.08 -0.01 0.00 -1.07 0.00 0.00 68.15 68.70 1y8b h THR 407 CO -0.73 0.01 -0.48 -0.09 -0.01 0.00 0.00 175.52 174.22 1y8b h ARG 408 N 0.00 0.00 0.02 0.00 2.43 0.37 -3.14 114.38 114.06 1y8b h ARG 408 Ca -0.00 0.00 -0.21 0.00 -0.81 0.00 0.00 59.98 58.96 1y8b h ARG 408 Cb 0.08 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.61 1y8b h ARG 408 CO 0.00 0.74 -0.96 -0.84 -1.51 0.00 0.00 179.97 177.41 1y8b h ILE 409 N -1.00 1.56 -0.32 1.20 3.07 0.19 -2.75 117.51 119.45 1y8b h ILE 409 Ca -0.12 -2.91 -0.08 0.00 1.55 0.00 0.00 64.86 63.30 1y8b h ILE 409 Cb 0.90 2.64 -0.01 0.00 -0.27 0.00 0.00 36.82 40.08 1y8b h ILE 409 CO -0.07 0.84 -0.12 1.05 -1.05 0.00 0.00 178.15 178.80 1y8b h GLU 410 N 0.06 0.65 0.00 0.16 -0.00 0.21 0.53 114.58 116.19 1y8b h GLU 410 Ca -0.05 -0.27 -0.05 0.00 -0.00 0.00 0.00 59.36 58.99 1y8b h GLU 410 Cb 1.63 -0.03 -0.01 0.00 -0.00 0.00 0.00 28.75 30.35 1y8b h GLU 410 CO 0.14 0.85 -0.24 1.79 -0.00 0.00 0.00 179.01 181.55 1y8b h THR 411 N 0.42 0.85 0.00 -1.06 1.35 -1.60 0.21 112.91 113.08 1y8b h THR 411 Ca 0.07 -0.95 -0.02 0.00 -0.55 0.00 0.00 66.41 64.96 1y8b h THR 411 Cb 0.64 1.57 -0.00 0.00 -1.73 0.00 0.00 68.15 68.62 1y8b h THR 411 CO 0.04 0.24 -0.14 -0.03 -0.25 0.00 0.00 175.52 175.38 1y8b h MET 412 N 0.00 0.00 0.00 4.72 1.85 -1.14 -3.26 114.93 117.09 1y8b h MET 412 Ca -0.00 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.09 1y8b h MET 412 Cb 0.55 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.58 1y8b h MET 412 CO 0.03 0.63 0.00 1.28 -0.40 0.00 0.00 176.91 178.45 1y8b n LEU 413 N -4.65 0.25 -2.48 3.39 4.77 0.18 -4.86 117.00 113.60 1y8b n LEU 413 Ca -0.09 0.57 -0.12 0.00 -0.03 0.00 0.00 56.01 56.34 1y8b n LEU 413 Cb 0.33 -0.56 0.05 0.00 -2.33 0.00 0.00 43.42 40.92 1y8b n LEU 413 CO 0.21 -0.46 0.10 0.61 -1.33 0.00 0.00 177.39 176.52 1y8b n GLY 414 N -0.40 -0.03 0.00 -0.72 0.00 0.63 -4.90 105.19 99.78 1y8b n GLY 414 Ca 0.02 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1y8b n GLY 414 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1y8b n MET 415 N -3.10 0.57 -3.37 1.61 2.81 -0.54 -5.01 117.12 110.09 1y8b n MET 415 Ca -0.10 0.00 -0.19 0.00 -1.81 0.00 0.00 57.70 55.59 1y8b n MET 415 Cb 0.58 0.00 -0.01 0.00 -0.71 0.00 0.00 33.22 33.07 1y8b n MET 415 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1y8b s ALA 416 N -3.46 4.23 0.03 3.04 0.00 -1.26 -4.99 121.76 119.36 1y8b s ALA 416 Ca 0.00 -1.77 -0.07 0.00 0.00 0.00 0.00 51.96 50.12 1y8b s ALA 416 Cb 0.00 -1.29 -0.02 0.00 0.00 0.00 0.00 23.12 21.81 1y8b s ALA 416 CO 0.00 -0.22 1.12 -1.35 0.00 0.00 0.00 175.76 175.31 1y8b h PRO 417 N 0.89 -0.03 -0.86 0.00 0.11 -2.00 -3.35 132.00 126.77 1y8b h PRO 417 Ca -0.41 0.00 -0.34 0.00 0.11 0.00 0.00 66.00 65.36 1y8b h PRO 417 Cb 1.27 0.01 -0.37 0.00 0.11 0.00 0.00 31.00 32.01 1y8b h PRO 417 CO 0.53 -0.02 -1.10 0.09 -0.21 0.00 0.00 178.00 177.28 1y8b n ASN 418 N -3.41 1.10 -0.01 -2.05 3.02 -1.26 -4.90 115.26 107.74 1y8b n ASN 418 Ca 0.00 -2.64 -0.22 0.00 -0.03 0.00 0.00 54.58 51.69 1y8b n ASN 418 Cb 0.06 -0.37 -0.14 0.00 -0.61 0.00 0.00 39.78 38.73 1y8b n ASN 418 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 1y8b h THR 419 N 3.07 0.76 -2.18 3.41 2.02 -1.99 -3.42 112.91 114.59 1y8b h THR 419 Ca -0.12 -2.34 -0.57 0.00 0.77 0.00 0.00 66.41 64.15 1y8b h THR 419 Cb 1.20 2.51 0.00 0.00 -1.74 0.00 0.00 68.15 70.12 1y8b h THR 419 CO 0.42 0.76 1.39 -0.76 0.37 0.00 0.00 175.52 177.70 1y8b s LEU 420 N -7.30 3.76 0.56 2.58 1.43 -1.26 -4.55 118.68 113.90 1y8b s LEU 420 Ca -0.23 2.07 0.07 0.00 -1.03 0.00 0.00 54.13 55.02 1y8b s LEU 420 Cb 0.06 -3.52 0.07 0.00 0.03 0.00 0.00 46.19 42.83 1y8b s LEU 420 CO 0.75 -1.65 0.77 -0.75 0.23 0.00 0.00 176.35 175.69 1y8b s LYS 421 N 5.68 2.36 -0.24 1.70 2.47 -1.10 -4.77 119.74 125.84 1y8b s LYS 421 Ca 0.94 -1.42 -0.13 0.00 -1.56 0.00 0.00 55.97 53.81 1y8b s LYS 421 Cb -0.35 -2.62 0.07 0.00 -1.46 0.00 0.00 37.83 33.48 1y8b s LYS 421 CO 0.37 -0.79 0.58 1.41 0.16 0.00 0.00 175.35 177.07 1y8b s MET 422 N -4.66 0.57 -0.55 4.03 1.75 -1.25 -2.89 119.30 116.30 1y8b s MET 422 Ca 0.61 1.07 -0.25 0.00 -1.25 0.00 0.00 55.69 55.86 1y8b s MET 422 Cb -0.07 0.11 0.04 0.00 2.84 0.00 0.00 34.83 37.75 1y8b s MET 422 CO 0.38 -0.16 1.00 0.20 -0.65 0.00 0.00 175.02 175.80 1y8b s GLY 423 N 1.63 1.34 -0.47 2.11 0.00 -0.87 0.37 107.32 111.43 1y8b s GLY 423 Ca -0.09 -1.10 -0.25 0.00 0.00 0.00 0.00 44.72 43.27 1y8b s GLY 423 CO -0.17 2.16 0.91 -0.42 0.00 0.00 0.00 173.10 175.58 1y8b s ILE 424 N 4.19 4.48 0.00 0.90 1.09 -1.26 -4.16 121.20 126.45 1y8b s ILE 424 Ca 0.34 0.63 0.00 0.00 -1.10 0.00 0.00 60.65 60.52 1y8b s ILE 424 Cb -0.11 -4.43 0.00 0.00 -1.06 0.00 0.00 42.46 36.86 1y8b s ILE 424 CO 0.21 -0.86 0.00 0.23 -0.10 0.00 0.00 174.94 174.42 1y8b n MET 425 N 7.15 1.13 -3.76 2.79 2.81 -1.26 -4.54 117.12 121.43 1y8b n MET 425 Ca 0.05 0.00 -0.13 0.00 -1.81 0.00 0.00 57.70 55.81 1y8b n MET 425 Cb 0.48 0.00 -0.11 0.00 -0.71 0.00 0.00 33.22 32.88 1y8b n MET 425 CO 0.00 0.00 0.00 0.16 1.51 0.00 0.00 175.97 177.64 1y8b s ASP 426 N -1.00 -0.34 0.00 7.83 -4.77 -1.26 -5.03 116.67 112.10 1y8b s ASP 426 Ca 0.00 0.65 0.00 0.00 -3.30 0.00 0.00 52.55 49.90 1y8b s ASP 426 Cb 0.00 0.65 0.00 0.00 -1.09 0.00 0.00 42.92 42.48 1y8b s ASP 426 CO 0.00 -0.11 0.00 -0.62 0.70 0.00 0.00 175.17 175.14 1y8b n GLU 427 N 2.97 0.00 0.00 2.11 1.02 -1.26 -4.78 120.64 120.70 1y8b n GLU 427 Ca -0.13 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.01 1y8b n GLU 427 Cb 0.58 -0.01 0.00 0.00 -0.02 0.00 0.00 31.44 31.98 1y8b n GLU 427 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1y8b n GLU 428 N -2.46 0.00 0.05 3.49 1.02 -1.26 -4.15 120.64 117.32 1y8b n GLU 428 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1y8b n GLU 428 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 1y8b n GLU 428 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1y8b n ARG 429 N 0.00 0.00 -0.00 3.49 3.00 -1.26 -5.01 116.66 116.88 1y8b n ARG 429 Ca 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 57.85 57.85 1y8b n ARG 429 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 32.46 32.46 1y8b n ARG 429 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.63 177.70 1y8b h ARG 430 N 0.00 0.00 0.00 -0.14 0.11 -1.92 -3.43 114.38 109.00 1y8b h ARG 430 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1y8b h ARG 430 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 1y8b h ARG 430 CO 0.00 0.00 -0.21 0.25 0.10 0.00 0.00 179.97 180.11 1y8b n THR 431 N -2.36 0.00 -1.80 0.08 -2.24 -1.26 -5.08 114.28 101.62 1y8b n THR 431 Ca -0.00 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.76 1y8b n THR 431 Cb 0.01 0.43 -0.01 0.00 -2.10 0.00 0.00 70.33 68.66 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 0.00 -1.68 -0.03 3.42 7.64 -1.26 -4.88 113.62 116.83 1y8b n SER 432 Ca 0.00 0.37 0.01 0.00 1.01 0.00 0.00 58.87 60.27 1y8b n SER 432 Cb 0.59 -2.18 -0.14 0.00 -1.01 0.00 0.00 64.21 61.47 1y8b n SER 432 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1y8b n LEU 433 N 0.45 0.23 -0.99 -3.43 4.32 -1.26 -4.25 117.00 112.07 1y8b n LEU 433 Ca -0.11 0.10 -0.01 0.00 -0.02 0.00 0.00 56.01 55.97 1y8b n LEU 433 Cb 0.17 0.19 0.20 0.00 -1.62 0.00 0.00 43.42 42.36 1y8b n LEU 433 CO 0.11 0.19 0.63 -3.20 -1.22 0.00 0.00 177.39 173.91 1y8b n ASN 434 N -2.58 2.49 -0.33 -1.43 4.05 -1.26 -4.73 115.26 111.46 1y8b n ASN 434 Ca -0.15 -3.68 0.24 0.00 0.45 0.00 0.00 54.58 51.43 1y8b n ASN 434 Cb 0.83 -0.60 0.52 0.00 1.23 0.00 0.00 39.78 41.76 1y8b n ASN 434 CO 0.00 0.00 0.00 0.25 -3.05 0.00 0.00 177.26 174.46 1y8b h LEU 435 N 1.03 0.44 -2.00 1.20 6.46 -1.85 0.83 115.31 121.42 1y8b h LEU 435 Ca 0.15 0.09 0.11 0.00 -0.12 0.00 0.00 57.88 58.11 1y8b h LEU 435 Cb 1.50 0.02 -0.02 0.00 -0.73 0.00 0.00 40.66 41.43 1y8b h LEU 435 CO 0.29 0.07 0.28 0.08 -0.62 0.00 0.00 178.44 178.53 1y8b h ARG 436 N 0.37 0.00 0.15 1.25 0.11 -1.84 0.48 114.38 114.90 1y8b h ARG 436 Ca 0.61 0.00 -0.27 0.00 0.10 0.00 0.00 59.98 60.42 1y8b h ARG 436 Cb 1.57 0.00 0.01 0.00 1.11 0.00 0.00 29.97 32.66 1y8b h ARG 436 CO -0.31 0.00 -1.30 1.03 0.10 0.00 0.00 179.97 179.49 1y8b h SER 437 N 0.00 0.49 -0.34 0.08 0.87 0.39 -2.82 113.55 112.22 1y8b h SER 437 Ca 0.18 -0.90 -0.08 0.00 -1.23 0.00 0.00 61.79 59.76 1y8b h SER 437 Cb 0.73 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 62.51 1y8b h SER 437 CO -0.00 1.59 -0.06 0.00 -0.53 0.00 0.00 176.83 177.83 1y8b h ILE 439 N 0.68 1.46 0.00 0.00 1.08 -0.20 -3.12 117.51 117.41 1y8b h ILE 439 Ca 0.13 -2.24 0.00 0.00 -0.39 0.00 0.00 64.86 62.36 1y8b h ILE 439 Cb 0.51 2.20 0.00 0.00 -3.07 0.00 0.00 36.82 36.45 1y8b h ILE 439 CO 0.03 0.64 0.62 0.00 -0.69 0.00 0.00 178.15 178.75 1y8b n ALA 440 N -2.43 0.17 1.67 1.87 0.00 -0.94 0.42 120.51 121.26 1y8b n ALA 440 Ca -0.01 0.03 0.05 0.00 0.00 0.00 0.00 53.44 53.51 1y8b n ALA 440 Cb 0.66 -0.21 0.31 0.00 0.00 0.00 0.00 19.45 20.21 1y8b n ALA 440 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1y8b n GLN 441 N -1.78 0.84 -0.25 0.00 -0.00 -1.18 -3.41 117.38 111.59 1y8b n GLN 441 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 57.00 1y8b n GLN 441 Cb 0.62 -1.20 0.00 0.00 -0.00 0.00 0.00 30.24 29.66 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 -0.70 3.23 0.20 2.61 0.00 1.40 -4.38 120.51 122.88 1y8b n ALA 442 Ca 0.08 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.65 1y8b n ALA 442 Cb 0.04 -1.01 0.68 0.00 0.00 0.00 0.00 19.45 19.15 1y8b n ALA 442 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1y8b h ARG 443 N 0.59 0.00 0.00 0.00 9.65 -1.79 -3.42 114.38 119.41 1y8b h ARG 443 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1y8b h ARG 443 Cb 0.97 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.55 1y8b h ARG 443 CO 0.00 0.00 0.00 0.09 2.80 0.00 0.00 179.97 182.86 1y8b n ASN 444 N -2.40 0.00 -1.80 -3.80 5.03 -1.26 -4.85 115.26 106.19 1y8b n ASN 444 Ca -0.02 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.43 1y8b n ASN 444 Cb 0.09 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 38.85 1y8b n ASN 444 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 1y8b n ARG 445 N 0.00 0.07 -3.90 3.52 3.00 -1.26 -4.58 116.66 113.51 1y8b n ARG 445 Ca 0.00 0.00 -0.35 0.00 -0.01 0.00 0.00 57.85 57.49 1y8b n ARG 445 Cb 0.00 -1.46 -0.14 0.00 0.00 0.00 0.00 32.46 30.86 1y8b n ARG 445 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 1y8b s VAL 446 N 1.70 3.20 1.06 1.55 0.11 -1.26 -3.80 120.40 122.97 1y8b s VAL 446 Ca 0.00 -0.98 -0.14 0.00 -2.93 0.00 0.00 61.98 57.94 1y8b s VAL 446 Cb 0.00 -2.66 0.22 0.00 -1.53 0.00 0.00 36.38 32.41 1y8b s VAL 446 CO 0.00 0.12 1.09 0.00 -3.33 0.00 0.00 175.10 172.98 1y8b s ALA 447 N 1.37 0.67 0.55 1.54 0.00 1.19 -4.69 121.76 122.38 1y8b s ALA 447 Ca 0.00 -0.47 -0.03 0.00 