#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 1.95 -1.00 3.04 0.00 -1.26 -5.06 120.51 118.19 1y8b n ALA 2 Ca 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.18 1y8b n ALA 2 Cb 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 19.45 19.30 1y8b n ALA 2 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1y8b n GLN 3 N 0.00 0.00 -2.88 0.00 6.02 -1.26 -5.12 117.38 114.15 1y8b n GLN 3 Ca -0.10 0.00 -0.32 0.00 -0.01 0.00 0.00 57.00 56.56 1y8b n GLN 3 Cb 0.48 0.00 -0.06 0.00 1.02 0.00 0.00 30.24 31.68 1y8b n GLN 3 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1y8b s THR 4 N 0.00 4.53 0.10 5.09 -4.23 -1.26 -4.49 115.64 115.38 1y8b s THR 4 Ca 0.00 1.21 0.04 0.00 -1.18 0.00 0.00 61.69 61.76 1y8b s THR 4 Cb 0.00 -3.63 -0.04 0.00 1.34 0.00 0.00 72.50 70.17 1y8b s THR 4 CO 0.00 -0.34 0.07 -0.51 -0.54 0.00 0.00 174.62 173.30 1y8b s ILE 5 N -2.18 4.39 -0.10 2.99 2.07 -1.18 -4.15 121.20 123.03 1y8b s ILE 5 Ca 0.58 -0.89 -0.16 0.00 -1.41 0.00 0.00 60.65 58.77 1y8b s ILE 5 Cb -0.10 -3.13 -0.05 0.00 0.13 0.00 0.00 42.46 39.31 1y8b s ILE 5 CO 0.18 0.08 0.41 0.42 -1.91 0.00 0.00 174.94 174.12 1y8b s THR 6 N -1.44 5.18 -0.13 4.00 -4.23 -1.26 -3.44 115.64 114.32 1y8b s THR 6 Ca 0.29 0.81 -0.12 0.00 -1.18 0.00 0.00 61.69 61.49 1y8b s THR 6 Cb -0.12 -3.74 0.03 0.00 1.34 0.00 0.00 72.50 70.02 1y8b s THR 6 CO 0.21 0.41 0.34 -1.10 -0.54 0.00 0.00 174.62 173.95 1y8b s GLN 7 N 0.11 0.41 1.44 3.99 -1.52 -0.90 -5.01 119.66 118.17 1y8b s GLN 7 Ca 0.23 0.46 0.00 0.00 -1.95 0.00 0.00 55.36 54.09 1y8b s GLN 7 Cb -0.15 0.20 0.00 0.00 -0.22 0.00 0.00 33.01 32.84 1y8b s GLN 7 CO 0.09 -0.05 0.00 0.43 -0.25 0.00 0.00 175.29 175.51 1y8b n SER 8 N 2.85 0.00 -0.71 5.90 7.64 -1.26 -1.20 113.62 126.84 1y8b n SER 8 Ca -0.13 0.00 0.07 0.00 1.01 0.00 0.00 58.87 59.82 1y8b n SER 8 Cb 0.58 0.00 0.15 0.00 -1.01 0.00 0.00 64.21 63.92 1y8b n SER 8 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 1y8b n ARG 9 N 14.00 2.29 -3.64 1.43 -4.01 -1.26 -5.00 116.66 120.47 1y8b n ARG 9 Ca 0.00 -1.92 -0.17 0.00 -1.04 0.00 0.00 57.85 54.72 1y8b n ARG 9 Cb 0.00 -1.31 -0.05 0.00 -3.04 0.00 0.00 32.46 28.06 1y8b n ARG 9 CO 0.00 0.00 0.00 1.47 -3.04 0.00 0.00 177.63 176.06 1y8b n LEU 10 N 0.74 0.00 -4.10 2.89 -0.00 -0.34 -4.33 117.00 111.87 1y8b n LEU 10 Ca 0.12 -2.17 -0.18 0.00 -0.00 0.00 0.00 56.01 53.78 1y8b n LEU 10 Cb 0.43 0.80 -0.13 0.00 -0.00 0.00 0.00 43.42 44.52 1y8b n LEU 10 CO 0.09 -0.34 -0.44 -0.13 -0.00 0.00 0.00 177.39 176.57 1y8b s ARG 11 N -3.05 0.80 0.22 1.47 0.52 -1.11 -2.12 118.95 115.68 1y8b s ARG 11 Ca 0.17 -0.64 0.05 0.00 -0.52 0.00 0.00 55.73 54.79 1y8b s ARG 11 Cb 0.01 -0.76 -0.05 0.00 0.52 0.00 0.00 34.95 34.67 1y8b s ARG 11 CO 0.12 0.19 -0.07 0.42 0.02 0.00 0.00 175.30 175.97 1y8b s ILE 12 N -0.78 1.37 0.04 1.52 1.09 -1.22 -3.52 121.20 119.70 1y8b s ILE 12 Ca -0.00 -2.10 -0.28 0.00 -1.10 0.00 0.00 60.65 57.16 1y8b s ILE 12 Cb -0.07 -2.18 -0.04 0.00 -1.06 0.00 0.00 42.46 39.11 1y8b s ILE 12 CO 0.01 -0.49 0.89 -1.81 -0.10 0.00 0.00 174.94 173.45 1y8b s ASP 13 N -3.31 7.33 0.04 3.58 1.01 -1.26 -3.12 116.67 120.94 1y8b s ASP 13 