0.00 0.00 0.00 51.96 51.46 1y8b s ALA 447 Cb -0.17 -3.08 0.01 0.00 0.00 0.00 0.00 23.12 19.88 1y8b s ALA 447 CO -0.02 -3.13 0.82 -0.59 0.00 0.00 0.00 175.76 172.83 1y8b s PHE 448 N -2.92 3.17 0.25 0.00 -0.71 -1.26 -4.00 117.98 112.52 1y8b s PHE 448 Ca 0.67 0.42 0.06 0.00 -1.04 0.00 0.00 56.93 57.03 1y8b s PHE 448 Cb -0.18 -2.63 -0.03 0.00 -1.21 0.00 0.00 43.02 38.97 1y8b s PHE 448 CO 0.58 -0.71 0.30 0.42 -1.34 0.00 0.00 175.22 174.47 1y8b s ILE 449 N -2.83 4.84 -0.30 -4.49 1.09 -1.26 -4.31 121.20 113.94 1y8b s ILE 449 Ca 0.53 -1.16 -0.17 0.00 -1.10 0.00 0.00 60.65 58.74 1y8b s ILE 449 Cb -0.10 -3.64 0.19 0.00 -1.06 0.00 0.00 42.46 37.84 1y8b s ILE 449 CO 0.42 -0.33 1.17 0.21 -0.10 0.00 0.00 174.94 176.31 1y8b s ASN 450 N -3.94 -0.25 -1.01 3.58 3.04 -1.25 -4.02 114.94 111.10 1y8b s ASN 450 Ca 0.34 0.36 -0.09 0.00 0.04 0.00 0.00 52.86 53.51 1y8b s ASN 450 Cb -0.08 1.22 -0.04 0.00 -1.54 0.00 0.00 41.25 40.81 1y8b s ASN 450 CO 0.27 -0.05 0.83 0.41 -3.04 0.00 0.00 177.10 175.52 1y8b n THR 451 N 4.17 -8.24 -3.07 -5.21 -1.04 -1.26 -4.63 114.28 95.00 1y8b n THR 451 Ca -0.11 -0.99 -0.44 0.00 -2.04 0.00 0.00 64.05 60.47 1y8b n THR 451 Cb 0.55 -5.87 0.01 0.00 -1.82 0.00 0.00 70.33 63.20 1y8b n THR 451 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1y8b n GLY 452 N -1.47 4.69 3.64 3.41 0.00 -1.25 -4.79 105.19 109.42 1y8b n GLY 452 Ca -0.07 -2.56 -0.08 0.00 0.00 0.00 0.00 46.02 43.31 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 -1.76 -0.44 0.00 1.61 5.36 -1.26 -4.41 117.98 117.09 1y8b s PHE 453 Ca 0.32 1.06 0.00 0.00 -0.96 0.00 0.00 56.93 57.35 1y8b s PHE 453 Cb -0.01 0.37 0.00 0.00 -0.34 0.00 0.00 43.02 43.05 1y8b s PHE 453 CO 0.02 -0.21 0.00 1.47 -1.46 0.00 0.00 175.22 175.04 1y8b n LEU 454 N 2.25 0.00 0.12 6.12 -0.00 -1.26 -4.77 117.00 119.45 1y8b n LEU 454 Ca -0.13 0.00 -0.24 0.00 -0.00 0.00 0.00 56.01 55.65 1y8b n LEU 454 Cb 0.56 0.00 -0.16 0.00 -0.00 0.00 0.00 43.42 43.82 1y8b n LEU 454 CO 0.02 0.00 -0.23 -0.78 -0.00 0.00 0.00 177.39 176.41 1y8b h ASP 455 N 0.00 0.75 0.00 1.45 1.82 -2.01 -3.24 116.42 115.20 1y8b h ASP 455 Ca 0.00 -0.93 0.00 0.00 -0.39 0.00 0.00 57.03 55.71 1y8b h ASP 455 Cb 0.00 -0.24 0.00 0.00 0.68 0.00 0.00 39.33 39.77 1y8b h ASP 455 CO 0.00 1.67 0.58 0.08 -1.61 0.00 0.00 179.24 179.96 1y8b h ARG 456 N 0.04 0.00 0.65 0.28 -0.00 -1.97 -0.38 114.38 113.00 1y8b h ARG 456 Ca -0.25 0.00 -0.03 0.00 -0.00 0.00 0.00 59.98 59.70 1y8b h ARG 456 Cb 2.06 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 32.03 1y8b h ARG 456 CO 0.24 0.00 -0.36 1.79 -0.00 0.00 0.00 179.97 181.64 1y8b h THR 457 N 0.00 0.27 -0.00 0.08 1.35 -1.95 -0.88 112.91 111.78 1y8b h THR 457 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 1y8b h THR 457 Cb 1.16 0.27 -0.00 0.00 -1.73 0.00 0.00 68.15 67.85 1y8b h THR 457 CO 0.00 0.00 0.79 1.23 -0.25 0.00 0.00 175.52 177.29 1y8b h GLY 458 N -0.94 0.00 2.00 5.82 0.00 -1.30 1.97 103.07 110.62 1y8b h GLY 458 Ca -0.08 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.25 1y8b h GLY 458 CO 0.11 0.00 -0.00 -1.80 0.00 0.00 0.00 176.54 174.85 1y8b h ASP 459 N 0.00 0.00 0.80 0.19 3.58 -1.29 -2.91 116.42 116.79 1y8b h ASP 459 Ca 0.00 0.00 -0.24 0.00 0.42 0.00 0.00 57.03 57.21 1y8b h ASP 459 Cb 1.59 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.63 1y8b h ASP 459 CO -0.00 0.00 -1.13 -0.33 -2.88 0.00 0.00 179.24 174.90 1y8b h GLU 460 N 0.00 0.14 0.00 0.28 5.08 0.31 -3.15 114.58 117.24 1y8b h GLU 460 Ca -0.00 -0.25 0.00 0.00 -1.00 0.00 0.00 59.36 58.11 1y8b h GLU 460 Cb 0.62 0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.96 1y8b h GLU 460 CO 0.00 1.12 0.00 0.52 -1.00 0.00 0.00 179.01 179.65 1y8b h MET 461 N 0.04 0.00 -0.30 2.33 2.86 -1.57 -2.92 114.93 115.38 1y8b h MET 461 Ca -0.08 0.00 0.09 0.00 -2.06 0.00 0.00 59.70 57.65 1y8b h MET 461 Cb 1.88 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.53 1y8b h MET 461 CO 0.17 0.00 0.78 1.25 1.06 0.00 0.00 176.91 180.16 1y8b h HIS 462 N 0.00 0.00 0.14 -0.22 6.17 -1.59 1.26 115.15 120.90 1y8b h HIS 462 Ca 0.00 0.00 -0.01 0.00 0.71 0.00 0.00 60.37 61.07 1y8b h HIS 462 Cb 0.29 0.00 0.00 0.00 2.52 0.00 0.00 27.41 30.22 1y8b h HIS 462 CO 0.00 0.00 -0.07 0.66 0.71 0.00 0.00 177.93 179.23 1y8b h SER 463 N 0.00 -0.16 -0.01 3.26 4.64 -1.78 -3.20 113.55 116.31 1y8b h SER 463 Ca 0.14 -0.34 0.00 0.00 -0.47 0.00 0.00 61.79 61.12 1y8b h SER 463 Cb 1.69 0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.82 1y8b h SER 463 CO -0.00 0.29 -0.69 1.33 -0.87 0.00 0.00 176.83 176.89 1y8b n VAL 464 N -4.97 0.00 0.09 0.95 0.24 0.52 -4.00 118.33 111.16 1y8b n VAL 464 Ca -0.09 -0.16 -0.06 0.00 -2.04 0.00 0.00 64.34 61.99 1y8b n VAL 464 Cb 0.25 1.13 -0.01 0.00 -1.47 0.00 0.00 33.84 33.74 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 1.22 0.08 0.00 7.34 -1.53 0.13 -3.05 114.93 119.12 1y8b h MET 465 Ca 0.00 -0.09 0.00 0.00 -3.44 0.00 0.00 59.70 56.17 1y8b h MET 465 Cb 0.60 0.03 0.00 0.00 -0.55 0.00 0.00 31.60 31.68 1y8b h MET 465 CO 0.00 0.89 0.00 0.39 0.14 0.00 0.00 176.91 178.34 1y8b n GLU 466 N -3.58 0.00 0.00 0.39 -0.58 -1.21 -2.87 120.64 112.79 1y8b n GLU 466 Ca -0.02 0.02 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 1y8b n GLU 466 Cb 0.81 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 30.18 1y8b n GLU 466 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1y8b n ALA 467 N -0.96 -0.14 0.00 0.62 0.00 -1.15 -5.05 120.51 113.83 1y8b n ALA 467 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1y8b n ALA 467 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1y8b n ALA 467 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1y8b n GLY 468 N 1.16 -1.67 3.57 0.00 0.00 -1.14 -5.03 105.19 102.09 1y8b n GLY 468 Ca 0.00 0.54 -0.41 0.00 0.00 0.00 0.00 46.02 46.15 1y8b n GLY 468 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1y8b s PRO 469 N 0.00 3.20 -0.00 1.61 0.04 -1.26 -4.79 135.00 133.79 1y8b s PRO 469 Ca 0.00 0.56 0.08 0.00 0.04 0.00 0.00 61.00 61.69 1y8b s PRO 469 Cb 0.00 -4.17 -0.02 0.00 0.04 0.00 0.00 34.50 30.34 1y8b s PRO 469 CO 0.00 -2.06 -0.26 0.00 0.04 0.00 0.00 177.00 174.72 1y8b s MET 470 N 5.77 2.03 -0.54 4.56 0.23 -1.26 -3.53 119.30 126.57 1y8b s MET 470 Ca 0.57 -0.97 0.04 0.00 -1.03 0.00 0.00 55.69 54.30 1y8b s MET 470 Cb -0.12 -2.02 0.15 0.00 -1.53 0.00 0.00 34.83 31.31 1y8b s MET 470 CO 0.25 0.55 0.35 -0.51 -2.03 0.00 0.00 175.02 173.63 1y8b s LEU 471 N -0.76 3.37 0.00 0.18 2.01 -0.88 -4.81 118.68 117.80 1y8b s LEU 471 Ca 0.10 -3.19 0.00 0.00 0.01 0.00 0.00 54.13 51.05 1y8b s LEU 471 Cb -0.10 -1.20 0.00 0.00 0.01 0.00 0.00 46.19 44.90 1y8b s LEU 471 CO -0.00 -0.18 0.00 -1.14 1.01 0.00 0.00 176.35 176.04 1y8b n ARG 472 N 2.80 0.00 0.20 1.70 0.00 -1.26 -4.34 116.66 115.76 1y8b n ARG 472 Ca 0.16 0.00 -0.09 0.00 -0.00 0.00 0.00 57.85 57.93 1y8b n ARG 472 Cb 0.37 -0.48 -0.04 0.00 0.00 0.00 0.00 32.46 32.31 1y8b n ARG 472 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.63 179.20 1y8b h LYS 473 N 0.00 -0.55 -1.11 -0.14 5.09 -2.01 -3.21 116.57 114.64 1y8b h LYS 473 Ca 0.00 0.04 0.32 0.00 0.09 0.00 0.00 60.65 61.09 1y8b h LYS 473 Cb 0.00 0.12 -0.11 0.00 0.10 0.00 0.00 32.23 32.34 1y8b h LYS 473 CO 0.00 -0.37 0.70 -0.91 -2.09 0.00 0.00 179.45 176.79 1y8b h ASN 474 N -1.15 0.41 -0.01 7.07 4.21 -1.95 0.92 115.58 125.07 1y8b h ASN 474 Ca -0.06 0.11 0.00 0.00 1.21 0.00 0.00 56.30 57.57 1y8b h ASN 474 Cb 0.44 0.06 -0.00 0.00 -1.12 0.00 0.00 38.32 37.69 1y8b h ASN 474 CO 0.10 -0.01 0.26 -0.61 -1.29 0.00 0.00 177.43 175.87 1y8b h GLN 475 N 0.31 0.00 0.00 0.81 5.75 -1.75 0.44 115.11 120.68 1y8b h GLN 475 Ca 0.67 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 59.17 1y8b h GLN 475 Cb 1.79 0.00 0.00 0.00 1.07 0.00 0.00 27.48 30.34 1y8b h GLN 475 CO -0.37 0.00 0.02 1.98 -2.65 0.00 0.00 178.83 177.81 1y8b h MET 476 N 0.00 0.00 -0.25 1.69 4.05 0.78 -2.78 114.93 118.43 1y8b h MET 476 Ca 0.01 0.00 0.06 0.00 -0.28 0.00 0.00 59.70 59.49 1y8b h MET 476 Cb 0.52 0.00 -0.07 0.00 -0.80 0.00 0.00 31.60 31.25 1y8b h MET 476 CO -0.00 0.00 -0.27 -0.22 0.23 0.00 0.00 176.91 176.65 1y8b h LYS 477 N 0.00 -0.26 0.00 0.39 3.64 -1.09 -3.45 116.57 115.80 1y8b h LYS 477 Ca 0.00 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 1y8b h LYS 477 Cb 0.03 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.91 1y8b h LYS 477 CO 0.00 -0.18 0.00 -1.13 -2.27 0.00 0.00 179.45 175.87 1y8b n SER 478 N -5.39 0.00 -3.50 4.20 3.41 -1.05 -5.19 113.62 106.10 1y8b n SER 478 Ca -0.01 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.48 1y8b n SER 478 Cb 0.30 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.22 1y8b n SER 478 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1y8b s THR 479 N 0.00 0.02 0.07 6.66 -4.23 -1.26 -5.07 115.64 111.83 1y8b s THR 479 Ca 0.00 -0.17 -0.34 0.00 -1.18 0.00 0.00 61.69 60.00 1y8b s THR 479 Cb 0.00 -1.03 -0.19 0.00 1.34 0.00 0.00 72.50 72.62 1y8b s THR 479 CO 0.00 -0.09 1.62 -0.65 -0.54 0.00 0.00 174.62 174.96 1y8b h PRO 480 N 2.32 -0.93 0.54 3.99 0.11 -1.99 -2.14 132.00 133.90 1y8b h PRO 480 Ca -0.33 0.06 -0.02 0.00 0.11 0.00 0.00 66.00 65.83 1y8b h PRO 480 Cb 1.26 0.21 -0.01 0.00 0.11 0.00 0.00 31.00 32.57 1y8b h PRO 480 CO 0.41 -0.62 -0.40 0.11 -0.21 0.00 0.00 178.00 177.29 1y8b h TRP 481 N -0.96 -1.07 -0.98 0.65 0.09 -1.92 -1.74 115.95 110.01 1y8b h TRP 481 Ca -0.10 -0.00 0.25 0.00 0.09 0.00 0.00 58.89 59.13 1y8b h TRP 481 Cb 0.74 0.40 -0.07 0.00 0.08 0.00 0.00 29.16 30.31 1y8b h TRP 481 CO -0.03 -0.58 0.65 0.97 0.09 0.00 0.00 178.44 179.54 1y8b h ILE 482 N -0.92 0.58 -0.16 0.12 -0.00 -1.90 0.92 117.51 116.15 1y8b h ILE 482 Ca -0.06 -0.11 0.00 0.00 -0.00 0.00 0.00 64.86 64.69 1y8b h ILE 482 Cb 0.77 0.22 -0.01 0.00 -0.00 0.00 0.00 36.82 37.81 1y8b h ILE 482 CO 0.02 0.06 0.11 0.50 -0.00 0.00 0.00 178.15 178.84 1y8b h LYS 483 N 0.33 0.20 0.00 2.19 1.63 -0.62 -2.31 116.57 117.99 1y8b h LYS 483 Ca 0.52 -0.01 -0.07 0.00 -0.85 0.00 0.00 60.65 60.25 1y8b h LYS 483 Cb 1.45 -0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 33.03 1y8b h LYS 483 CO -0.19 0.13 -0.47 0.00 -3.45 0.00 0.00 179.45 175.47 1y8b h ALA 484 N 1.90 0.07 -0.33 5.00 0.00 0.11 -2.98 119.26 123.03 1y8b h ALA 484 Ca 0.06 -0.59 0.04 0.00 0.00 0.00 0.00 54.91 54.42 1y8b h ALA 484 Cb -0.01 0.32 -0.06 0.00 0.00 0.00 0.00 17.79 18.04 1y8b h ALA 484 CO -0.01 0.31 -0.41 1.88 0.00 0.00 0.00 179.25 181.02 1y8b h TYR 485 N -1.00 -1.26 0.71 0.00 -1.99 -1.10 0.65 116.97 112.98 1y8b h TYR 485 Ca -0.10 0.06 -0.03 0.00 2.00 0.00 0.00 58.73 60.66 1y8b h TYR 485 Cb 0.75 0.59 0.01 0.00 2.00 0.00 0.00 36.73 40.07 1y8b h TYR 485 CO 0.05 -0.35 -0.34 1.49 -0.00 0.00 0.00 178.16 179.01 1y8b h GLU 486 N -0.27 -0.92 -0.95 4.88 4.81 -1.62 -2.16 114.58 118.35 1y8b h GLU 486 Ca 0.06 0.06 0.22 0.00 -0.13 0.00 0.00 59.36 59.57 1y8b h GLU 486 Cb 0.42 0.21 -0.08 0.00 0.63 0.00 0.00 28.75 29.94 1y8b h GLU 486 CO -0.45 -0.59 0.62 -0.09 -0.73 0.00 0.00 179.01 177.77 1y8b h ARG 487 N -1.02 0.42 -0.47 1.92 9.65 -1.33 0.75 114.38 124.29 1y8b h ARG 487 Ca -0.10 -0.03 -0.12 0.00 -1.10 0.00 0.00 59.98 58.64 1y8b h ARG 487 Cb 0.75 -0.09 -0.02 0.00 -1.39 0.00 0.00 29.97 29.22 1y8b h ARG 487 CO 0.16 0.28 -0.17 -0.97 2.80 0.00 0.00 179.97 182.07 1y8b h ASN 488 N 0.43 0.92 -1.41 -3.80 -0.00 0.63 -2.75 115.58 109.59 1y8b h ASN 488 Ca 0.51 -0.32 0.41 0.00 -0.00 0.00 0.00 56.30 56.90 1y8b h ASN 488 Cb 1.24 -0.25 -0.06 0.00 -0.00 0.00 0.00 38.32 39.26 1y8b h ASN 488 CO -0.22 1.07 1.02 0.78 -0.00 0.00 0.00 177.43 180.08 1y8b h ASN 489 N 0.80 0.00 0.31 1.15 -0.26 -0.19 0.84 115.58 118.22 1y8b h ASN 489 Ca 0.12 0.00 -0.33 0.00 -0.56 0.00 0.00 56.30 55.53 1y8b h ASN 489 Cb 0.71 0.00 0.03 0.00 -1.06 0.00 0.00 38.32 38.00 1y8b h ASN 489 CO 0.05 -0.00 -1.51 0.58 -1.06 0.00 0.00 177.43 175.49 1y8b h VAL 490 N 0.00 1.24 0.00 2.81 2.07 -1.55 -3.00 116.25 117.82 1y8b h VAL 490 Ca 0.67 -2.72 0.00 0.00 0.82 0.00 0.00 66.70 65.47 1y8b h VAL 490 Cb 2.70 2.97 0.00 0.00 -1.52 0.00 0.00 31.29 35.44 1y8b h VAL 490 CO -0.01 0.83 -0.09 -0.07 0.02 0.00 0.00 177.57 178.25 1y8b h LEU 491 N 0.13 0.00 -1.73 2.57 3.38 0.15 -3.09 115.31 116.73 1y8b h LEU 491 Ca -0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1y8b h LEU 491 Cb 2.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.88 1y8b h LEU 491 CO 0.24 0.52 0.22 -1.28 0.09 0.00 0.00 178.44 178.23 1y8b h SER 492 N -0.94 0.00 0.00 -0.43 0.87 0.15 0.64 113.55 113.84 1y8b h SER 492 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1y8b h SER 492 Cb 0.09 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.05 1y8b h SER 492 CO 0.00 0.00 0.00 0.61 -0.53 0.00 0.00 176.83 176.91 1y8b n GLY 493 N -1.23 -0.47 0.30 5.77 0.00 -1.13 -4.16 105.19 104.26 1y8b n GLY 493 Ca -0.02 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.14 1y8b n GLY 493 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1y8b n LEU 494 N -2.09 1.07 -1.13 0.99 -0.00 -1.17 -3.87 117.00 110.81 1y8b n LEU 494 Ca 0.00 -0.29 0.08 0.00 -0.00 0.00 0.00 56.01 55.80 1y8b n LEU 494 Cb 0.00 -0.09 0.28 0.00 -0.00 0.00 0.00 43.42 43.61 1y8b n LEU 494 CO 0.00 0.19 0.74 0.33 -0.00 0.00 0.00 177.39 178.65 1y8b n PHE 495 N -0.44 1.09 -0.02 1.47 7.35 0.22 -0.66 117.46 126.47 1y8b n PHE 495 Ca 0.15 -0.69 -0.00 0.00 -0.76 0.00 0.00 57.45 56.15 1y8b n PHE 495 Cb 0.33 -0.24 -0.06 0.00 0.35 0.00 0.00 39.48 39.87 1y8b n PHE 495 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1y8b n GLY 497 N 2.36 -0.13 0.14 0.00 0.00 -1.26 -4.12 105.19 102.18 1y8b n GLY 497 Ca -0.07 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.73 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 0.00 0.52 -2.41 0.99 -0.00 -1.90 -3.36 115.31 109.15 1y8b h LEU 498 Ca 0.00 -0.92 -0.55 0.00 -0.00 0.00 0.00 57.88 56.42 1y8b h LEU 498 Cb 0.00 -0.17 -0.08 0.00 -0.00 0.00 0.00 40.66 40.41 1y8b h LEU 498 CO 0.00 1.75 -0.94 0.54 -0.00 0.00 0.00 178.44 179.79 1y8b n ARG 499 N -3.68 -1.83 0.00 0.17 1.74 0.17 -4.74 116.66 108.47 1y8b n ARG 499 Ca -0.26 0.26 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1y8b n ARG 499 Cb 1.02 -3.87 0.00 0.00 -1.02 0.00 0.00 32.46 28.58 1y8b n ARG 499 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1y8b n GLY 500 N -2.17 -0.89 3.10 -0.13 0.00 -1.26 -5.02 105.19 98.82 1y8b n GLY 500 Ca -0.26 0.28 -0.28 0.00 0.00 0.00 0.00 46.02 45.76 1y8b n GLY 500 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1y8b s LYS 501 N 0.00 2.26 0.00 1.61 2.20 -1.26 -5.04 119.74 119.50 1y8b s LYS 501 Ca 0.00 -0.60 0.00 0.00 -0.36 0.00 0.00 55.97 55.01 1y8b s LYS 501 Cb 0.00 -1.80 0.00 0.00 -1.51 0.00 0.00 37.83 34.52 1y8b s LYS 501 CO 0.00 0.06 0.00 0.00 -0.36 0.00 0.00 175.35 175.05 1y8b n ALA 502 N 3.79 0.00 -2.15 3.13 0.00 -1.26 -5.02 120.51 119.00 1y8b n ALA 502 Ca -0.21 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.13 1y8b n ALA 502 Cb 0.52 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.87 1y8b n ALA 502 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1y8b s GLN 503 N -2.00 0.92 -0.00 0.00 -0.21 -1.26 -5.03 119.66 112.08 1y8b s GLN 503 Ca 0.00 -1.43 -0.11 0.00 0.02 0.00 0.00 55.36 53.83 1y8b s GLN 503 Cb 0.00 0.21 0.01 0.00 1.00 0.00 0.00 33.01 34.24 1y8b s GLN 503 CO 0.00 -0.25 0.23 0.42 -2.12 0.00 0.00 175.29 173.58 1y8b s ILE 504 N -4.02 0.07 0.18 1.08 -1.09 -1.26 -3.76 121.20 112.40 1y8b s ILE 504 Ca 0.23 -0.58 0.03 0.00 -2.23 0.00 0.00 60.65 58.10 1y8b s ILE 504 Cb 0.07 -0.55 -0.01 0.00 -1.58 0.00 0.00 42.46 40.39 1y8b s ILE 504 CO 0.01 -0.32 0.18 0.61 -1.23 0.00 0.00 174.94 174.19 1y8b n GLY 505 N 1.32 3.21 0.00 6.18 0.00 -1.25 -1.32 105.19 113.33 1y8b n GLY 505 Ca -0.22 -1.70 0.00 0.00 0.00 0.00 0.00 46.02 44.09 1y8b n GLY 505 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1y8b n LYS 506 N -0.32 0.00 0.00 1.61 0.00 -1.26 -3.85 118.16 114.33 1y8b n LYS 506 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.34 1y8b n LYS 506 Cb 0.31 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.34 1y8b n LYS 506 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1y8b n GLY 507 N 0.00 -0.09 7.00 3.14 0.00 -1.26 -4.87 105.19 109.11 1y8b n GLY 507 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1y8b n GLY 507 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1y8b n MET 508 N -2.19 0.00 -1.44 1.61 2.81 -1.26 -4.72 117.12 111.93 1y8b n MET 508 Ca 0.00 0.00 -0.36 0.00 -1.81 0.00 0.00 57.70 55.53 1y8b n MET 508 Cb 0.00 0.00 0.09 0.00 -0.71 0.00 0.00 33.22 32.60 1y8b n MET 508 CO 0.00 0.00 0.00 0.91 1.51 0.00 0.00 175.97 178.39 1y8b n TRP 509 N 0.00 1.31 -2.77 2.03 8.01 -1.26 -4.68 117.44 120.08 1y8b n TRP 509 Ca 0.00 0.41 -0.04 0.00 -1.31 0.00 0.00 57.50 56.56 1y8b n TRP 509 Cb 0.00 -2.16 0.01 0.00 -2.01 0.00 0.00 31.31 27.15 1y8b n TRP 509 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1y8b s ALA 510 N -1.72 -2.09 -0.60 6.99 0.00 -1.26 -5.04 121.76 118.05 1y8b s ALA 510 Ca 0.77 -0.43 -0.35 0.00 0.00 0.00 0.00 51.96 51.95 1y8b s ALA 510 Cb -0.35 -2.71 -0.16 0.00 0.00 0.00 0.00 23.12 19.90 1y8b s ALA 510 CO 0.46 -2.24 2.35 -1.33 0.00 0.00 0.00 175.76 175.01 1y8b n MET 511 N 2.96 0.46 -0.23 0.00 2.81 -1.26 -4.68 117.12 117.18 1y8b n MET 511 Ca 0.18 0.09 0.15 0.00 -1.81 0.00 0.00 57.70 56.31 1y8b n MET 511 Cb 0.56 -2.03 0.46 0.00 -0.71 0.00 0.00 33.22 31.49 1y8b n MET 511 CO 0.00 0.00 0.00 -1.35 1.51 0.00 0.00 175.97 176.13 1y8b h PRO 512 N 12.20 0.51 0.00 0.03 0.11 -1.88 -3.37 132.00 139.60 1y8b h PRO 512 Ca -0.16 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.92 1y8b h PRO 512 Cb 1.34 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1y8b h PRO 512 CO 1.16 0.34 0.00 -0.40 -0.21 0.00 0.00 178.00 178.89 1y8b n ASP 513 N -4.53 0.00 -4.41 -2.05 5.68 -1.26 -4.72 116.55 105.26 1y8b n ASP 513 Ca 0.17 0.00 -0.50 0.00 -0.50 0.00 0.00 54.79 53.97 1y8b n ASP 513 Cb 0.57 0.00 -0.10 0.00 -1.14 0.00 0.00 41.12 40.44 1y8b n ASP 513 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1y8b n LEU 514 N -0.93 1.22 0.00 -2.12 7.99 -1.26 -2.87 117.00 119.03 1y8b n LEU 514 Ca 0.00 0.35 0.00 0.00 -0.01 0.00 0.00 56.01 56.35 1y8b n LEU 514 Cb 0.00 -1.09 0.00 0.00 -0.11 0.00 0.00 43.42 42.22 1y8b n LEU 514 CO 0.00 -0.82 0.08 0.23 -1.51 0.00 0.00 177.39 175.37 1y8b n MET 515 N 8.13 -0.11 0.07 3.23 2.81 -1.26 -4.59 117.12 125.40 1y8b n MET 515 Ca 0.52 -0.17 -0.13 0.00 -1.81 0.00 0.00 57.70 56.11 1y8b n MET 515 Cb 0.12 -0.60 -0.09 0.00 -0.71 0.00 0.00 33.22 31.94 1y8b n MET 515 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1y8b h ALA 516 N 0.00 -0.19 -0.09 3.04 0.00 -1.82 -2.67 119.26 117.54 1y8b h ALA 516 Ca 0.00 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.62 1y8b h ALA 516 Cb 0.46 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1y8b h ALA 516 CO 0.00 -0.40 -0.30 0.38 0.00 0.00 0.00 179.25 178.92 1y8b h ASP 517 N -0.59 0.42 -0.86 0.00 3.04 -1.93 -3.18 116.42 113.31 1y8b h ASP 517 Ca -0.02 -0.62 0.22 0.00 -3.24 0.00 0.00 57.03 53.37 1y8b h ASP 517 Cb 0.45 -0.12 -0.13 0.00 -1.04 0.00 0.00 39.33 38.49 1y8b h ASP 517 CO 0.03 0.97 0.29 0.24 -2.04 0.00 0.00 179.24 178.73 1y8b h MET 518 N -0.11 0.29 -0.92 4.15 2.86 -1.85 1.55 114.93 120.89 1y8b h MET 518 Ca -0.01 -0.02 0.27 0.00 -2.06 0.00 0.00 59.70 57.88 1y8b h MET 518 Cb 0.94 -0.07 -0.04 0.00 0.06 0.00 0.00 31.60 32.49 1y8b h MET 518 CO 0.06 0.19 0.79 -0.92 1.06 0.00 0.00 176.91 178.10 1y8b h TYR 519 N 0.30 0.00 0.00 -0.22 3.20 -1.45 1.87 116.97 120.67 1y8b h TYR 519 Ca 0.53 0.00 -0.29 0.00 3.14 0.00 0.00 58.73 62.12 1y8b h TYR 519 Cb 1.02 0.00 -0.05 0.00 1.54 0.00 0.00 36.73 39.24 1y8b h TYR 519 CO -0.21 0.00 -1.72 0.45 -1.64 0.00 0.00 178.16 175.04 1y8b n SER 520 N -3.88 0.83 -0.03 -2.11 2.88 0.52 -1.69 113.62 110.14 1y8b n SER 520 Ca 0.20 0.39 -0.18 0.00 -1.33 0.00 0.00 58.87 57.94 1y8b n SER 520 Cb 1.10 0.01 -0.13 0.00 -0.75 0.00 0.00 64.21 64.44 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 0.13 0.00 -1.46 5.75 0.19 -3.30 115.11 116.43 1y8b h GLN 521 Ca -0.29 -0.23 -0.14 0.00 -0.15 0.00 0.00 58.65 57.84 1y8b h GLN 521 Cb 1.99 0.08 -0.02 0.00 1.07 0.00 0.00 27.48 30.61 1y8b h GLN 521 CO 0.07 1.11 -0.68 -0.22 -2.65 0.00 0.00 178.83 176.46 1y8b h LYS 522 N -0.68 0.00 -0.68 1.69 3.64 0.22 -2.93 116.57 117.82 1y8b h LYS 522 Ca -0.16 0.00 0.08 0.00 -1.27 0.00 0.00 60.65 59.30 1y8b h LYS 522 Cb 1.38 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 33.14 1y8b h LYS 522 CO 0.02 0.68 0.36 0.78 -2.27 0.00 0.00 179.45 179.01 1y8b h GLY 523 N 3.26 1.01 1.73 5.01 0.00 -1.32 -1.80 103.07 110.97 1y8b h GLY 523 Ca -0.01 -0.23 -0.16 0.00 0.00 0.00 0.00 47.33 46.93 1y8b h GLY 523 CO 0.09 0.10 -0.91 -0.55 0.00 0.00 0.00 176.54 175.27 1y8b h ASP 524 N 0.63 0.00 -1.03 0.19 3.32 -1.63 -3.33 116.42 114.58 1y8b h ASP 524 Ca 0.32 0.00 0.35 0.00 0.02 0.00 0.00 57.03 57.72 1y8b h ASP 524 Cb 0.28 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 39.68 1y8b h ASP 524 CO -0.23 0.70 0.59 -0.61 -1.72 0.00 0.00 179.24 177.97 1y8b h GLN 525 N 0.00 0.24 0.11 3.56 -0.00 -1.13 0.31 115.11 118.20 1y8b h GLN 525 Ca -0.06 -0.01 -0.24 0.00 -0.00 0.00 0.00 58.65 58.34 1y8b h GLN 525 Cb 1.58 -0.05 0.02 0.00 0.00 0.00 0.00 27.48 29.04 1y8b h GLN 525 CO 0.08 0.16 -1.01 1.37 0.00 0.00 0.00 178.83 179.43 1y8b h LEU 526 N 0.25 0.70 -1.79 -2.39 -0.00 -1.66 -3.10 115.31 107.31 1y8b h LEU 526 Ca 0.76 -0.85 0.21 0.00 -0.00 0.00 0.00 57.88 58.00 1y8b h LEU 526 Cb 1.85 -0.22 -0.03 0.00 -0.00 0.00 0.00 40.66 42.26 1y8b h LEU 526 CO -0.61 1.48 0.70 0.03 -0.00 0.00 0.00 178.44 180.03 1y8b h ARG 527 N 0.02 0.00 0.00 0.17 2.47 -0.56 1.65 