Ca 0.24 1.60 -0.31 0.00 0.71 0.00 0.00 52.55 54.80 1y8b s ASP 13 Cb 0.03 -2.53 -0.17 0.00 1.01 0.00 0.00 42.92 41.25 1y8b s ASP 13 CO 0.07 -0.12 1.34 0.00 0.21 0.00 0.00 175.17 176.67 1y8b h ALA 14 N 6.18 -0.98 -1.12 5.23 0.00 -1.96 -1.15 119.26 125.46 1y8b h ALA 14 Ca -0.42 -0.23 0.33 0.00 0.00 0.00 0.00 54.91 54.59 1y8b h ALA 14 Cb 1.21 0.38 -0.04 0.00 0.00 0.00 0.00 17.79 19.34 1y8b h ALA 14 CO 0.73 -0.97 0.83 -0.97 0.00 0.00 0.00 179.25 178.88 1y8b h ASN 15 N -1.15 0.00 0.02 0.00 -0.73 -1.92 0.20 115.58 112.00 1y8b h ASN 15 Ca -0.10 0.00 -0.10 0.00 1.87 0.00 0.00 56.30 57.97 1y8b h ASN 15 Cb 0.78 0.00 0.01 0.00 0.27 0.00 0.00 38.32 39.38 1y8b h ASN 15 CO 0.17 0.00 -0.39 0.15 -0.37 0.00 0.00 177.43 176.98 1y8b h PHE 16 N 0.00 0.35 0.07 0.67 3.04 -1.74 -2.98 116.94 116.36 1y8b h PHE 16 Ca 0.53 -0.21 -0.00 0.00 3.98 0.00 0.00 57.97 62.27 1y8b h PHE 16 Cb 2.20 -0.03 0.00 0.00 2.56 0.00 0.00 35.95 40.67 1y8b h PHE 16 CO 0.00 1.05 -0.03 -0.22 -2.02 0.00 0.00 178.31 177.09 1y8b h LYS 17 N -0.46 -0.09 0.37 1.11 3.64 0.58 -2.08 116.57 119.64 1y8b h LYS 17 Ca -0.06 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.32 1y8b h LYS 17 Cb 1.18 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 33.00 1y8b h LYS 17 CO 0.08 -0.04 -0.40 0.00 -2.27 0.00 0.00 179.45 176.81 1y8b h ARG 18 N -0.12 -0.75 -0.33 1.90 3.08 -1.21 2.31 114.38 119.26 1y8b h ARG 18 Ca -0.01 0.05 0.04 0.00 0.07 0.00 0.00 59.98 60.13 1y8b h ARG 18 Cb 0.10 0.17 -0.07 0.00 0.08 0.00 0.00 29.97 30.24 1y8b h ARG 18 CO 0.02 -0.50 -0.52 0.35 -1.07 0.00 0.00 179.97 178.25 1y8b h PHE 19 N -0.78 -1.58 -0.62 3.04 3.04 -1.52 2.57 116.94 121.09 1y8b h PHE 19 Ca -0.05 0.07 -0.08 0.00 3.98 0.00 0.00 57.97 61.89 1y8b h PHE 19 Cb 0.68 0.73 -0.02 0.00 2.56 0.00 0.00 35.95 39.90 1y8b h PHE 19 CO -0.24 -0.47 0.06 0.28 -2.02 0.00 0.00 178.31 175.92 1y8b h VAL 20 N -0.41 1.26 -0.18 1.41 2.07 -1.24 1.32 116.25 120.47 1y8b h VAL 20 Ca 0.06 -1.06 -0.14 0.00 0.82 0.00 0.00 66.70 66.37 1y8b h VAL 20 Cb 0.57 0.72 0.00 0.00 -1.52 0.00 0.00 31.29 31.06 1y8b h VAL 20 CO -0.53 0.39 -0.44 -0.78 0.02 0.00 0.00 177.57 176.23 1y8b h ASP 21 N 0.97 0.70 0.66 0.57 1.82 0.51 0.93 116.42 122.58 1y8b h ASP 21 Ca 0.19 -0.57 0.00 0.00 -0.39 0.00 0.00 57.03 56.26 1y8b h ASP 21 Cb 0.47 -0.20 0.00 0.00 0.68 0.00 0.00 39.33 40.28 1y8b h ASP 21 CO 0.02 1.15 -1.03 -0.62 -1.61 0.00 0.00 179.24 177.15 1y8b n GLU 22 N -4.22 0.42 -0.06 0.28 1.02 0.85 -4.04 120.64 114.90 1y8b n GLU 22 Ca -0.06 0.04 -0.13 0.00 -0.02 0.00 0.00 57.16 56.99 1y8b n GLU 22 Cb 0.56 -1.68 -0.04 0.00 -0.02 0.00 0.00 31.44 30.26 1y8b n GLU 22 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1y8b n GLU 23 N -2.25 0.28 -0.07 3.49 4.07 0.45 -4.74 120.64 121.87 1y8b n GLU 23 Ca 0.01 0.12 -0.09 0.00 -0.06 0.00 0.00 57.16 57.14 1y8b n GLU 23 Cb 0.49 -0.97 -0.06 0.00 -0.06 0.00 0.00 31.44 30.84 1y8b n GLU 23 CO 0.00 0.00 0.00 0.28 -0.06 0.00 0.00 177.13 177.35 1y8b h VAL 24 N -0.47 0.60 -0.94 6.31 2.07 -0.99 -3.31 116.25 119.51 1y8b h VAL 24 Ca -0.29 -1.55 0.17 0.00 0.82 0.00 0.00 66.70 65.85 1y8b h VAL 24 Cb 1.18 1.23 -0.10 0.00 -1.52 