114.38 118.14 1y8b h ARG 527 Ca -0.16 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.56 1y8b h ARG 527 Cb 1.73 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 30.05 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 -2.42 1.98 0.00 0.04 0.00 -0.74 -4.74 120.51 114.63 1y8b n ALA 528 Ca 0.15 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.51 1y8b n ALA 528 Cb 0.95 -1.20 0.00 0.00 0.00 0.00 0.00 19.45 19.21 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 -0.17 1.76 0.00 0.00 0.00 0.56 -4.80 105.19 102.54 1y8b n GLY 529 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1y8b n GLY 529 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y8b n ALA 530 N -1.19 0.00 -1.00 4.61 0.00 -0.75 -4.83 120.51 117.35 1y8b n ALA 530 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1y8b n ALA 530 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1y8b n ALA 530 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1y8b n ASN 531 N -1.71 0.00 -4.00 0.00 5.15 -0.43 -4.85 115.26 109.42 1y8b n ASN 531 Ca 0.00 0.00 -0.28 0.00 -0.60 0.00 0.00 54.58 53.70 1y8b n ASN 531 Cb 0.00 0.00 -0.17 0.00 -0.53 0.00 0.00 39.78 39.08 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 0.00 1.35 0.58 -0.44 -4.23 -1.20 -4.94 115.64 106.75 1y8b s THR 532 Ca 0.00 -0.52 0.05 0.00 -1.18 0.00 0.00 61.69 60.04 1y8b s THR 532 Cb 0.00 -1.28 0.07 0.00 1.34 0.00 0.00 72.50 72.63 1y8b s THR 532 CO 0.00 0.42 0.80 0.00 -0.54 0.00 0.00 174.62 175.29 1y8b s ALA 533 N 1.32 4.22 0.41 3.99 0.00 -1.26 -3.81 121.76 126.63 1y8b s ALA 533 Ca -0.00 -1.75 0.08 0.00 0.00 0.00 0.00 51.96 50.28 1y8b s ALA 533 Cb -0.14 -1.78 -0.01 0.00 0.00 0.00 0.00 23.12 21.19 1y8b s ALA 533 CO -0.06 -0.88 0.41 1.67 0.00 0.00 0.00 175.76 176.91 1y8b s TRP 534 N -2.75 2.74 0.01 0.00 1.48 -1.26 -1.26 118.94 117.90 1y8b s TRP 534 Ca 0.61 -0.46 -0.18 0.00 -1.06 0.00 0.00 56.10 55.00 1y8b s TRP 534 Cb -0.08 -2.20 0.03 0.00 -1.16 0.00 0.00 33.47 30.07 1y8b s TRP 534 CO 0.39 -0.17 0.40 0.14 -4.06 0.00 0.00 176.95 173.65 1y8b s VAL 535 N -2.44 0.05 -1.50 -0.66 -7.23 -0.28 -4.30 120.40 104.04 1y8b s VAL 535 Ca 0.49 -0.44 0.28 0.00 -1.81 0.00 0.00 61.98 60.51 1y8b s VAL 535 Cb -0.05 -0.85 0.53 0.00 0.56 0.00 0.00 36.38 36.57 1y8b s VAL 535 CO 0.29 -0.24 1.97 -0.81 -0.31 0.00 0.00 175.10 176.00 1y8b n PRO 536 N 0.80 0.46 -4.06 4.82 -0.04 -1.26 -0.66 135.00 135.06 1y8b n PRO 536 Ca -0.20 0.02 -0.10 0.00 -0.04 0.00 0.00 63.50 63.19 1y8b n PRO 536 Cb 0.58 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.48 1y8b n PRO 536 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1y8b s SER 537 N -2.50 -0.00 -0.09 3.54 1.04 -1.26 -4.67 113.70 109.76 1y8b s SER 537 Ca 0.28 -1.08 -0.26 0.00 0.48 0.00 0.00 55.95 55.38 1y8b s SER 537 Cb 0.19 0.53 -0.22 0.00 0.10 0.00 0.00 66.02 66.62 1y8b s SER 537 CO 0.41 -1.06 0.90 -0.65 0.98 0.00 0.00 173.24 173.82 1y8b h PRO 538 N 2.36 -0.03 -1.04 4.02 0.11 -1.92 -3.05 132.00 132.45 1y8b h PRO 538 Ca -0.29 0.00 0.36 0.00 0.11 0.00 0.00 66.00 66.18 1y8b h PRO 538 Cb 1.25 0.01 -0.15 0.00 0.11 0.00 0.00 31.00 32.21 1y8b h PRO 538 CO 0.41 0.69 0.60 0.00 -0.21 0.00 0.00 178.00 179.48 1y8b h THR 539 N -0.83 0.22 0.00 -1.15 1.03 -1.98 2.25 112.91 112.45 1y8b h THR 539 Ca -0.00 -0.08 0.00 0.00 -0.01 0.00 0.00 66.41 66.32 1y8b h THR 539 Cb 0.73 -0.03 0.00 0.00 -1.07 0.00 0.00 68.15 67.79 1y8b h THR 539 CO 0.01 0.04 -0.13 0.00 -0.01 0.00 0.00 175.52 175.43 1y8b h ALA 540 N 1.85 0.93 0.26 0.00 0.00 -1.92 -3.13 119.26 117.25 1y8b h ALA 540 Ca 0.77 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.66 1y8b h ALA 540 Cb 1.90 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.69 1y8b h ALA 540 CO -0.62 0.00 -0.13 0.00 0.00 0.00 0.00 179.25 178.51 1y8b h ALA 541 N 2.25 -0.36 -0.58 0.00 0.00 0.39 -3.14 119.26 117.81 1y8b h ALA 541 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1y8b h ALA 541 Cb 0.88 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.78 1y8b h ALA 541 CO 0.00 -0.40 0.38 0.00 0.00 0.00 0.00 179.25 179.23 1y8b h THR 542 N -0.96 1.16 -0.81 0.00 1.03 -1.54 -2.59 112.91 109.20 1y8b h THR 542 Ca -0.04 -0.31 0.15 0.00 -0.01 0.00 0.00 66.41 66.20 1y8b h THR 542 Cb 0.48 0.32 -0.15 0.00 -1.07 0.00 0.00 68.15 67.73 1y8b h THR 542 CO 0.06 0.16 -0.28 -0.07 -0.01 0.00 0.00 175.52 175.38 1y8b h LEU 543 N 0.79 -1.01 -1.79 0.00 -0.00 -1.62 1.76 115.31 113.44 1y8b h LEU 543 Ca 0.21 0.26 -0.03 0.00 -0.00 0.00 0.00 57.88 58.32 1y8b h LEU 543 Cb -0.07 0.58 -0.00 0.00 -0.00 0.00 0.00 40.66 41.17 1y8b h LEU 543 CO -0.04 -0.29 -0.15 -0.74 -0.00 0.00 0.00 178.44 177.22 1y8b h HIS 544 N -0.04 0.00 0.00 1.13 2.76 -1.42 -1.63 115.15 115.95 1y8b h HIS 544 Ca 0.35 0.00 -0.07 0.00 -2.20 0.00 0.00 60.37 58.45 1y8b h HIS 544 Cb 0.59 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.54 1y8b h HIS 544 CO -0.70 0.15 -0.31 0.00 -1.30 0.00 0.00 177.93 175.77 1y8b h ALA 545 N 1.85 1.45 0.17 5.26 0.00 0.29 -1.08 119.26 127.21 1y8b h ALA 545 Ca -0.00 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 1y8b h ALA 545 Cb 0.36 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1y8b h ALA 545 CO 0.02 0.39 -0.08 -0.07 0.00 0.00 0.00 179.25 179.51 1y8b h LEU 546 N 0.00 -0.20 -2.30 0.00 3.38 -0.33 -1.41 115.31 114.45 1y8b h LEU 546 Ca -0.00 -0.34 -0.01 0.00 0.09 0.00 0.00 57.88 57.62 1y8b h LEU 546 Cb 0.56 0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.36 1y8b h LEU 546 CO 0.04 0.32 -0.04 0.45 0.09 0.00 0.00 178.44 179.30 1y8b h HIS 547 N -0.81 0.00 0.00 1.13 3.86 -1.47 0.47 115.15 118.33 1y8b h HIS 547 Ca -0.02 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.15 1y8b h HIS 547 Cb 0.52 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.99 1y8b h HIS 547 CO 0.08 0.04 -0.24 -0.92 0.86 0.00 0.00 177.93 177.75 1y8b h TYR 548 N 0.00 0.00 0.18 2.45 5.03 -1.09 -3.23 116.97 120.31 1y8b h TYR 548 Ca -0.00 0.00 -0.35 0.00 2.58 0.00 0.00 58.73 60.96 1y8b h TYR 548 Cb 0.10 0.00 0.01 0.00 1.55 0.00 0.00 36.73 38.39 1y8b h TYR 548 CO 0.00 0.15 -1.71 0.45 -1.32 0.00 0.00 178.16 175.74 1y8b h HIS 549 N 0.00 0.70 -0.91 -3.82 3.86 0.21 -3.33 115.15 111.86 1y8b h HIS 549 Ca -0.01 -0.51 0.01 0.00 -1.16 0.00 0.00 60.37 58.70 1y8b h HIS 549 Cb 1.12 -0.03 -0.05 0.00 1.06 0.00 0.00 27.41 29.52 1y8b h HIS 549 CO 0.00 1.63 0.60 1.96 0.86 0.00 0.00 177.93 182.98 1y8b h GLN 550 N 0.11 1.18 -4.68 2.45 4.20 -1.42 -3.36 115.11 113.59 1y8b h GLN 550 Ca -0.32 -0.07 -0.66 0.00 0.06 0.00 0.00 58.65 57.65 1y8b h GLN 550 Cb 2.10 -0.27 -0.40 0.00 0.30 0.00 0.00 27.48 29.21 1y8b h GLN 550 CO 0.18 0.78 -0.71 -0.08 -0.67 0.00 0.00 178.83 178.33 1y8b s THR 551 N -6.12 2.31 -0.51 -0.54 -1.32 -1.22 -4.95 115.64 103.29 1y8b s THR 551 Ca -0.13 -2.34 -0.26 0.00 -1.21 0.00 0.00 61.69 57.75 1y8b s THR 551 Cb 0.17 -2.71 -0.06 0.00 -1.51 0.00 0.00 72.50 68.39 1y8b s THR 551 CO 0.80 -0.60 2.35 0.20 -2.21 0.00 0.00 174.62 175.16 1y8b s ASN 552 N 0.93 4.51 0.64 8.08 0.01 -1.25 -4.72 114.94 123.14 1y8b s ASN 552 Ca 0.11 0.97 0.39 0.00 -0.71 0.00 0.00 52.86 53.63 1y8b s ASN 552 Cb -0.19 -2.50 2.15 0.00 0.41 0.00 0.00 41.25 41.11 1y8b s ASN 552 CO -0.08 -2.85 2.21 -0.37 -1.51 0.00 0.00 177.10 174.50 1y8b h VAL 553 N 7.60 0.00 0.28 1.60 -1.51 -1.92 -2.24 116.25 120.07 1y8b h VAL 553 Ca -0.24 0.00 -0.00 0.00 -1.23 0.00 0.00 66.70 65.23 1y8b h VAL 553 Cb 1.25 0.88 -0.01 0.00 -2.13 0.00 0.00 31.29 31.27 1y8b h VAL 553 CO 1.17 0.00 -0.24 -0.61 -1.23 0.00 0.00 177.57 176.66 1y8b h GLN 554 N 0.00 -0.52 -0.67 5.19 4.15 -1.93 0.12 115.11 121.45 1y8b h GLN 554 Ca 0.00 0.04 -0.07 0.00 0.77 0.00 0.00 58.65 59.39 1y8b h GLN 554 Cb 0.16 0.12 -0.03 0.00 0.21 0.00 0.00 27.48 27.94 1y8b h GLN 554 CO 0.00 -0.34 0.15 0.66 -1.93 0.00 0.00 178.83 177.36 1y8b h SER 555 N -0.54 1.03 -0.41 -0.69 4.64 -1.80 -1.05 113.55 114.73 1y8b h SER 555 Ca -0.02 -0.24 0.05 0.00 -0.47 0.00 0.00 61.79 61.11 1y8b h SER 555 Cb 0.48 -0.27 -0.05 0.00 -0.31 0.00 0.00 62.40 62.25 1y8b h SER 555 CO -0.02 1.01 0.15 0.58 -0.87 0.00 0.00 176.83 177.67 1y8b h VAL 556 N 1.01 0.88 0.00 0.95 2.07 -1.32 0.11 116.25 119.95 1y8b h VAL 556 Ca 0.21 -0.11 -0.07 0.00 0.82 0.00 0.00 66.70 67.55 1y8b h VAL 556 Cb 0.39 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 1y8b h VAL 556 CO 0.01 0.06 -0.34 1.56 0.02 0.00 0.00 177.57 178.87 1y8b h GLN 557 N 0.32 0.00 -0.21 1.57 7.50 -0.52 -3.00 115.11 120.77 1y8b h GLN 557 Ca 0.19 0.00 -0.05 0.00 0.50 0.00 0.00 58.65 59.29 1y8b h GLN 557 Cb 0.17 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 27.70 1y8b h GLN 557 CO -0.19 0.34 -0.07 0.00 -1.50 0.00 0.00 178.83 177.41 1y8b h ALA 558 N 1.66 0.29 -0.25 3.87 0.00 0.30 0.21 119.26 125.34 1y8b h ALA 558 Ca -0.00 -0.27 0.06 0.00 0.00 0.00 0.00 54.91 54.70 1y8b h ALA 558 Cb 0.70 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 18.35 1y8b h ALA 558 CO 0.04 0.09 -0.19 -0.97 0.00 0.00 0.00 179.25 178.22 1y8b h ASN 559 N 0.13 -0.61 0.24 0.00 -0.00 -0.98 0.45 115.58 114.81 1y8b h ASN 559 Ca 0.05 0.12 -0.17 0.00 -0.00 0.00 0.00 56.30 56.31 1y8b h ASN 559 Cb 0.53 0.30 -0.01 0.00 -0.00 0.00 0.00 38.32 39.15 1y8b h ASN 559 CO 0.02 -0.23 -0.65 0.16 -0.00 0.00 0.00 177.43 176.73 1y8b h ILE 560 N -0.18 1.37 0.00 2.57 3.07 -1.53 -2.73 117.51 120.08 1y8b h ILE 560 Ca 0.14 -2.02 0.00 0.00 1.55 0.00 0.00 64.86 64.53 1y8b h ILE 560 Cb 0.39 2.01 0.00 0.00 -0.27 0.00 0.00 36.82 38.95 1y8b h ILE 560 CO -0.35 0.61 0.00 0.00 -1.05 0.00 0.00 178.15 177.35 1y8b n ALA 561 N -2.50 2.03 0.58 0.16 0.00 0.73 -2.81 120.51 118.69 1y8b n ALA 561 Ca -0.03 -0.09 0.02 0.00 0.00 0.00 0.00 53.44 53.34 1y8b n ALA 561 Cb 0.66 -1.34 0.09 0.00 0.00 0.00 0.00 19.45 18.86 1y8b n ALA 561 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1y8b n GLN 562 N -1.40 1.91 -1.89 0.00 1.13 0.15 -4.92 117.38 112.35 1y8b n GLN 562 Ca 0.07 -0.74 -0.02 0.00 -1.94 0.00 0.00 57.00 54.38 1y8b n GLN 562 Cb 0.21 -1.67 -0.02 0.00 0.11 0.00 0.00 30.24 28.88 1y8b n GLN 562 CO 0.00 0.00 0.00 2.41 -1.44 0.00 0.00 177.06 178.03 1y8b n THR 563 N 0.14 -6.84 0.00 5.09 -1.04 -1.12 -5.02 114.28 105.49 1y8b n THR 563 Ca 0.06 1.10 0.00 0.00 -2.04 0.00 0.00 64.05 63.17 1y8b n THR 563 Cb 0.47 -4.66 0.00 0.00 -1.82 0.00 0.00 70.33 64.32 1y8b n THR 563 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 1y8b n GLU 564 N 0.66 0.00 0.20 -2.82 0.00 -1.26 -4.91 120.64 112.52 1y8b n GLU 564 Ca -0.16 0.00 0.08 0.00 0.00 0.00 0.00 57.16 57.08 1y8b n GLU 564 Cb 0.24 0.00 0.41 0.00 0.00 0.00 0.00 31.44 32.10 1y8b n GLU 564 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.13 177.48 1y8b h PHE 565 N 0.00 0.00 0.00 4.31 3.04 -1.85 -0.46 116.94 121.98 1y8b h PHE 565 Ca 0.00 0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.95 1y8b h PHE 565 Cb 0.00 0.00 0.00 0.00 2.56 0.00 0.00 35.95 38.51 1y8b h PHE 565 CO 0.00 0.00 0.13 0.27 -2.02 0.00 0.00 178.31 176.69 1y8b n ASN 566 N -2.21 0.00 0.20 0.41 0.23 -1.26 -0.22 115.26 112.41 1y8b n ASN 566 Ca -0.01 0.33 0.07 0.00 -0.53 0.00 0.00 54.58 54.44 1y8b n ASN 566 Cb 0.37 -0.33 0.39 0.00 -2.08 0.00 0.00 39.78 38.13 1y8b n ASN 566 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1y8b h ALA 567 N 1.42 1.02 -0.00 -2.53 0.00 -1.51 -2.62 119.26 115.03 1y8b h ALA 567 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1y8b h ALA 567 Cb 0.27 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1y8b h ALA 567 CO 0.00 0.39 -0.57 -1.91 0.00 0.00 0.00 179.25 177.16 1y8b n GLU 568 N -3.49 0.41 -0.25 0.00 4.07 0.69 -4.21 120.64 117.85 1y8b n GLU 568 Ca -0.00 -0.29 0.28 0.00 -0.06 0.00 0.00 57.16 57.09 1y8b n GLU 568 Cb 0.47 -1.49 0.67 0.00 -0.06 0.00 0.00 31.44 31.03 1y8b n GLU 568 CO 0.00 0.00 0.00 0.35 -0.06 0.00 0.00 177.13 177.42 1y8b h PHE 569 N 0.70 0.17 0.00 4.31 3.57 -1.51 -1.37 116.94 122.82 1y8b h PHE 569 Ca 0.00 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.51 1y8b h PHE 569 Cb 0.55 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.24 1y8b h PHE 569 CO 0.00 0.03 -0.06 0.93 -2.23 0.00 0.00 178.31 176.98 1y8b h GLU 570 N 0.11 0.00 -1.60 1.11 5.08 -1.77 -3.31 114.58 114.20 1y8b h GLU 570 Ca 0.50 0.00 0.49 0.00 -1.00 0.00 0.00 59.36 59.34 1y8b h GLU 570 Cb 1.78 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 30.93 1y8b h GLU 570 CO -0.07 0.00 1.11 -1.35 -1.00 0.00 0.00 179.01 177.70 1y8b h PRO 571 N -0.53 0.03 0.00 2.33 0.11 -1.75 1.35 132.00 133.53 1y8b h PRO 571 Ca 0.00 -0.00 -0.08 0.00 0.11 0.00 0.00 66.00 66.02 1y8b h PRO 571 Cb 0.06 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.15 1y8b h PRO 571 CO 0.00 0.02 -0.40 -0.07 -0.21 0.00 0.00 178.00 177.34 1y8b h LEU 572 N 0.03 0.00 -0.27 2.35 3.38 -1.38 -2.47 115.31 116.96 1y8b h LEU 572 Ca 0.84 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.78 1y8b h LEU 572 Cb 3.08 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 43.83 1y8b h LEU 572 CO -0.18 0.40 -0.15 0.25 0.09 0.00 0.00 178.44 178.84 1y8b h LEU 573 N 0.00 0.00 0.06 1.67 5.85 0.17 -2.58 115.31 120.47 1y8b h LEU 573 Ca -0.00 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.71 1y8b h LEU 573 Cb 0.73 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.76 1y8b h LEU 573 CO 0.05 0.15 -0.03 0.44 -0.34 0.00 0.00 178.44 178.72 1y8b h ASP 574 N 0.00 -0.06 0.36 1.25 5.19 -1.29 -3.27 116.42 118.60 1y8b h ASP 574 Ca -0.00 -0.54 -0.03 0.00 -0.62 0.00 0.00 57.03 55.84 1y8b h ASP 574 Cb 1.02 0.02 -0.00 0.00 0.18 0.00 0.00 39.33 40.55 1y8b h ASP 574 CO 0.02 0.65 -0.16 0.44 -3.12 0.00 0.00 179.24 177.07 1y8b h ASP 575 N -0.93 0.00 -0.81 6.45 5.19 -1.60 -2.64 116.42 122.08 1y8b h ASP 575 Ca -0.01 0.00 0.13 0.00 -0.62 0.00 0.00 57.03 56.53 1y8b h ASP 575 Cb 0.60 0.00 -0.09 0.00 0.18 0.00 0.00 39.33 40.02 1y8b h ASP 575 CO 0.01 0.16 0.42 0.25 -3.12 0.00 0.00 179.24 176.96 1y8b h LEU 576 N 0.00 0.52 0.00 1.55 6.46 -1.51 0.92 115.31 123.26 1y8b h LEU 576 Ca -0.00 0.08 0.00 0.00 -0.12 0.00 0.00 57.88 57.84 1y8b h LEU 576 Cb 0.38 -0.01 0.00 0.00 -0.73 0.00 0.00 40.66 40.31 1y8b h LEU 576 CO 0.02 0.25 0.00 0.18 -0.62 0.00 0.00 178.44 178.27 1y8b n LEU 577 N -4.86 0.00 -4.55 2.25 4.77 -0.99 -4.50 117.00 109.12 1y8b n LEU 577 Ca 0.15 0.16 -0.42 0.00 -0.03 0.00 0.00 56.01 55.86 1y8b n LEU 577 Cb 0.37 -0.16 -0.07 0.00 -2.33 0.00 0.00 43.42 41.24 1y8b n LEU 577 CO 0.23 -0.10 0.36 -0.89 -1.33 0.00 0.00 177.39 175.66 1y8b s THR 578 N -2.31 4.88 0.29 -5.08 2.01 0.32 -4.84 115.64 110.91 1y8b s THR 578 Ca 0.14 0.40 -0.16 0.00 0.31 0.00 0.00 61.69 62.38 1y8b s THR 578 Cb 0.08 -4.11 -0.09 0.00 0.01 0.00 0.00 72.50 68.39 1y8b s THR 578 CO 0.15 -0.40 0.72 0.27 -0.69 0.00 0.00 174.62 174.68 1y8b s ILE 579 N 2.71 4.67 -0.61 1.82 -5.25 -1.26 -4.94 121.20 118.34 1y8b s ILE 579 Ca 0.23 1.00 -0.07 0.00 -0.99 0.00 0.00 60.65 60.82 1y8b s ILE 579 Cb -0.14 -3.67 -0.18 0.00 2.95 0.00 0.00 42.46 41.41 1y8b s ILE 579 CO 0.16 -0.08 3.16 -0.81 -1.79 0.00 0.00 174.94 175.58 1y8b n PRO 580 N -0.07 2.48 -2.60 0.37 -0.04 -1.26 -4.88 135.00 129.00 1y8b n PRO 580 Ca 0.02 -1.39 -0.42 0.00 -0.04 0.00 0.00 63.50 61.68 1y8b n PRO 580 Cb 0.53 -2.28 -0.03 0.00 -0.04 0.00 0.00 33.50 31.68 1y8b n PRO 580 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1y8b s VAL 581 N 1.66 3.87 -0.30 0.52 0.11 -1.26 -2.06 120.40 122.93 1y8b s VAL 581 Ca 0.63 0.46 -0.16 0.00 -2.93 0.00 0.00 61.98 59.98 1y8b s VAL 581 Cb 0.24 -4.84 0.17 0.00 -1.53 0.00 0.00 36.38 30.42 1y8b s VAL 581 CO -0.02 -1.67 1.03 0.00 -3.33 0.00 0.00 175.10 171.11 1y8b s ALA 582 N 5.33 -2.74 -0.03 1.54 0.00 -1.23 -4.94 121.76 119.69 1y8b s ALA 582 Ca 0.36 2.03 -0.01 0.00 0.00 0.00 0.00 51.96 54.34 1y8b s ALA 582 Cb -0.09 -2.05 0.03 0.00 0.00 0.00 0.00 23.12 21.01 1y8b s ALA 582 CO 0.17 -0.89 0.04 -2.00 0.00 0.00 0.00 175.76 173.08 1y8b s GLU 583 N 2.28 -0.04 0.00 0.00 2.12 -1.26 -4.28 118.70 117.51 1y8b s GLU 583 Ca -0.03 0.27 0.03 0.00 0.36 0.00 0.00 54.97 55.60 1y8b s GLU 583 Cb -0.05 -0.38 0.16 0.00 0.26 0.00 0.00 34.13 34.12 1y8b s GLU 583 CO -0.17 -0.24 0.57 0.09 -0.54 0.00 0.00 175.26 174.96 1y8b n ASN 584 N 4.69 0.00 0.00 -1.70 3.02 -1.26 -4.89 115.26 115.12 1y8b n ASN 584 Ca -0.17 -0.72 0.00 0.00 -0.03 0.00 0.00 54.58 53.66 1y8b n ASN 584 Cb 0.50 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.67 1y8b n ASN 584 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1y8b n ALA 585 N -0.60 0.00 -2.84 5.41 0.00 -1.26 -2.25 120.51 118.96 1y8b n ALA 585 Ca 0.02 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.20 1y8b n ALA 585 Cb 0.01 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.43 1y8b n ALA 585 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1y8b n ASN 586 N 10.04 4.31 0.00 0.00 5.03 -1.26 -4.96 115.26 128.42 1y8b n ASN 586 Ca 0.00 -3.65 0.00 0.00 0.87 0.00 0.00 54.58 51.80 1y8b n ASN 586 Cb 0.00 -0.54 0.00 0.00 -1.02 0.00 0.00 39.78 38.22 1y8b n ASN 586 CO 0.00 0.00 0.00 -2.67 -1.83 0.00 0.00 177.26 172.76 1y8b n TRP 587 N -0.27 0.00 -3.68 3.10 2.14 -0.96 -4.60 117.44 113.17 1y8b n TRP 587 Ca 0.32 0.00 -0.32 0.00 2.07 0.00 0.00 57.50 59.57 1y8b n TRP 587 Cb 0.47 0.00 -0.05 0.00 -0.81 0.00 0.00 31.31 30.92 1y8b n TRP 587 CO 0.00 0.00 0.00 -1.54 2.07 0.00 0.00 177.69 178.22 1y8b s SER 588 N -2.91 6.50 0.53 -0.67 1.04 -1.26 -4.97 113.70 111.96 1y8b s SER 588 Ca 0.00 0.60 0.33 0.00 0.48 0.00 0.00 55.95 57.36 1y8b s SER 588 Cb 0.00 -2.09 1.37 0.00 0.10 0.00 0.00 66.02 65.40 1y8b s SER 588 CO 0.00 0.08 1.97 0.00 0.98 0.00 0.00 173.24 176.27 1y8b h ALA 589 N 2.99 1.00 -0.11 5.32 0.00 -2.01 -2.96 119.26 123.48 1y8b h ALA 589 Ca -0.46 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.30 1y8b h ALA 589 Cb 1.17 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.97 1y8b h ALA 589 CO 0.72 0.00 -0.49 0.37 0.00 0.00 0.00 179.25 179.85 1y8b h GLN 590 N 0.00 0.52 0.52 0.00 5.75 -1.97 -1.73 115.11 118.20 1y8b h GLN 590 Ca 0.00 -0.42 -0.02 0.00 -0.15 0.00 0.00 58.65 58.06 1y8b h GLN 590 Cb 0.48 0.08 -0.00 0.00 1.07 0.00 0.00 27.48 29.12 1y8b h GLN 590 CO 0.00 1.05 -0.30 0.93 -2.65 0.00 0.00 178.83 177.86 1y8b h GLU 591 N 0.13 -0.73 -0.03 1.69 3.07 -1.93 0.51 114.58 117.28 1y8b h GLU 591 Ca -0.03 0.05 0.03 0.00 -0.50 0.00 0.00 59.36 58.91 1y8b h GLU 591 Cb 1.13 0.17 -0.06 0.00 -0.84 0.00 0.00 28.75 29.15 1y8b h GLU 591 CO 0.10 -0.49 -0.39 0.82 -1.40 0.00 0.00 179.01 177.65 1y8b h ILE 592 N -0.76 0.19 -0.92 3.13 1.08 -1.66 2.01 117.51 120.57 1y8b h ILE 592 Ca -0.07 0.00 0.18 0.00 -0.39 0.00 0.00 64.86 64.58 1y8b h ILE 592 Cb 0.60 0.19 -0.11 0.00 -3.07 0.00 0.00 36.82 34.43 1y8b h ILE 592 CO 0.08 0.00 0.51 -0.61 -0.69 0.00 0.00 178.15 177.44 1y8b h GLN 593 N -0.53 0.63 -0.05 2.37 5.75 -1.25 2.38 115.11 124.41 1y8b h GLN 593 Ca 0.06 -0.04 -0.17 0.00 -0.15 0.00 0.00 58.65 58.35 1y8b h GLN 593 Cb 0.62 -0.14 0.01 0.00 1.07 0.00 0.00 27.48 29.04 1y8b h GLN 593 CO -0.32 0.41 -0.63 1.96 -2.65 0.00 0.00 178.83 177.59 1y8b h GLN 594 N 0.64 0.51 0.16 1.69 1.08 0.20 -1.52 115.11 117.87 1y8b h GLN 594 Ca 0.53 -0.49 -0.01 0.00 -1.45 0.00 0.00 58.65 57.24 1y8b h GLN 594 Cb 0.84 0.12 0.00 0.00 -0.05 0.00 0.00 27.48 28.39 1y8b h GLN 594 CO -0.40 1.12 -0.08 0.93 -0.95 0.00 0.00 178.83 179.46 1y8b h GLU 595 N 0.08 -0.21 0.14 1.46 3.07 0.46 -1.95 114.58 117.64 1y8b h GLU 595 Ca -0.07 0.01 0.02 0.00 -0.50 0.00 0.00 59.36 58.82 1y8b h GLU 595 Cb 1.31 0.05 -0.03 0.00 -0.84 0.00 0.00 28.75 29.23 1y8b h GLU 595 CO 0.13 0.22 -0.27 1.25 -1.40 0.00 0.00 179.01 178.94 1y8b h LEU 596 N -0.81 -0.77 -0.34 1.33 6.46 0.38 -2.02 115.31 119.54 1y8b h LEU 596 Ca -0.02 0.09 0.07 0.00 -0.12 0.00 0.00 57.88 57.89 1y8b h LEU 596 Cb 0.53 0.29 -0.09 0.00 -0.73 0.00 0.00 40.66 40.66 1y8b h LEU 596 CO 0.04 -0.37 -0.35 -0.78 -0.62 0.00 0.00 178.44 176.36 1y8b h ASP 597 N -0.50 -1.15 -1.10 1.25 1.82 -1.36 0.45 116.42 115.84 1y8b h ASP 597 Ca 0.02 0.19 0.31 0.00 -0.39 0.00 0.00 57.03 57.16 1y8b h ASP 597 Cb 0.51 0.52 -0.11 0.00 0.68 0.00 0.00 39.33 40.93 1y8b h ASP 597 CO -0.14 -0.34 0.70 -1.13 -1.61 0.00 0.00 179.24 176.71 1y8b h ASN 598 N -0.30 0.42 0.33 2.28 -0.00 -0.86 0.57 115.58 118.02 1y8b h ASN 598 Ca 0.15 0.11 -0.02 0.00 -0.00 0.00 0.00 56.30 56.54 1y8b h ASN 598 Cb 0.55 0.05 0.00 0.00 -0.00 0.00 0.00 38.32 38.93 1y8b h ASN 598 CO -0.51 0.01 -0.16 0.78 -0.00 0.00 0.00 177.43 177.55 1y8b h ASN 599 N 0.33 -0.38 -0.35 1.15 4.21 0.52 -2.09 115.58 118.97 1y8b h ASN 599 Ca 0.66 0.01 0.08 0.00 1.21 0.00 0.00 56.30 58.26 1y8b h ASN 599 Cb 1.75 0.10 -0.07 0.00 -1.12 0.00 0.00 38.32 38.97 1y8b h ASN 599 CO -0.36 -0.04 -0.14 0.58 -1.29 0.00 0.00 177.43 176.18 1y8b h VAL 600 N -0.92 0.53 0.03 2.81 2.07 -0.17 0.06 116.25 120.66 1y8b h VAL 600 Ca -0.05 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.50 1y8b h VAL 600 Cb 0.34 0.53 -0.05 0.00 -1.52 0.00 0.00 31.29 30.59 1y8b h VAL 600 CO 0.08 0.00 -0.48 -0.61 0.02 0.00 0.00 177.57 176.57 1y8b h GLN 601 N -0.08 -0.63 -0.94 1.57 4.15 0.02 0.70 115.11 119.90 1y8b h GLN 601 Ca 0.18 0.04 0.20 0.00 0.77 0.00 0.00 58.65 59.84 1y8b h GLN 601 Cb 0.35 0.14 -0.08 0.00 0.21 0.00 0.00 27.48 28.10 1y8b h GLN 601 CO -0.41 -0.42 0.61 0.78 -1.93 0.00 0.00 178.83 177.46 1y8b h GLY 602 N -0.65 1.09 0.31 2.39 0.00 -0.71 -0.77 103.07 104.73 1y8b h GLY 602 Ca 0.02 -0.23 -0.01 0.00 0.00 0.00 0.00 47.33 47.11 1y8b h GLY 602 CO -0.33 -0.02 -0.15 -2.22 0.00 0.00 0.00 176.54 173.82 1y8b h ILE 603 N 0.49 0.00 -0.92 2.60 2.04 0.12 -1.13 117.51 120.71 1y8b h ILE 603 Ca 0.50 -0.63 0.27 0.00 1.00 0.00 0.00 64.86 66.00 1y8b h ILE 603 Cb 1.13 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 37.18 1y8b h ILE 603 CO -0.23 0.00 0.79 -0.07 0.00 0.00 0.00 178.15 