0.00 0.00 31.29 32.07 1y8b h VAL 24 CO -0.17 0.20 0.54 -0.07 0.02 0.00 0.00 177.57 178.08 1y8b h LEU 25 N -1.00 0.68 0.38 2.57 3.38 0.67 -0.19 115.31 121.81 1y8b h LEU 25 Ca -0.07 0.09 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1y8b h LEU 25 Cb 0.62 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.35 1y8b h LEU 25 CO -0.04 0.27 -0.18 -0.65 0.09 0.00 0.00 178.44 177.92 1y8b h PRO 26 N 0.72 -0.49 0.00 1.13 0.11 -1.76 -2.22 132.00 129.49 1y8b h PRO 26 Ca 0.53 0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.67 1y8b h PRO 26 Cb 0.77 0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.99 1y8b h PRO 26 CO -0.37 -0.18 0.00 0.78 -0.21 0.00 0.00 178.00 178.02 1y8b h GLY 27 N -0.92 0.00 1.59 -0.55 0.00 -1.61 -2.55 103.07 99.03 1y8b h GLY 27 Ca -0.05 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 47.11 1y8b h GLY 27 CO 0.09 0.00 -1.02 -0.91 0.00 0.00 0.00 176.54 174.70 1y8b h THR 28 N 0.00 0.95 0.00 4.70 1.35 -0.99 -3.48 112.91 115.45 1y8b h THR 28 Ca 0.00 -2.49 0.00 0.00 -0.55 0.00 0.00 66.41 63.37 1y8b h THR 28 Cb 0.37 2.41 0.00 0.00 -1.73 0.00 0.00 68.15 69.20 1y8b h THR 28 CO 0.00 0.54 0.00 0.61 -0.25 0.00 0.00 175.52 176.42 1y8b n GLY 29 N 1.34 3.39 3.19 5.82 0.00 -0.84 -5.05 105.19 113.04 1y8b n GLY 29 Ca -0.04 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.72 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 -1.12 -4.49 0.99 4.77 -1.18 -4.99 117.00 110.97 1y8b n LEU 30 Ca 0.00 -0.53 -0.32 0.00 -0.03 0.00 0.00 56.01 55.13 1y8b n LEU 30 Cb 0.00 -0.95 -0.12 0.00 -2.33 0.00 0.00 43.42 40.01 1y8b n LEU 30 CO 0.00 -3.82 -0.45 -0.62 -1.33 0.00 0.00 177.39 171.17 1y8b s ASP 31 N -2.47 4.08 -0.09 -1.43 2.15 -1.26 -4.74 116.67 112.90 1y8b s ASP 31 Ca 0.56 -0.25 -0.25 0.00 0.43 0.00 0.00 52.55 53.04 1y8b s ASP 31 Cb -0.12 -0.83 -0.21 0.00 -0.30 0.00 0.00 42.92 41.46 1y8b s ASP 31 CO 0.51 0.31 0.87 0.00 -0.17 0.00 0.00 175.17 176.69 1y8b h ALA 32 N 4.96 -0.03 -0.69 3.66 0.00 -1.94 -1.63 119.26 123.57 1y8b h ALA 32 Ca -0.47 -0.36 0.16 0.00 0.00 0.00 0.00 54.91 54.24 1y8b h ALA 32 Cb 1.16 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.92 1y8b h ALA 32 CO 0.50 -0.11 0.48 0.00 0.00 0.00 0.00 179.25 180.11 1y8b h ALA 33 N 0.03 2.29 0.00 0.00 0.00 -2.00 -0.06 119.26 119.51 1y8b h ALA 33 Ca -0.00 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.69 1y8b h ALA 33 Cb 0.73 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 1y8b h ALA 33 CO 0.01 -0.48 -1.23 0.00 0.00 0.00 0.00 179.25 177.54 1y8b h ALA 34 N 1.67 0.60 0.33 0.00 0.00 -1.99 -3.11 119.26 116.76 1y8b h ALA 34 Ca 0.34 -1.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.23 1y8b h ALA 34 Cb 0.97 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1y8b h ALA 34 CO -0.08 1.19 -0.16 0.35 0.00 0.00 0.00 179.25 180.56 1y8b h PHE 35 N 0.00 -0.41 0.00 0.00 3.04 0.01 -1.11 116.94 118.46 1y8b h PHE 35 Ca -0.13 -0.01 -0.01 0.00 3.98 0.00 0.00 57.97 61.80 1y8b h PHE 35 Cb 1.75 0.14 -0.00 0.00 2.56 0.00 0.00 35.95 40.39 1y8b h PHE 35 CO 0.00 -0.19 -0.07 0.11 -2.02 0.00 0.00 178.31 176.15 1y8b h TRP 36 N -0.56 0.00 0.12 0.41 5.08 -1.64 -1.67 115.95 117.70 1y8b h TRP 36 Ca -0.05 0.00 -0.30 0.00 1.08 0.00 0.00 58.89 59.63 1y8b h TRP 36 Cb 0.41 0.00 0.03 0.00 -3.00 0.00 0.00 29.16 26.60 1y8b h TRP 36 CO -0.02 0.07 -1.25 0.00 -1.28 0.00 0.00 178.44 175.95 1y8b h ARG 37 N 0.00 0.61 0.00 0.12 3.08 -1.45 -2.99 114.38 113.75 1y8b h ARG 37 Ca -0.00 -0.82 -0.15 0.00 0.07 0.00 0.00 59.98 59.07 1y8b h ARG 37 Cb 0.88 0.27 -0.02 0.00 0.08 0.00 0.00 29.97 31.18 1y8b h ARG 37 CO 0.01 1.37 -1.07 -0.97 -1.07 0.00 0.00 179.97 178.24 1y8b h ASN 38 N 0.27 0.00 -0.17 7.04 -1.24 -1.24 -3.36 115.58 116.89 1y8b h ASN 38 Ca -0.19 0.00 -0.10 0.00 0.71 0.00 0.00 56.30 56.73 1y8b h ASN 38 Cb 1.92 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 40.97 1y8b h ASN 38 CO 0.24 0.59 -0.27 -0.26 -1.29 0.00 0.00 177.43 176.45 1y8b h PHE 39 N 0.00 0.60 -0.61 0.67 -1.00 -1.39 -3.11 116.94 112.09 1y8b h PHE 39 Ca -0.10 -0.20 0.12 0.00 2.81 0.00 0.00 57.97 60.59 1y8b h PHE 39 Cb 1.54 -0.12 -0.09 0.00 3.61 0.00 0.00 35.95 40.90 1y8b h PHE 39 CO 0.00 0.90 0.14 0.22 -1.61 0.00 0.00 178.31 177.96 1y8b h ASP 40 N 0.12 0.02 0.50 2.17 3.58 -1.66 0.90 116.42 122.06 1y8b h ASP 40 Ca 0.02 0.11 -0.02 0.00 0.42 0.00 0.00 57.03 57.55 1y8b h ASP 40 Cb 0.84 0.15 0.00 0.00 1.72 0.00 0.00 39.33 42.05 1y8b h ASP 40 CO 0.06 0.02 -0.24 -0.33 -2.88 0.00 0.00 179.24 175.87 1y8b h GLU 41 N 0.27 -0.64 -0.39 0.28 3.07 -1.70 -0.28 114.58 115.18 1y8b h GLU 41 Ca 0.32 0.04 -0.02 0.00 -0.50 0.00 0.00 59.36 59.21 1y8b h GLU 41 Cb 0.48 0.15 -0.02 0.00 -0.84 0.00 0.00 28.75 28.52 1y8b h GLU 41 CO -0.40 -0.43 0.18 -0.84 -1.40 0.00 0.00 179.01 176.11 1y8b h ILE 42 N -0.70 1.14 0.18 3.13 3.07 -1.46 0.77 117.51 123.65 1y8b h ILE 42 Ca -0.07 -0.42 -0.01 0.00 1.55 0.00 0.00 64.86 65.91 1y8b h ILE 42 Cb 0.51 0.66 0.00 0.00 -0.27 0.00 0.00 36.82 37.72 1y8b h ILE 42 CO 0.11 0.17 -0.09 0.58 -1.05 0.00 0.00 178.15 177.87 1y8b h VAL 43 N 0.55 0.90 0.00 0.16 2.07 0.92 0.43 116.25 121.28 1y8b h VAL 43 Ca 0.14 -0.41 -0.04 0.00 0.82 0.00 0.00 66.70 67.21 1y8b h VAL 43 Cb 0.08 1.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 1y8b h VAL 43 CO -0.02 0.09 -0.33 -0.74 0.02 0.00 0.00 177.57 176.59 1y8b h HIS 44 N -0.44 0.00 0.18 1.57 -0.00 -0.83 -0.76 115.15 114.86 1y8b h HIS 44 Ca -0.03 0.00 -0.34 0.00 -0.00 0.00 0.00 60.37 60.01 1y8b h HIS 44 Cb 0.34 0.00 0.01 0.00 -0.00 0.00 0.00 27.41 27.76 1y8b h HIS 44 CO -0.01 0.16 -1.66 -0.44 -0.00 0.00 0.00 177.93 175.98 1y8b h ASP 45 N 0.00 0.59 0.82 3.26 5.19 0.63 -3.36 116.42 123.54 1y8b h ASP 45 Ca -0.01 -0.82 -0.19 0.00 -0.62 0.00 0.00 57.03 55.39 1y8b h ASP 45 Cb 1.13 -0.19 -0.03 0.00 0.18 0.00 0.00 39.33 40.42 1y8b h ASP 45 CO 0.02 1.69 -1.28 0.25 -3.12 0.00 0.00 179.24 176.79 1y8b h LEU 46 N 0.10 0.00 0.07 1.55 5.85 -0.23 -3.38 115.31 119.28 1y8b h LEU 46 Ca -0.31 0.00 0.02 0.00 0.84 0.00 0.00 57.88 58.43 1y8b h LEU 46 Cb 2.09 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 43.07 1y8b h LEU 46 CO 0.19 0.69 -0.53 0.00 -0.34 0.00 0.00 178.44 178.45 1y8b h ALA 47 N 1.31 -0.97 0.00 1.25 0.00 -1.21 0.60 119.26 120.24 1y8b h ALA 47 Ca -0.15 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1y8b