178.64 1y8b h LEU 604 N -1.04 0.00 0.12 1.44 -0.00 0.67 0.12 115.31 116.63 1y8b h LEU 604 Ca -0.04 0.00 -0.30 0.00 -0.00 0.00 0.00 57.88 57.54 1y8b h LEU 604 Cb 0.31 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.97 1y8b h LEU 604 CO 0.07 0.00 -1.56 1.23 -0.00 0.00 0.00 178.44 178.18 1y8b h GLY 605 N 0.00 0.30 0.60 0.83 0.00 -1.15 -3.03 103.07 100.62 1y8b h GLY 605 Ca 0.44 -0.76 -0.03 0.00 0.00 0.00 0.00 47.33 46.98 1y8b h GLY 605 CO -0.00 0.67 -0.06 -0.97 0.00 0.00 0.00 176.54 176.17 1y8b h TYR 606 N -0.21 0.18 0.52 5.60 0.05 0.21 -2.82 116.97 120.49 1y8b h TYR 606 Ca -0.33 -0.05 -0.03 0.00 0.05 0.00 0.00 58.73 58.37 1y8b h TYR 606 Cb 1.84 -0.04 0.01 0.00 1.01 0.00 0.00 36.73 39.55 1y8b h TYR 606 CO 0.11 0.61 -0.25 0.28 -1.05 0.00 0.00 178.16 177.86 1y8b h VAL 607 N -0.31 0.31 -0.83 -2.88 2.07 -1.02 0.51 116.25 114.10 1y8b h VAL 607 Ca 0.01 -0.43 0.20 0.00 0.82 0.00 0.00 66.70 67.30 1y8b h VAL 607 Cb 0.58 0.44 -0.13 0.00 -1.52 0.00 0.00 31.29 30.66 1y8b h VAL 607 CO 0.02 0.05 0.26 1.62 0.02 0.00 0.00 177.57 179.53 1y8b h VAL 608 N -1.02 0.43 0.00 2.57 3.04 -1.65 0.20 116.25 119.82 1y8b h VAL 608 Ca -0.07 -0.10 0.00 0.00 -1.01 0.00 0.00 66.70 65.52 1y8b h VAL 608 Cb 0.62 0.12 0.00 0.00 -2.01 0.00 0.00 31.29 30.01 1y8b h VAL 608 CO 0.12 0.05 -0.19 0.03 -1.01 0.00 0.00 177.57 176.57 1y8b h ARG 609 N 0.29 0.00 -1.13 4.17 3.08 -1.48 -2.60 114.38 116.70 1y8b h ARG 609 Ca 0.50 0.00 0.32 0.00 0.07 0.00 0.00 59.98 60.88 1y8b h ARG 609 Cb 0.95 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 30.89 1y8b h ARG 609 CO -0.57 0.00 0.73 2.35 -1.07 0.00 0.00 179.97 181.41 1y8b h TRP 610 N -0.90 0.59 0.00 3.04 7.01 0.11 0.80 115.95 126.61 1y8b h TRP 610 Ca 0.00 0.02 -0.17 0.00 2.11 0.00 0.00 58.89 60.85 1y8b h TRP 610 Cb 0.19 -0.16 -0.03 0.00 -2.10 0.00 0.00 29.16 27.06 1y8b h TRP 610 CO -0.08 -0.03 -1.02 0.28 -2.79 0.00 0.00 178.44 174.79 1y8b h VAL 611 N 0.28 0.95 0.00 2.65 2.07 -0.72 -1.79 116.25 119.69 1y8b h VAL 611 Ca 0.67 -2.48 -0.20 0.00 0.82 0.00 0.00 66.70 65.51 1y8b h VAL 611 Cb 1.87 2.40 -0.03 0.00 -1.52 0.00 0.00 31.29 34.02 1y8b h VAL 611 CO -0.33 0.54 -1.09 -0.33 0.02 0.00 0.00 177.57 176.38 1y8b h GLU 612 N 0.00 0.00 0.00 1.57 4.39 0.29 -3.40 114.58 117.42 1y8b h GLU 612 Ca -0.08 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.62 1y8b h GLU 612 Cb 1.60 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.25 1y8b h GLU 612 CO 0.08 0.96 -1.56 1.04 -1.16 0.00 0.00 179.01 178.37 1y8b n GLN 613 N -4.46 0.37 -2.85 2.33 6.02 0.23 -4.99 117.38 114.03 1y8b n GLN 613 Ca -0.29 -0.11 -0.11 0.00 -0.01 0.00 0.00 57.00 56.49 1y8b n GLN 613 Cb 0.64 -1.51 0.03 0.00 1.02 0.00 0.00 30.24 30.42 1y8b n GLN 613 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1y8b n GLY 614 N 1.37 0.23 3.08 1.08 0.00 -0.67 -4.99 105.19 105.28 1y8b n GLY 614 Ca -0.00 -0.30 -0.13 0.00 0.00 0.00 0.00 46.02 45.59 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 -3.02 -0.02 -0.26 -0.61 -4.36 -1.26 -4.99 121.20 106.68 1y8b s ILE 615 Ca 0.22 0.08 0.01 0.00 -0.26 0.00 0.00 60.65 60.70 1y8b s ILE 615 Cb -0.10 -0.35 0.27 0.00 1.25 0.00 0.00 42.46 43.54 1y8b s ILE 615 CO 0.27 0.03 1.68 0.61 0.24 0.00 0.00 174.94 177.77 1y8b n GLY 616 N 3.67 3.57 3.81 6.27 0.00 -1.26 -3.89 105.19 117.35 1y8b n GLY 616 Ca -0.20 -0.76 -0.30 0.00 0.00 0.00 0.00 46.02 44.77 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 0.24 0.00 -4.88 0.00 2.88 -1.26 -5.00 113.62 105.60 1y8b n SER 618 Ca -0.08 0.00 -0.32 0.00 -1.33 0.00 0.00 58.87 57.14 1y8b n SER 618 Cb 0.52 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.93 1y8b n SER 618 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 1y8b s LYS 619 N -5.32 3.71 -0.17 -1.46 1.02 -1.26 -4.93 119.74 111.33 1y8b s LYS 619 Ca 0.00 0.09 -0.02 0.00 0.02 0.00 0.00 55.97 56.06 1y8b s LYS 619 Cb 0.00 -2.81 -0.01 0.00 -0.52 0.00 0.00 37.83 34.49 1y8b s LYS 619 CO 0.00 0.43 -0.09 0.08 -0.92 0.00 0.00 175.35 174.85 1y8b s VAL 620 N -1.67 3.17 0.51 3.17 1.01 -0.80 -4.89 120.40 120.90 1y8b s VAL 620 Ca 0.42 -0.59 -0.18 0.00 0.00 0.00 0.00 61.98 61.62 1y8b s VAL 620 Cb -0.12 -2.38 -0.08 0.00 0.00 0.00 0.00 36.38 33.80 1y8b s VAL 620 CO 0.22 0.48 1.01 -2.16 0.00 0.00 0.00 175.10 174.65 1y8b s PRO 621 N 0.85 3.84 -0.71 2.72 0.04 -1.26 0.15 135.00 140.63 1y8b s PRO 621 Ca -0.03 1.14 0.00 0.00 0.04 0.00 0.00 61.00 62.15 1y8b s PRO 621 Cb -0.15 -2.11 0.38 0.00 0.04 0.00 0.00 34.50 32.65 1y8b s PRO 621 CO 0.01 -0.37 1.76 -0.40 0.04 0.00 0.00 177.00 178.03 1y8b n ASP 622 N -1.32 6.70 0.00 6.66 5.68 -1.26 -4.82 116.55 128.18 1y8b n ASP 622 Ca 0.08 -3.80 0.00 0.00 -0.50 0.00 0.00 54.79 50.57 1y8b n ASP 622 Cb 0.53 -0.88 0.00 0.00 -1.14 0.00 0.00 41.12 39.64 1y8b n ASP 622 CO 0.00 0.00 0.00 -0.38 -1.33 0.00 0.00 177.20 175.49 1y8b n ILE 623 N -0.55 0.00 1.50 2.12 2.08 -1.26 -4.45 119.36 118.80 1y8b n ILE 623 Ca 0.50 0.00 0.11 0.00 0.56 0.00 0.00 62.75 63.92 1y8b n ILE 623 Cb 0.39 0.00 0.66 0.00 -0.75 0.00 0.00 39.64 39.94 1y8b n ILE 623 CO 0.00 0.00 0.00 1.41 0.56 0.00 0.00 176.55 178.52 1y8b n HIS 624 N 0.00 0.00 -0.91 1.39 8.25 -1.26 -4.81 115.22 117.88 1y8b n HIS 624 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1y8b n HIS 624 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 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 -0.96 -0.40 0.00 0.41 2.85 -1.26 -4.97 115.26 110.93 1y8b n ASN 625 Ca 0.17 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.64 1y8b n ASN 625 Cb 0.08 -0.59 0.00 0.00 1.24 0.00 0.00 39.78 40.51 1y8b n ASN 625 CO 0.00 0.00 0.00 0.52 -2.11 0.00 0.00 177.26 175.67 1y8b n VAL 626 N -2.09 0.00 0.00 3.44 0.31 -1.26 -4.87 118.33 113.86 1y8b n VAL 626 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1y8b n VAL 626 Cb 0.01 -0.26 0.00 0.00 -0.91 0.00 0.00 33.84 32.68 1y8b n VAL 626 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1y8b n ALA 627 N -3.00 0.00 -2.65 3.52 0.00 -1.26 -4.71 120.51 112.40 1y8b n ALA 627 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.03 1y8b n ALA 627 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 1y8b n ALA 627 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1y8b s LEU 628 N 0.00 4.12 -0.20 0.00 1.43 0.40 -4.59 118.68 119.85 1y8b s LEU 628 Ca 0.00 0.92 -0.03 0.00 -1.03 0.00 0.00 54.13 54.00 1y8b s LEU 628 Cb 0.00 -3.02 0.06 0.00 0.03 0.00 0.00 46.19 43.26 1y8b s LEU 628 CO 0.00 -0.36 0.03 -0.32 0.23 0.00 0.00 176.35 175.92 1y8b s MET 629 N 2.25 0.71 0.56 1.70 1.75 -1.26 -1.90 119.30 123.11 1y8b s MET 629 Ca 0.32 -0.45 0.09 0.00 -1.25 0.00 0.00 55.69 54.39 1y8b s MET 629 Cb -0.16 -2.13 0.08 0.00 2.84 0.00 0.00 34.83 35.46 1y8b s MET 629 CO 0.10 -0.64 0.77 -2.00 -0.65 0.00 0.00 175.02 172.60 1y8b s GLU 630 N 1.83 2.36 0.00 4.11 2.56 -1.26 -3.80 118.70 124.50 1y8b s GLU 630 Ca -0.01 -1.57 0.00 0.00 0.00 0.00 0.00 54.97 53.38 1y8b s GLU 630 Cb -0.17 -2.65 0.00 0.00 2.00 0.00 0.00 34.13 33.31 1y8b s GLU 630 CO -0.08 -0.80 0.00 -0.25 -0.56 0.00 0.00 175.26 173.57 1y8b n ASP 631 N -2.21 0.00 0.15 -1.70 9.92 -1.26 -4.82 116.55 116.63 1y8b n ASP 631 Ca 0.15 -0.99 0.12 0.00 -0.53 0.00 0.00 54.79 53.53 1y8b n ASP 631 Cb 0.61 0.00 0.13 0.00 -0.64 0.00 0.00 41.12 41.22 1y8b n ASP 631 CO 0.00 0.00 0.00 0.03 0.13 0.00 0.00 177.20 177.36 1y8b h ARG 632 N 0.00 0.00 0.00 -1.24 -0.00 -1.93 -3.25 114.38 107.96 1y8b h ARG 632 Ca 0.00 0.00 -0.14 0.00 -0.50 0.00 0.00 59.98 59.34 1y8b h ARG 632 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 29.97 29.95 1y8b h ARG 632 CO 0.00 0.00 -0.68 0.00 0.00 0.00 0.00 179.97 179.29 1y8b h ALA 633 N 2.10 0.83 -0.23 0.04 0.00 -1.91 -3.28 119.26 116.81 1y8b h ALA 633 Ca 0.00 -0.62 0.03 0.00 0.00 0.00 0.00 54.91 54.32 1y8b h ALA 633 Cb 0.95 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 18.57 1y8b h ALA 633 CO 0.00 0.85 -0.49 1.15 0.00 0.00 0.00 179.25 180.76 1y8b h THR 634 N 0.00 0.00 -1.06 0.00 2.02 -1.93 0.54 112.91 112.48 1y8b h THR 634 Ca -0.01 0.00 0.28 0.00 0.77 0.00 0.00 66.41 67.45 1y8b h THR 634 Cb 1.24 0.00 -0.10 0.00 -1.74 0.00 0.00 68.15 67.55 1y8b h THR 634 CO 0.09 0.00 0.68 0.25 0.37 0.00 0.00 175.52 176.91 1y8b h LEU 635 N -0.45 0.44 0.61 2.58 7.12 -1.77 2.33 115.31 126.17 1y8b h LEU 635 Ca 0.04 0.09 -0.03 0.00 0.13 0.00 0.00 57.88 58.12 1y8b h LEU 635 Cb 0.58 0.02 0.01 0.00 -0.53 0.00 0.00 40.66 40.74 1y8b h LEU 635 CO -0.45 0.06 -0.29 -0.09 -0.13 0.00 0.00 178.44 177.53 1y8b h ARG 636 N 0.38 -0.79 -0.13 1.25 9.65 -0.15 -2.94 114.38 121.65 1y8b h ARG 636 Ca 0.62 0.05 -0.15 0.00 -1.10 0.00 0.00 59.98 59.40 1y8b h ARG 636 Cb 1.58 0.18 0.01 0.00 -1.39 0.00 0.00 29.97 30.35 1y8b h ARG 636 CO -0.32 -0.53 -0.50 0.97 2.80 0.00 0.00 179.97 182.39 1y8b h ILE 637 N -1.08 1.35 -0.85 1.20 6.09 0.09 -3.24 117.51 121.08 1y8b h ILE 637 Ca -0.08 -1.80 0.19 0.00 -1.37 0.00 0.00 64.86 61.80 1y8b h ILE 637 Cb 0.63 2.11 -0.15 0.00 0.47 0.00 0.00 36.82 39.87 1y8b h ILE 637 CO 0.14 0.55 -0.07 0.77 -3.07 0.00 0.00 178.15 176.47 1y8b h SER 638 N 0.19 -0.54 -0.72 2.19 4.64 0.38 2.12 113.55 121.81 1y8b h SER 638 Ca -0.03 0.24 0.21 0.00 -0.47 0.00 0.00 61.79 61.74 1y8b h SER 638 Cb 1.14 0.44 -0.03 0.00 -0.31 0.00 0.00 62.40 63.64 1y8b h SER 638 CO 0.11 -0.26 0.73 0.28 -0.87 0.00 0.00 176.83 176.82 1y8b h SER 639 N 0.05 0.00 0.14 4.97 0.02 -1.54 0.32 113.55 117.51 1y8b h SER 639 Ca 0.46 0.00 -0.30 0.00 -0.84 0.00 0.00 61.79 61.11 1y8b h SER 639 Cb 0.81 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.35 1y8b h SER 639 CO -0.80 0.00 -1.49 -0.61 -1.14 0.00 0.00 176.83 172.78 1y8b h GLN 640 N 0.00 0.29 0.03 3.45 4.15 0.33 -3.00 115.11 120.35 1y8b h GLN 640 Ca 0.34 -0.50 0.03 0.00 0.77 0.00 0.00 58.65 59.29 1y8b h GLN 640 Cb 1.81 0.19 -0.05 0.00 0.21 0.00 0.00 27.48 29.64 1y8b h GLN 640 CO -0.00 1.24 -0.30 0.45 -1.93 0.00 0.00 178.83 178.28 1y8b h HIS 641 N -0.18 -0.83 -0.06 3.99 3.86 0.38 0.24 115.15 122.54 1y8b h HIS 641 Ca -0.31 0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 58.90 1y8b h HIS 641 Cb 1.86 0.36 -0.01 0.00 1.06 0.00 0.00 27.41 30.68 1y8b h HIS 641 CO 0.12 -0.40 -0.06 0.97 0.86 0.00 0.00 177.93 179.42 1y8b h ILE 642 N -0.47 1.08 0.56 2.45 2.10 -1.49 -2.50 117.51 119.24 1y8b h ILE 642 Ca 0.05 -0.35 -0.03 0.00 1.08 0.00 0.00 64.86 65.61 1y8b h ILE 642 Cb 0.54 1.11 0.01 0.00 -1.09 0.00 0.00 36.82 37.39 1y8b h ILE 642 CO -0.24 0.11 -0.27 0.00 -1.08 0.00 0.00 178.15 176.67 1y8b h ALA 643 N 1.86 -0.84 -1.06 0.18 0.00 -0.84 0.26 119.26 118.82 1y8b h ALA 643 Ca 0.02 -0.16 0.31 0.00 0.00 0.00 0.00 54.91 55.07 1y8b h ALA 643 Cb 0.16 0.29 -0.13 0.00 0.00 0.00 0.00 17.79 18.12 1y8b h ALA 643 CO 0.01 -0.79 0.64 -0.97 0.00 0.00 0.00 179.25 178.14 1y8b h ASN 644 N -1.06 0.50 -0.15 0.00 -0.73 -0.51 0.60 115.58 114.23 1y8b h ASN 644 Ca -0.08 0.14 -0.22 0.00 