h ALA 47 Cb 1.66 0.92 0.00 0.00 0.00 0.00 0.00 17.79 20.36 1y8b h ALA 47 CO 0.06 -1.12 0.18 -1.00 0.00 0.00 0.00 179.25 177.37 1y8b h PRO 48 N -0.72 0.00 0.07 0.00 0.13 -1.73 -1.23 132.00 128.51 1y8b h PRO 48 Ca 0.00 0.00 -0.24 0.00 -0.87 0.00 0.00 66.00 64.90 1y8b h PRO 48 Cb 0.75 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.86 1y8b h PRO 48 CO -0.32 0.00 -1.23 1.49 -0.23 0.00 0.00 178.00 177.71 1y8b h GLU 49 N 0.00 0.15 0.00 0.86 4.22 -1.10 -3.30 114.58 115.41 1y8b h GLU 49 Ca 0.00 -0.26 -0.02 0.00 0.08 0.00 0.00 59.36 59.16 1y8b h GLU 49 Cb 0.36 0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.70 1y8b h GLU 49 CO 0.00 1.12 -0.11 -0.91 -2.18 0.00 0.00 179.01 176.93 1y8b h ASN 50 N -0.55 0.00 -0.15 1.04 4.21 -0.48 -2.71 115.58 116.94 1y8b h ASN 50 Ca -0.28 0.00 -0.12 0.00 1.21 0.00 0.00 56.30 57.11 1y8b h ASN 50 Cb 1.56 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 38.75 1y8b h ASN 50 CO -0.02 0.11 -0.29 -0.09 -1.29 0.00 0.00 177.43 175.85 1y8b h ARG 51 N 0.00 0.63 -0.55 0.81 9.65 -1.36 -2.93 114.38 120.63 1y8b h ARG 51 Ca -0.00 -0.27 -0.04 0.00 -1.10 0.00 0.00 59.98 58.57 1y8b h ARG 51 Cb 0.57 -0.02 -0.02 0.00 -1.39 0.00 0.00 29.97 29.11 1y8b h ARG 51 CO 0.01 0.85 0.19 0.37 2.80 0.00 0.00 179.97 184.20 1y8b h GLN 52 N 0.54 0.84 -0.96 0.20 4.15 -1.55 -2.29 115.11 116.04 1y8b h GLN 52 Ca 0.07 -0.17 0.19 0.00 0.77 0.00 0.00 58.65 59.50 1y8b h GLN 52 Cb 0.78 -0.13 -0.11 0.00 0.21 0.00 0.00 27.48 28.23 1y8b h GLN 52 CO 0.06 0.75 0.55 1.25 -1.93 0.00 0.00 178.83 179.52 1y8b h LEU 53 N 0.76 0.68 -0.66 -2.39 5.85 -1.53 0.32 115.31 118.35 1y8b h LEU 53 Ca 0.18 0.10 -0.07 0.00 0.84 0.00 0.00 57.88 58.94 1y8b h LEU 53 Cb 0.25 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.24 1y8b h LEU 53 CO -0.01 0.23 0.15 -0.07 -0.34 0.00 0.00 178.44 178.39 1y8b h LEU 54 N 0.69 1.01 -1.40 2.25 3.38 -1.38 1.13 115.31 120.99 1y8b h LEU 54 Ca 0.56 -0.24 -0.06 0.00 0.09 0.00 0.00 57.88 58.23 1y8b h LEU 54 Cb 0.88 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 1y8b h LEU 54 CO -0.40 0.99 -0.29 0.00 0.09 0.00 0.00 178.44 178.83 1y8b h ALA 55 N 1.06 1.30 0.16 1.53 0.00 -0.22 -0.40 119.26 122.69 1y8b h ALA 55 Ca 0.20 -0.26 -0.33 0.00 0.00 0.00 0.00 54.91 54.52 1y8b h ALA 55 Cb 0.38 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1y8b h ALA 55 CO 0.01 0.36 -1.65 1.49 0.00 0.00 0.00 179.25 179.46 1y8b h GLU 56 N 0.00 0.33 -0.58 0.00 4.81 0.20 -2.83 114.58 116.51 1y8b h GLU 56 Ca -0.00 -0.56 -0.05 0.00 -0.13 0.00 0.00 59.36 58.61 1y8b h GLU 56 Cb 0.59 0.21 -0.02 0.00 0.63 0.00 0.00 28.75 30.16 1y8b h GLU 56 CO 0.04 1.22 0.16 -0.09 -0.73 0.00 0.00 179.01 179.60 1y8b h ARG 57 N 0.09 0.92 0.00 1.92 1.12 0.16 0.44 114.38 119.03 1y8b h ARG 57 Ca -0.30 -0.21 -0.09 0.00 -1.11 0.00 0.00 59.98 58.28 1y8b h ARG 57 Cb 2.06 -0.13 -0.01 0.00 -0.01 0.00 0.00 29.97 31.89 1y8b h ARG 57 CO 0.17 0.84 -0.41 -0.44 -3.11 0.00 0.00 179.97 177.03 1y8b h ASP 58 N 0.83 0.00 0.19 -3.80 5.19 -1.19 -2.79 116.42 114.86 1y8b h ASP 58 Ca 0.18 0.00 -0.26 0.00 -0.62 0.00 0.00 57.03 56.33 1y8b h ASP 58 Cb 0.33 0.00 0.03 0.00 0.18 0.00 0.00 39.33 39.86 1y8b h ASP 58 CO -0.00 0.41 -1.17 0.03 -3.12 0.00 0.00 179.24 175.39 1y8b h ARG 59 N 0.00 0.40 -0.83 3.56 2.47 -1.14 -1.66 114.38 117.18 1y8b h ARG 59 Ca -0.00 -0.69 0.07 0.00 -1.26 0.00 0.00 59.98 58.10 1y8b h ARG 59 Cb 0.85 0.26 -0.05 0.00 -1.65 0.00 0.00 29.97 29.37 1y8b h ARG 59 CO 0.05 1.33 0.54 0.97 0.56 0.00 0.00 179.97 183.43 1y8b h ILE 60 N -0.14 1.03 0.21 2.04 6.09 -0.06 0.25 117.51 126.93 1y8b h ILE 60 Ca -0.21 -0.31 -0.33 0.00 -1.37 0.00 0.00 64.86 62.64 1y8b h ILE 60 Cb 1.89 0.06 0.02 0.00 0.47 0.00 0.00 36.82 39.26 1y8b h ILE 60 CO 0.20 0.16 -1.50 0.06 -3.07 0.00 0.00 178.15 174.01 1y8b h GLN 61 N 0.90 0.45 -0.69 2.19 3.07 -1.57 -2.37 115.11 117.08 1y8b h GLN 61 Ca 0.36 -0.76 -0.01 0.00 0.09 0.00 0.00 58.65 58.33 1y8b h GLN 61 Cb 0.26 0.28 -0.03 0.00 0.08 0.00 0.00 27.48 28.07 1y8b h GLN 61 CO -0.13 1.36 0.40 0.00 0.09 0.00 0.00 178.83 180.55 1y8b h ALA 62 N 0.25 0.89 -0.39 0.06 0.00 -0.63 0.61 119.26 120.05 1y8b h ALA 62 Ca -0.25 -0.09 -0.16 0.00 0.00 0.00 0.00 54.91 54.40 1y8b h ALA 62 Cb 2.12 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 19.62 1y8b h ALA 62 CO 0.24 0.38 -0.38 0.00 0.00 0.00 0.00 179.25 179.48 1y8b h ALA 63 N 1.21 0.58 0.05 0.00 0.00 -0.62 -1.67 119.26 118.81 1y8b h ALA 63 Ca 0.25 -0.46 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 1y8b h ALA 63 Cb -0.00 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 1y8b h ALA 63 CO -0.04 0.68 -0.03 1.25 0.00 0.00 0.00 179.25 181.11 1y8b h LEU 64 N 0.77 -0.07 0.10 0.00 5.85 -0.95 -1.38 115.31 119.63 1y8b h LEU 64 Ca 0.06 0.00 0.02 0.00 0.84 0.00 0.00 57.88 58.81 1y8b h LEU 64 Cb 0.98 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.99 1y8b h LEU 64 CO 0.10 -0.05 -0.26 0.44 -0.34 0.00 0.00 178.44 178.33 1y8b h ASP 65 N -0.07 -0.75 -0.28 1.25 3.32 -0.82 0.05 116.42 119.12 1y8b h ASP 65 Ca -0.01 0.09 0.04 0.00 0.02 0.00 0.00 57.03 57.17 1y8b h ASP 65 Cb 0.06 0.29 -0.06 0.00 0.22 0.00 0.00 39.33 39.84 1y8b h ASP 65 CO 0.01 -0.35 -0.42 -0.33 -1.72 0.00 0.00 179.24 176.43 1y8b h GLU 66 N -0.46 -0.30 -0.79 3.56 5.08 -1.01 1.46 114.58 122.12 1y8b h GLU 66 Ca 0.04 0.02 0.16 0.00 -1.00 0.00 0.00 59.36 58.58 1y8b h GLU 66 Cb 0.49 0.07 -0.10 0.00 0.50 0.00 0.00 28.75 29.71 1y8b h GLU 66 CO -0.16 -0.20 0.32 -1.49 -1.00 0.00 0.00 179.01 176.47 1y8b h TRP 67 N -0.31 0.53 -0.49 4.33 4.06 -1.01 0.45 115.95 123.51 1y8b h TRP 67 Ca 0.05 0.04 -0.06 0.00 2.06 0.00 0.00 58.89 60.98 1y8b h TRP 67 Cb 0.45 -0.11 -0.02 0.00 -1.00 0.00 0.00 29.16 28.48 1y8b h TRP 67 CO -0.68 0.03 0.07 1.25 -3.56 0.00 0.00 178.44 175.55 1y8b h HIS 68 N 0.43 0.80 0.09 0.49 2.76 0.14 -2.70 115.15 117.16 1y8b h HIS 68 Ca 0.45 -0.09 -0.00 0.00 -2.20 0.00 0.00 60.37 58.53 1y8b h HIS 68 Cb 0.73 -0.23 -0.00 0.00 1.55 0.00 0.00 27.41 29.46 1y8b h HIS 68 CO -0.17 0.71 -0.05 -0.09 -1.30 0.00 0.00 177.93 177.03 1y8b h ARG 69 N 0.74 -0.13 0.00 5.26 2.43 0.65 -0.32 114.38 123.01 1y8b h ARG 69 Ca 0.16 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.33 1y8b h ARG 69 Cb 0.35 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.93 