1.87 0.00 0.00 56.30 58.02 1y8b h ASN 644 Cb 0.58 0.08 0.01 0.00 0.27 0.00 0.00 38.32 39.25 1y8b h ASN 644 CO 0.13 -0.03 -0.76 -0.50 -0.37 0.00 0.00 177.43 175.90 1y8b h TRP 645 N 0.37 1.06 -0.89 0.67 -0.00 -1.33 -1.31 115.95 114.52 1y8b h TRP 645 Ca 0.69 -0.47 0.14 0.00 -0.00 0.00 0.00 58.89 59.25 1y8b h TRP 645 Cb 1.65 -0.16 -0.09 0.00 -0.00 0.00 0.00 29.16 30.56 1y8b h TRP 645 CO -0.01 1.30 0.49 1.25 -0.00 0.00 0.00 178.44 181.48 1y8b h LEU 646 N 0.52 0.64 0.03 -4.49 7.12 0.38 3.14 115.31 122.66 1y8b h LEU 646 Ca -0.05 0.08 -0.08 0.00 0.13 0.00 0.00 57.88 57.96 1y8b h LEU 646 Cb 1.39 -0.03 0.00 0.00 -0.53 0.00 0.00 40.66 41.49 1y8b h LEU 646 CO 0.16 0.29 -0.37 0.03 -0.13 0.00 0.00 178.44 178.41 1y8b h ARG 647 N 0.72 0.07 -0.96 1.25 2.47 -1.29 -3.39 114.38 113.25 1y8b h ARG 647 Ca 0.47 -0.12 -0.57 0.00 -1.26 0.00 0.00 59.98 58.50 1y8b h ARG 647 Cb 0.62 0.05 -0.42 0.00 -1.65 0.00 0.00 29.97 28.57 1y8b h ARG 647 CO -0.34 1.06 -0.65 0.72 0.56 0.00 0.00 179.97 181.32 1y8b n HIS 648 N -4.46 2.94 -0.21 3.04 8.25 -0.50 -4.60 115.22 119.68 1y8b n HIS 648 Ca -0.14 -2.48 0.00 0.00 -0.26 0.00 0.00 57.72 54.85 1y8b n HIS 648 Cb 0.59 -0.37 0.00 0.00 1.12 0.00 0.00 29.99 31.33 1y8b n HIS 648 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1y8b n GLY 649 N -0.67 -0.43 3.43 -1.41 0.00 1.05 -4.78 105.19 102.37 1y8b n GLY 649 Ca 0.44 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.25 1y8b n GLY 649 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1y8b n ILE 650 N -0.08 -7.80 -5.16 -0.61 5.41 -1.25 -4.66 119.36 105.22 1y8b n ILE 650 Ca 0.00 -1.11 -0.32 0.00 1.00 0.00 0.00 62.75 62.32 1y8b n ILE 650 Cb 0.10 -5.60 -0.16 0.00 -0.71 0.00 0.00 39.64 33.27 1y8b n ILE 650 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 1y8b s LEU 651 N -5.75 2.24 0.04 1.39 1.43 -1.26 -5.03 118.68 111.75 1y8b s LEU 651 Ca 0.43 -0.45 -0.20 0.00 -1.03 0.00 0.00 54.13 52.88 1y8b s LEU 651 Cb -0.10 -1.43 -0.06 0.00 0.03 0.00 0.00 46.19 44.63 1y8b s LEU 651 CO 0.79 0.25 0.59 0.42 0.23 0.00 0.00 176.35 178.63 1y8b s THR 652 N -0.16 4.79 0.52 5.49 -4.23 -1.26 -4.93 115.64 115.87 1y8b s THR 652 Ca -0.03 1.26 0.34 0.00 -1.18 0.00 0.00 61.69 62.08 1y8b s THR 652 Cb -0.14 -3.93 0.53 0.00 1.34 0.00 0.00 72.50 70.30 1y8b s THR 652 CO 0.04 0.49 1.81 0.11 -0.54 0.00 0.00 174.62 176.53 1y8b h LYS 653 N 5.00 0.05 0.00 3.99 6.56 -1.99 1.34 116.57 131.52 1y8b h LYS 653 Ca -0.48 -0.00 -0.01 0.00 -1.06 0.00 0.00 60.65 59.10 1y8b h LYS 653 Cb 1.21 -0.01 -0.00 0.00 -0.57 0.00 0.00 32.23 32.86 1y8b h LYS 653 CO 0.66 0.03 -0.04 0.93 -2.06 0.00 0.00 179.45 178.98 1y8b h GLU 654 N 0.05 0.00 0.04 3.15 5.08 -1.98 -2.44 114.58 118.49 1y8b h GLU 654 Ca 0.56 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.92 1y8b h GLU 654 Cb 2.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.38 1y8b h GLU 654 CO -0.05 0.04 -0.02 0.37 -1.00 0.00 0.00 179.01 178.35 1y8b h GLN 655 N 0.00 -0.06 -0.36 2.33 4.15 0.14 -2.58 115.11 118.74 1y8b h GLN 655 Ca -0.00 0.00 0.03 0.00 0.77 0.00 0.00 58.65 59.45 1y8b h GLN 655 Cb 0.64 0.01 -0.03 0.00 0.21 0.00 0.00 27.48 28.31 1y8b h GLN 655 CO 0.00 -0.04 0.16 0.28 -1.93 0.00 0.00 178.83 177.31 1y8b h VAL 656 N -0.96 0.96 -0.77 2.39 2.07 -1.61 0.39 116.25 118.71 1y8b h VAL 656 Ca -0.01 -0.12 0.04 0.00 0.82 0.00 0.00 66.70 67.44 1y8b h VAL 656 Cb 0.05 0.58 -0.04 0.00 -1.52 0.00 0.00 31.29 30.35 1y8b h VAL 656 CO 0.01 0.06 0.51 -0.61 0.02 0.00 0.00 177.57 177.56 1y8b h GLN 657 N 0.34 0.90 -0.10 1.57 4.15 -1.59 -1.93 115.11 118.46 1y8b h GLN 657 Ca 0.16 -0.05 -0.23 0.00 0.77 0.00 0.00 58.65 59.29 1y8b h GLN 657 Cb 0.09 -0.20 0.01 0.00 0.21 0.00 0.00 27.48 27.59 1y8b h GLN 657 CO -0.12 0.59 -0.86 0.00 -1.93 0.00 0.00 178.83 176.51 1y8b h ALA 658 N 1.56 0.29 0.35 3.38 0.00 -0.83 -2.50 119.26 121.50 1y8b h ALA 658 Ca 0.31 -0.63 -0.00 0.00 0.00 0.00 0.00 54.91 54.59 1y8b h ALA 658 Cb 0.08 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1y8b h ALA 658 CO -0.09 0.70 -0.37 1.03 0.00 0.00 0.00 179.25 180.52 1y8b h SER 659 N 0.46 -1.00 -0.72 0.00 0.87 0.49 -1.02 113.55 112.64 1y8b h SER 659 Ca -0.07 0.09 -0.06 0.00 -1.23 0.00 0.00 61.79 60.51 1y8b h SER 659 Cb 1.49 0.34 -0.03 0.00 -0.44 0.00 0.00 62.40 63.76 1y8b h SER 659 CO 0.17 -0.51 0.22 0.17 -0.53 0.00 0.00 176.83 176.35 1y8b h LEU 660 N -0.75 1.06 -0.11 2.23 8.10 -1.53 -0.08 115.31 124.23 1y8b h LEU 660 Ca -0.02 -0.20 0.04 0.00 0.11 0.00 0.00 57.88 57.81 1y8b h LEU 660 Cb 0.68 -0.28 -0.05 0.00 -0.44 0.00 0.00 40.66 40.57 1y8b h LEU 660 CO -0.07 0.99 -0.20 -0.33 -4.11 0.00 0.00 178.44 174.72 1y8b h GLU 661 N 1.08 -0.25 -0.23 0.17 4.39 -1.07 1.11 114.58 119.78 1y8b h GLU 661 Ca 0.23 0.02 -0.09 0.00 0.34 0.00 0.00 59.36 59.86 1y8b h GLU 661 Cb 0.31 0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 29.02 1y8b h GLU 661 CO -0.01 -0.17 -0.21 -0.91 -1.16 0.00 0.00 179.01 176.55 1y8b h ASN 662 N -0.26 0.58 -0.60 1.42 4.21 -1.03 -3.18 115.58 116.71 1y8b h ASN 662 Ca 0.09 -0.47 -0.05 0.00 1.21 0.00 0.00 56.30 57.08 1y8b h ASN 662 Cb 0.40 -0.16 -0.03 0.00 -1.12 0.00 0.00 38.32 37.41 1y8b h ASN 662 CO -0.26 0.93 0.17 0.24 -1.29 0.00 0.00 177.43 177.22 1y8b h MET 663 N 0.24 0.95 -1.17 0.81 2.86 -0.66 -2.51 114.93 115.45 1y8b h MET 663 Ca 0.04 -0.22 0.37 0.00 -2.06 0.00 0.00 59.70 57.83 1y8b h MET 663 Cb 0.76 -0.13 -0.13 0.00 0.06 0.00 0.00 31.60 32.16 1y8b h MET 663 CO 0.05 0.86 0.73 0.00 1.06 0.00 0.00 176.91 179.62 1y8b h ALA 664 N 1.05 2.41 -0.02 6.32 0.00 0.13 0.93 119.26 130.09 1y8b h ALA 664 Ca 0.19 0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.21 1y8b h ALA 664 Cb 0.32 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1y8b h ALA 664 CO -0.00 -1.00 -0.05 0.87 0.00 0.00 0.00 179.25 179.07 1y8b h LYS 665 N 0.21 0.07 -0.22 0.00 1.79 -1.52 -1.79 116.57 115.10 1y8b h LYS 665 Ca 0.75 -0.05 -0.02 0.00 -2.18 0.00 0.00 60.65 59.16 1y8b h LYS 665 Cb 2.11 0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 32.75 1y8b h LYS 665 CO -0.45 0.65 0.07 0.28 -1.08 0.00 0.00 179.45 178.92 1y8b h VAL 666 N -0.51 1.19 0.00 0.50 2.07 -0.33 -1.81 116.25 117.37 1y8b h VAL 666 Ca -0.00 -0.61 -0.00 0.00 0.82 0.00 0.00 66.70 66.90 1y8b h VAL 666 Cb 0.65 1.19 -0.00 0.00 -1.52 0.00 0.00 31.29 31.61 1y8b h VAL 666 CO 0.01 0.20 -0.02 0.58 0.02 0.00 0.00 177.57 178.36 1y8b h VAL 667 N 0.18 0.28 0.00 2.57 2.07 0.61 -0.42 116.25 121.54 1y8b h VAL 667 Ca 0.07 -0.12 -0.14 0.00 0.82 0.00 0.00 66.70 67.33 1y8b h VAL 667 Cb 0.24 1.09 -0.02 0.00 -1.52 0.00 0.00 31.29 31.08 1y8b h VAL 667 CO -0.00 0.02 -0.65 -0.78 0.02 0.00 0.00 177.57 176.18 1y8b h ASP 668 N 0.00 0.00 -0.83 0.57 1.82 -0.47 -3.18 116.42 114.33 1y8b h ASP 668 Ca -0.00 0.00 0.16 0.00 -0.39 0.00 0.00 57.03 56.80 1y8b h ASP 668 Cb 0.09 0.00 -0.06 0.00 0.68 0.00 0.00 39.33 40.04 1y8b h ASP 668 CO 0.00 0.65 0.55 -0.61 -1.61 0.00 0.00 179.24 178.22 1y8b h GLN 669 N 0.00 0.47 0.00 0.28 5.75 -0.64 0.24 115.11 121.20 1y8b h GLN 669 Ca -0.01 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.47 1y8b h GLN 669 Cb 1.37 -0.10 0.00 0.00 1.07 0.00 0.00 27.48 29.82 1y8b h GLN 669 CO 0.08 0.31 0.28 1.04 -2.65 0.00 0.00 178.83 177.89 1y8b n GLN 670 N -4.51 0.03 0.00 1.69 1.13 -1.20 0.15 117.38 114.66 1y8b n GLN 670 Ca 0.17 0.37 0.00 0.00 -1.94 0.00 0.00 57.00 55.60 1y8b n GLN 670 Cb 0.57 -1.88 0.00 0.00 0.11 0.00 0.00 30.24 29.04 1y8b n GLN 670 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 1y8b n ASN 671 N -1.54 1.36 0.00 1.08 4.13 0.84 -4.64 115.26 116.48 1y8b n ASN 671 Ca -0.00 -1.49 0.00 0.00 1.68 0.00 0.00 54.58 54.77 1y8b n ASN 671 Cb 0.29 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.53 1y8b n ASN 671 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1y8b n ALA 672 N -0.24 0.00 0.99 5.41 0.00 0.38 -4.41 120.51 122.64 1y8b n ALA 672 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.45 1y8b n ALA 672 Cb 0.17 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.66 1y8b n ALA 672 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1y8b n GLY 673 N 3.85 1.26 3.84 0.00 0.00 -1.26 -4.85 105.19 108.03 1y8b n GLY 673 Ca 0.00 -0.08 -0.33 0.00 0.00 0.00 0.00 46.02 45.61 1y8b n GLY 673 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1y8b s ASP 674 N -0.21 6.82 1.00 1.61 1.01 -1.26 -5.02 116.67 120.62 1y8b s ASP 674 Ca 0.05 1.36 -0.25 0.00 0.71 0.00 0.00 52.55 54.41 1y8b s ASP 674 Cb 0.03 -2.40 -0.17 0.00 1.01 0.00 0.00 42.92 41.39 1y8b s ASP 674 CO 0.02 -0.21 -1.30 -2.65 0.21 0.00 0.00 175.17 171.23 1y8b n PRO 675 N -0.33 -0.07 -3.65 8.23 -0.02 -1.26 -3.73 135.00 134.17 1y8b n PRO 675 Ca 0.04 -0.02 -0.27 0.00 -2.02 0.00 0.00 63.50 61.23 1y8b n PRO 675 Cb 0.53 -1.04 0.02 0.00 -0.02 0.00 0.00 33.50 33.00 1y8b n PRO 675 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1y8b n ALA 676 N -3.30 -2.61 -2.01 3.55 0.00 -1.26 -4.82 120.51 110.06 1y8b n ALA 676 Ca -0.02 -0.25 -0.42 0.00 0.00 0.00 0.00 53.44 52.75 1y8b n ALA 676 Cb 0.70 -2.79 -0.03 0.00 0.00 0.00 0.00 19.45 17.34 1y8b n ALA 676 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 1y8b s TYR 677 N -3.29 2.79 -0.03 0.00 -0.85 -1.24 -4.99 117.35 109.73 1y8b s TYR 677 Ca 0.30 0.57 -0.16 0.00 -0.52 0.00 0.00 57.07 57.25 1y8b s TYR 677 Cb -0.12 -3.87 0.03 0.00 0.38 0.00 0.00 41.96 38.38 1y8b s TYR 677 CO 0.86 -3.33 0.35 1.03 -1.52 0.00 0.00 175.55 172.95 1y8b s ARG 678 N 1.95 0.68 0.10 -3.49 0.52 -1.26 -5.12 118.95 112.32 1y8b s ARG 678 Ca 0.70 -0.06 -0.36 0.00 -0.52 0.00 0.00 55.73 55.49 1y8b s ARG 678 Cb -0.39 0.31 -0.17 0.00 0.52 0.00 0.00 34.95 35.21 1y8b s ARG 678 CO 0.31 -0.18 1.12 -2.30 0.02 0.00 0.00 175.30 174.27 1y8b n PRO 679 N 1.43 0.68 -0.05 3.54 -0.02 -1.26 -4.91 135.00 134.42 1y8b n PRO 679 Ca -0.20 0.24 -0.08 0.00 -2.02 0.00 0.00 63.50 61.44 1y8b n PRO 679 Cb 0.56 -1.73 -0.08 0.00 -0.02 0.00 0.00 33.50 32.23 1y8b n PRO 679 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1y8b h MET 680 N 3.36 -0.02 0.00 -0.52 -0.00 -1.96 -3.44 114.93 112.34 1y8b h MET 680 Ca -0.45 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.25 1y8b h MET 680 Cb 1.38 0.01 0.00 0.00 -0.00 0.00 0.00 31.60 32.98 1y8b h MET 680 CO 0.69 0.54 -0.93 0.00 -0.00 0.00 0.00 176.91 177.21 1y8b n ALA 681 N -2.67 1.99 0.00 -3.00 0.00 -1.26 -4.97 120.51 110.60 1y8b n ALA 681 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 1y8b n ALA 681 Cb 0.28 0.42 0.00 0.00 0.00 0.00 0.00 19.45 20.14 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 3.25 1.98 2.66 0.00 0.00 -1.26 -4.48 105.19 107.35 1y8b n GLY 682 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 1y8b n GLY 682 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1y8b n ASN 683 N 0.30 -1.54 0.00 1.61 4.05 -1.26 -4.95 115.26 113.48 1y8b n ASN 683 Ca 0.00 -3.04 0.00 0.00 0.45 