1y8b h ARG 69 CO 0.01 -0.09 0.00 0.43 -1.51 0.00 0.00 179.97 178.81 1y8b n SER 70 N -5.15 0.08 -3.43 -3.80 7.64 -0.48 -3.54 113.62 104.94 1y8b n SER 70 Ca -0.08 0.53 -0.27 0.00 1.01 0.00 0.00 58.87 60.07 1y8b n SER 70 Cb 0.08 -0.54 -0.10 0.00 -1.01 0.00 0.00 64.21 62.64 1y8b n SER 70 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1y8b n ASN 71 N -1.60 0.13 -4.84 6.43 2.85 -0.15 -5.11 115.26 112.97 1y8b n ASN 71 Ca 0.01 -2.54 -0.32 0.00 -0.11 0.00 0.00 54.58 51.62 1y8b n ASN 71 Cb 0.06 -0.59 -0.02 0.00 1.24 0.00 0.00 39.78 40.47 1y8b n ASN 71 CO 0.00 0.00 0.00 -2.16 -2.11 0.00 0.00 177.26 172.99 1y8b s PRO 72 N -0.35 3.81 0.21 1.20 0.04 -1.11 -4.74 135.00 134.06 1y8b s PRO 72 Ca 0.32 0.96 0.00 0.00 0.04 0.00 0.00 61.00 62.33 1y8b s PRO 72 Cb 0.05 -2.11 0.00 0.00 0.04 0.00 0.00 34.50 32.48 1y8b s PRO 72 CO -0.18 -0.39 0.00 0.41 0.04 0.00 0.00 177.00 176.88 1y8b n GLY 73 N -1.65 -2.41 2.69 0.56 0.00 -1.26 -4.99 105.19 98.13 1y8b n GLY 73 Ca 0.07 -1.89 -0.21 0.00 0.00 0.00 0.00 46.02 43.99 1y8b n GLY 73 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1y8b n PRO 74 N -0.09 -3.06 -3.61 1.61 -0.02 -1.26 -4.93 135.00 123.63 1y8b n PRO 74 Ca 0.00 -0.98 -0.39 0.00 -2.02 0.00 0.00 63.50 60.10 1y8b n PRO 74 Cb 0.00 -1.48 -0.09 0.00 -0.02 0.00 0.00 33.50 31.91 1y8b n PRO 74 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1y8b s VAL 75 N -1.91 4.04 -0.16 -1.45 1.01 -1.26 -4.92 120.40 115.75 1y8b s VAL 75 Ca 0.45 -2.16 0.01 0.00 0.00 0.00 0.00 61.98 60.28 1y8b s VAL 75 Cb -0.08 -3.66 0.21 0.00 0.00 0.00 0.00 36.38 32.86 1y8b s VAL 75 CO 0.38 -0.80 1.43 0.29 0.00 0.00 0.00 175.10 176.39 1y8b n LYS 76 N 4.45 1.44 -2.95 2.72 5.02 -1.26 -4.45 118.16 123.14 1y8b n LYS 76 Ca -0.01 -1.02 -0.00 0.00 -2.02 0.00 0.00 58.31 55.25 1y8b n LYS 76 Cb 0.41 -1.40 0.00 0.00 -0.02 0.00 0.00 35.03 34.02 1y8b n LYS 76 CO 0.00 0.00 0.00 0.16 -0.52 0.00 0.00 177.40 177.04 1y8b s ASP 77 N 0.31 -1.09 0.11 4.39 1.47 -1.26 -5.02 116.67 115.57 1y8b s ASP 77 Ca 0.20 -0.79 -0.12 0.00 1.18 0.00 0.00 52.55 53.01 1y8b s ASP 77 Cb 0.16 1.40 -0.15 0.00 -0.34 0.00 0.00 42.92 44.00 1y8b s ASP 77 CO 0.03 -0.09 1.31 0.11 0.68 0.00 0.00 175.17 177.21 1y8b h LYS 78 N 5.88 0.79 -0.72 2.11 1.79 -1.98 -0.37 116.57 124.08 1y8b h LYS 78 Ca 0.03 -0.64 0.01 0.00 -2.18 0.00 0.00 60.65 57.86 1y8b h LYS 78 Cb 1.18 0.13 -0.04 0.00 -1.58 0.00 0.00 32.23 31.92 1y8b h LYS 78 CO 0.02 1.25 0.48 0.00 -1.08 0.00 0.00 179.45 180.11 1y8b h ALA 79 N 0.57 1.48 0.18 3.86 0.00 -1.97 1.44 119.26 124.81 1y8b h ALA 79 Ca -0.05 -0.05 -0.23 0.00 0.00 0.00 0.00 54.91 54.57 1y8b h ALA 79 Cb 1.41 -0.29 0.03 0.00 0.00 0.00 0.00 17.79 18.93 1y8b h ALA 79 CO 0.16 0.48 -1.03 0.00 0.00 0.00 0.00 179.25 178.86 1y8b h ALA 80 N 1.55 -0.11 -0.22 0.00 0.00 -1.96 -2.66 119.26 115.87 1y8b h ALA 80 Ca 0.26 -0.76 -0.18 0.00 0.00 0.00 0.00 54.91 54.24 1y8b h ALA 80 Cb -0.11 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1y8b h ALA 80 CO -0.06 0.48 -0.58 -0.92 0.00 0.00 0.00 179.25 178.18 1y8b h TYR 81 N -0.22 0.87 -0.53 0.00 5.03 -0.77 -2.71 116.97 118.65 1y8b h TYR 81 Ca -0.18 -0.32 -0.09 