0.00 0.00 54.58 51.99 1y8b n ASN 683 Cb 0.00 1.10 0.00 0.00 1.23 0.00 0.00 39.78 42.11 1y8b n ASN 683 CO 0.00 0.00 0.00 2.22 -3.05 0.00 0.00 177.26 176.43 1y8b n PHE 684 N -0.08 0.00 -0.12 1.20 1.16 -1.26 0.15 117.46 118.50 1y8b n PHE 684 Ca 0.04 0.00 -0.25 0.00 -1.87 0.00 0.00 57.45 55.37 1y8b n PHE 684 Cb 0.77 -0.11 -0.09 0.00 -1.61 0.00 0.00 39.48 38.43 1y8b n PHE 684 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1y8b n ALA 685 N -0.99 1.05 -0.63 1.98 0.00 -1.26 -4.54 120.51 116.11 1y8b n ALA 685 Ca 0.00 -0.92 0.08 0.00 0.00 0.00 0.00 53.44 52.60 1y8b n ALA 685 Cb 0.07 -0.03 0.24 0.00 0.00 0.00 0.00 19.45 19.73 1y8b n ALA 685 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1y8b n ASN 686 N -4.32 3.71 -4.56 0.00 2.85 -0.46 -4.92 115.26 107.57 1y8b n ASN 686 Ca -0.44 -2.55 -0.31 0.00 -0.11 0.00 0.00 54.58 51.16 1y8b n ASN 686 Cb 0.78 -0.44 -0.04 0.00 1.24 0.00 0.00 39.78 41.33 1y8b n ASN 686 CO 0.00 0.00 0.00 -0.44 -2.11 0.00 0.00 177.26 174.71 1y8b s SER 687 N -1.40 5.09 0.00 1.20 0.01 0.40 -4.75 113.70 114.25 1y8b s SER 687 Ca 0.37 -0.12 0.02 0.00 1.31 0.00 0.00 55.95 57.53 1y8b s SER 687 Cb 0.26 -2.54 0.11 0.00 0.21 0.00 0.00 66.02 64.05 1y8b s SER 687 CO 0.14 -2.66 0.75 0.00 0.41 0.00 0.00 173.24 171.88 1y8b h ALA 689 N 2.11 -0.66 -0.73 0.00 0.00 -1.96 -2.90 119.26 115.12 1y8b h ALA 689 Ca 0.00 -0.14 0.10 0.00 0.00 0.00 0.00 54.91 54.87 1y8b h ALA 689 Cb 0.01 0.24 -0.07 0.00 0.00 0.00 0.00 17.79 17.97 1y8b h ALA 689 CO 0.00 -0.61 0.37 0.74 0.00 0.00 0.00 179.25 179.75 1y8b h PHE 690 N -1.12 0.66 -0.88 0.00 -1.00 -1.90 0.20 116.94 112.91 1y8b h PHE 690 Ca -0.06 0.03 0.24 0.00 2.81 0.00 0.00 57.97 60.98 1y8b h PHE 690 Cb 0.48 -0.19 -0.05 0.00 3.61 0.00 0.00 35.95 39.81 1y8b h PHE 690 CO 0.01 0.23 0.61 -0.22 -1.61 0.00 0.00 178.31 177.33 1y8b h LYS 691 N 0.62 0.13 0.00 1.51 3.64 -1.62 0.79 116.57 121.63 1y8b h LYS 691 Ca 0.36 -0.01 -0.10 0.00 -1.27 0.00 0.00 60.65 59.63 1y8b h LYS 691 Cb 0.39 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 1y8b h LYS 691 CO -0.27 0.09 -0.49 0.00 -2.27 0.00 0.00 179.45 176.50 1y8b h ALA 692 N 1.59 0.95 -0.03 5.00 0.00 -0.38 -2.38 119.26 124.01 1y8b h ALA 692 Ca 0.43 -0.44 -0.25 0.00 0.00 0.00 0.00 54.91 54.65 1y8b h ALA 692 Cb 1.50 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 19.23 1y8b h ALA 692 CO -0.07 0.61 -0.96 0.00 0.00 0.00 0.00 179.25 178.83 1y8b h ALA 693 N 1.51 0.15 0.00 0.00 0.00 0.75 -3.17 119.26 118.51 1y8b h ALA 693 Ca -0.00 -0.67 -0.09 0.00 0.00 0.00 0.00 54.91 54.14 1y8b h ALA 693 Cb 1.02 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 1y8b h ALA 693 CO 0.06 0.65 -0.45 0.66 0.00 0.00 0.00 179.25 180.18 1y8b h SER 694 N 0.38 0.00 -0.27 0.00 4.64 -1.29 -3.06 113.55 113.96 1y8b h SER 694 Ca -0.11 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.21 1y8b h SER 694 Cb 1.61 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.69 1y8b h SER 694 CO 0.19 0.45 0.16 0.44 -0.87 0.00 0.00 176.83 177.20 1y8b h ASP 695 N 0.00 0.32 -0.70 4.97 3.32 -1.40 -1.03 116.42 121.90 1y8b h ASP 695 Ca -0.00 -0.04 0.20 0.00 0.02 0.00 0.00 57.03 57.20 1y8b h ASP 695 Cb 0.82 -0.08 -0.03 0.00 0.22 0.00 0.00 39.33 40.26 1y8b h ASP 695 CO 0.06 0.27 0.51 -0.07 -1.72 0.00 0.00 179.24 178.28 1y8b h LEU 696 N 0.34 0.00 0.13 1.55 3.38 -1.53 0.80 115.31 119.98 1y8b h LEU 696 Ca 0.10 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.89 1y8b h LEU 696 Cb 0.01 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.78 1y8b h LEU 696 CO -0.02 0.00 -0.77 0.40 0.09 0.00 0.00 178.44 178.15 1y8b h ILE 697 N 0.00 1.53 0.13 1.22 5.03 -1.32 -3.18 117.51 120.92 1y8b h ILE 697 Ca 0.33 -2.51 -0.01 0.00 -0.12 0.00 0.00 64.86 62.56 1y8b h ILE 697 Cb 1.34 3.19 0.00 0.00 -3.03 0.00 0.00 36.82 38.33 1y8b h ILE 697 CO -0.00 0.71 -0.06 0.15 -0.68 0.00 0.00 178.15 178.26 1y8b h PHE 698 N -0.39 -0.17 0.00 1.37 3.04 0.09 -2.74 116.94 118.14 1y8b h PHE 698 Ca -0.13 -0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.81 1y8b h PHE 698 Cb 1.60 0.06 0.00 0.00 2.56 0.00 0.00 35.95 40.16 1y8b h PHE 698 CO 0.20 0.28 0.11 1.28 -2.02 0.00 0.00 178.31 178.17 1y8b n LEU 699 N -4.93 0.00 0.26 0.59 4.32 0.26 -2.66 117.00 114.84 1y8b n LEU 699 Ca -0.08 0.32 0.07 0.00 -0.02 0.00 0.00 56.01 56.29 1y8b n LEU 699 Cb 0.27 -0.32 0.23 0.00 -1.62 0.00 0.00 43.42 41.98 1y8b n LEU 699 CO 0.29 -0.32 1.06 1.23 -1.22 0.00 0.00 177.39 178.44 1y8b h GLY 700 N 0.00 0.00 0.72 -0.72 0.00 -1.46 3.31 103.07 104.92 1y8b h GLY 700 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.00 1y8b h GLY 700 CO 0.00 0.00 -1.91 3.33 0.00 0.00 0.00 176.54 177.96 1y8b n VAL 701 N -2.70 1.66 -1.35 4.60 0.24 -1.09 -4.37 118.33 115.32 1y8b n VAL 701 Ca 0.03 -0.73 0.08 0.00 -2.04 0.00 0.00 64.34 61.67 1y8b n VAL 701 Cb 0.93 -1.30 0.12 0.00 -1.47 0.00 0.00 33.84 32.13 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 -3.21 1.08 -2.12 7.34 2.85 0.39 -5.05 118.16 119.44 1y8b n LYS 702 Ca -0.25 -2.42 -0.42 0.00 -1.05 0.00 0.00 58.31 54.16 1y8b n LYS 702 Cb 1.05 -1.30 -0.03 0.00 -0.65 0.00 0.00 35.03 34.10 1y8b n LYS 702 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 177.40 176.21 1y8b s GLN 703 N -2.37 4.31 -0.08 -1.58 0.74 1.01 -4.95 119.66 116.73 1y8b s GLN 703 Ca 0.28 2.15 -0.30 0.00 0.05 0.00 0.00 55.36 57.54 1y8b s GLN 703 Cb 0.25 -3.20 -0.03 0.00 1.10 0.00 0.00 33.01 31.13 1y8b s GLN 703 CO 0.00 -0.43 1.31 -1.25 -0.55 0.00 0.00 175.29 174.37 1y8b s PRO 704 N 0.71 4.28 0.00 1.67 0.04 -1.26 -4.87 135.00 135.56 1y8b s PRO 704 Ca 0.63 1.78 0.06 0.00 0.04 0.00 0.00 61.00 63.52 1y8b s PRO 704 Cb -0.39 -3.67 0.32 0.00 0.04 0.00 0.00 34.50 30.80 1y8b s PRO 704 CO 0.33 -0.60 0.99 0.09 0.04 0.00 0.00 177.00 177.86 1y8b n ASN 705 N 5.89 0.00 0.02 6.66 3.02 -1.26 -3.98 115.26 125.61 1y8b n ASN 705 Ca 0.13 0.11 0.00 0.00 -0.03 0.00 0.00 54.58 54.79 1y8b n ASN 705 Cb 0.45 -0.22 0.00 0.00 -0.61 0.00 0.00 39.78 39.40 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 -0.74 -0.22 2.09 7.41 0.00 -1.26 -4.34 105.19 108.13 1y8b n GLY 706 Ca 0.03 0.03 -0.02 0.00 0.00 0.00 0.00 46.02 46.05 1y8b n GLY 706 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1y8b n TYR 707 N -2.64 0.00 0.40 1.61 9.36 -1.26 -3.54 117.16 121.10 1y8b n TYR 707 Ca 0.00 -0.46 0.10 0.00 3.32 0.00 0.00 57.90 60.85 1y8b n TYR 707 Cb 0.00 -0.61 -0.13 0.00 -0.63 0.00 0.00 39.34 37.97 1y8b n TYR 707 CO 0.00 0.00 0.00 2.41 0.22 0.00 0.00 176.86 179.49 1y8b n THR 708 N 2.36 0.00 -0.07 2.97 -1.04 -1.26 -4.43 114.28 112.82 1y8b n THR 708 Ca 0.09 -0.27 -0.13 0.00 -2.04 0.00 0.00 64.05 61.69 1y8b n THR 708 Cb 0.26 0.48 -0.06 0.00 -1.82 0.00 0.00 70.33 69.19 1y8b n THR 708 CO 0.00 0.00 0.00 -0.08 -0.64 0.00 0.00 175.07 174.35 1y8b h GLU 709 N 0.00 0.46 -0.82 -2.82 4.81 -1.93 -3.21 114.58 111.07 1y8b h GLU 709 Ca 0.00 -0.24 0.09 0.00 -0.13 0.00 0.00 59.36 59.08 1y8b h GLU 709 Cb 0.70 0.01 -0.06 0.00 0.63 0.00 0.00 28.75 30.03 1y8b h GLU 709 CO 0.00 0.81 0.53 -1.35 -0.73 0.00 0.00 179.01 178.27 1y8b h PRO 710 N 0.12 0.76 -0.19 0.92 0.11 -1.89 -3.03 132.00 128.81 1y8b h PRO 710 Ca 0.03 -0.05 0.02 0.00 0.11 0.00 0.00 66.00 66.12 1y8b h PRO 710 Cb 0.73 -0.17 -0.04 0.00 0.11 0.00 0.00 31.00 31.62 1y8b h PRO 710 CO 0.05 0.50 -0.32 -0.07 -0.21 0.00 0.00 178.00 177.95 1y8b h LEU 711 N 0.78 -1.04 -0.24 2.35 3.38 -1.78 1.03 115.31 119.79 1y8b h LEU 711 Ca 0.37 0.13 0.04 0.00 0.09 0.00 0.00 57.88 58.52 1y8b h LEU 711 Cb 0.41 0.42 -0.04 0.00 0.09 0.00 0.00 40.66 41.54 1y8b h LEU 711 CO -0.15 -0.24 -0.02 -0.07 0.09 0.00 0.00 178.44 178.06 1y8b h LEU 712 N -0.26 -0.13 -2.63 1.67 3.38 -1.71 0.13 115.31 115.77 1y8b h LEU 712 Ca 0.03 0.06 0.01 0.00 0.09 0.00 0.00 57.88 58.07 1y8b h LEU 712 Cb 0.35 0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.21 1y8b h LEU 712 CO -0.31 -0.03 0.07 0.45 0.09 0.00 0.00 178.44 178.71 1y8b h HIS 713 N 0.06 0.00 -1.13 1.13 3.86 -1.20 -2.08 115.15 115.79 1y8b h HIS 713 Ca 0.12 0.00 0.32 0.00 -1.16 0.00 0.00 60.37 59.65 1y8b h HIS 713 Cb 0.16 0.00 -0.11 0.00 1.06 0.00 0.00 27.41 28.52 1y8b h HIS 713 CO -0.21 0.00 0.72 0.00 0.86 0.00 0.00 177.93 179.30 1y8b h ALA 714 N 1.88 2.39 0.00 2.45 0.00 0.39 0.74 119.26 127.12 1y8b h ALA 714 Ca 0.01 0.08 -0.24 0.00 0.00 0.00 0.00 54.91 54.77 1y8b h ALA 714 Cb 0.16 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 1y8b h ALA 714 CO -0.00 -0.87 -1.28 -1.49 0.00 0.00 0.00 179.25 175.60 1y8b h TRP 715 N 0.29 0.00 -0.08 0.00 4.06 -1.51 -3.29 115.95 115.42 1y8b h TRP 715 Ca 0.67 0.00 -0.05 0.00 2.06 0.00 0.00 58.89 61.57 1y8b h TRP 715 Cb 1.86 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 30.01 1y8b h TRP 715 CO -0.00 0.95 -0.18 -0.09 -3.56 0.00 0.00 178.44 175.56 1y8b h ARG 716 N 0.00 0.12 -0.30 0.49 2.43 0.35 0.39 114.38 117.86 1y8b h ARG 716 Ca -0.13 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.00 1y8b h ARG 716 Cb 1.84 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 31.36 1y8b h ARG 716 CO 0.10 0.30 0.13 -0.07 -1.51 0.00 0.00 179.97 178.92 1y8b h LEU 717 N 0.12 0.40 0.00 3.80 3.38 -1.18 -2.80 115.31 119.03 1y8b h LEU 717 Ca 0.02 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 57.81 1y8b h LEU 717 Cb 0.39 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 1y8b h LEU 717 CO 0.03 0.44 -0.50 -0.09 0.09 0.00 0.00 178.44 178.41 1y8b h ARG 718 N 0.34 0.00 -0.72 1.13 2.43 -1.61 -3.32 114.38 112.63 1y8b h ARG 718 Ca 0.10 0.00 0.07 0.00 -0.81 0.00 0.00 59.98 59.35 1y8b h ARG 718 Cb 0.16 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 29.64 1y8b h ARG 718 CO -0.01 0.11 0.39 1.49 -1.51 0.00 0.00 179.97 180.44 1y8b h GLU 719 N 0.00 0.68 -0.04 0.20 4.81 0.05 -2.15 114.58 118.13 1y8b h GLU 719 Ca -0.02 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.17 1y8b h GLU 719 Cb 1.12 -0.15 -0.00 0.00 0.63 0.00 0.00 28.75 30.34 1y8b h GLU 719 CO 0.01 0.45 0.01 0.87 -0.73 0.00 0.00 179.01 179.63 1y8b h LYS 720 N 0.70 0.06 0.00 1.92 1.79 -1.63 -1.56 116.57 117.85 1y8b h LYS 720 Ca 0.34 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.80 1y8b h LYS 720 Cb 0.27 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 30.91 1y8b h LYS 720 CO -0.22 0.21 0.44 0.39 -1.08 0.00 0.00 179.45 179.20 1y8b n GLU 721 N -4.97 0.04 0.02 3.15 1.02 -0.82 -0.44 120.64 118.64 1y8b n GLU 721 Ca -0.07 0.43 -0.13 0.00 -0.02 0.00 0.00 57.16 57.37 1y8b n GLU 721 Cb 0.11 -2.08 -0.09 0.00 -0.02 0.00 0.00 31.44 29.36 1y8b n GLU 721 CO 0.00 0.00 0.00 0.77 1.18 0.00 0.00 177.13 179.08 1y8b h SER 722 N 0.00 -0.08 0.00 1.62 0.02 -1.15 -3.52 113.55 110.44 1y8b h SER 722 Ca 0.00 -0.44 0.00 0.00 -0.84 0.00 0.00 61.79 60.51 1y8b h SER 722 Cb 0.89 0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.45 1y8b h SER 722 CO 0.00 0.42 0.00 1.57 -1.14 0.00 0.00 176.83 177.68