0.00 2.58 0.00 0.00 58.73 60.72 1y8b h TYR 81 Cb 1.80 -0.16 -0.02 0.00 1.55 0.00 0.00 36.73 39.91 1y8b h TYR 81 CO 0.18 1.10 -0.03 -0.22 -1.32 0.00 0.00 178.16 177.87 1y8b h LYS 82 N 0.52 0.95 0.56 1.82 3.11 0.19 -3.05 116.57 120.67 1y8b h LYS 82 Ca 0.00 -0.32 -0.03 0.00 -2.81 0.00 0.00 60.65 57.50 1y8b h LYS 82 Cb 1.16 -0.08 0.01 0.00 -1.00 0.00 0.00 32.23 32.32 1y8b h LYS 82 CO 0.12 0.98 -0.27 1.03 -2.81 0.00 0.00 179.45 178.49 1y8b h SER 83 N 0.82 -0.64 -0.98 4.20 0.87 -1.43 -2.58 113.55 113.81 1y8b h SER 83 Ca 0.15 -0.00 0.31 0.00 -1.23 0.00 0.00 61.79 61.01 1y8b h SER 83 Cb 0.57 0.17 -0.15 0.00 -0.44 0.00 0.00 62.40 62.55 1y8b h SER 83 CO 0.03 -0.41 0.50 -0.26 -0.53 0.00 0.00 176.83 176.16 1y8b h PHE 84 N -0.82 0.80 -0.50 2.24 -1.00 -1.48 1.29 116.94 117.46 1y8b h PHE 84 Ca -0.08 0.04 0.01 0.00 2.81 0.00 0.00 57.97 60.75 1y8b h PHE 84 Cb 0.61 -0.19 -0.02 0.00 3.61 0.00 0.00 35.95 39.95 1y8b h PHE 84 CO -0.02 -0.20 0.33 -0.07 -1.61 0.00 0.00 178.31 176.74 1y8b h LEU 85 N 0.28 0.56 -0.50 1.54 3.38 -1.35 1.43 115.31 120.65 1y8b h LEU 85 Ca 0.70 -0.01 -0.14 0.00 0.09 0.00 0.00 57.88 58.52 1y8b h LEU 85 Cb 1.59 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 42.19 1y8b h LEU 85 CO -0.63 0.40 -0.34 -0.09 0.09 0.00 0.00 178.44 177.88 1y8b h ARG 86 N 0.66 0.86 0.00 1.13 2.43 0.18 3.78 114.38 123.42 1y8b h ARG 86 Ca 0.18 -0.42 -0.25 0.00 -0.81 0.00 0.00 59.98 58.69 1y8b h ARG 86 Cb -0.06 -0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.45 1y8b h ARG 86 CO -0.04 1.06 -1.31 0.93 -1.51 0.00 0.00 179.97 179.11 1y8b h GLU 87 N 0.72 0.01 0.00 0.20 5.08 -0.62 -3.28 114.58 116.69 1y8b h GLU 87 Ca 0.07 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1y8b h GLU 87 Cb 0.90 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.16 1y8b h GLU 87 CO 0.08 0.79 -1.00 -0.11 -1.00 0.00 0.00 179.01 177.77 1y8b n LEU 88 N -3.23 0.00 -0.09 1.33 0.00 0.48 -4.63 117.00 110.86 1y8b n LEU 88 Ca -0.07 0.00 0.01 0.00 0.00 0.00 0.00 56.01 55.94 1y8b n LEU 88 Cb 0.99 0.00 0.01 0.00 0.00 0.00 0.00 43.42 44.42 1y8b n LEU 88 CO 0.46 0.00 0.50 0.61 0.00 0.00 0.00 177.39 178.96 1y8b n GLY 89 N 3.00 -0.69 3.80 -3.96 0.00 1.24 -4.87 105.19 103.70 1y8b n GLY 89 Ca -0.00 -0.04 -0.24 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.38 -1.90 -3.85 1.61 4.01 -0.31 -4.81 117.16 111.53 1y8b n TYR 90 Ca 0.01 0.83 -0.35 0.00 -0.16 0.00 0.00 57.90 58.23 1y8b n TYR 90 Cb 0.04 -4.15 -0.08 0.00 -0.31 0.00 0.00 39.34 34.84 1y8b n TYR 90 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 1y8b s LEU 91 N -6.84 4.10 -0.05 7.72 2.96 -1.07 -4.93 118.68 120.57 1y8b s LEU 91 Ca 0.11 0.22 -0.05 0.00 -0.22 0.00 0.00 54.13 54.20 1y8b s LEU 91 Cb -0.06 -2.04 0.01 0.00 0.50 0.00 0.00 46.19 44.60 1y8b s LEU 91 CO 0.83 0.22 0.13 0.68 -1.32 0.00 0.00 176.35 176.89 1y8b s VAL 92 N 0.12 0.01 0.84 1.68 -7.23 -1.26 -4.63 120.40 109.93 1y8b s VAL 92 Ca 0.08 -0.05 -0.16 0.00 -1.81 0.00 0.00 61.98 60.04 1y8b s VAL 92 Cb -0.12 -0.21 -0.08 0.00 0.56 0.00 0.00 36.38 36.54 1y8b s VAL 92 CO -0.00 -0.03 -0.10 -2.65 -0.31 0.00 0.00 175.10 172.01 1y8b n PRO 93 N 2.90 0.01 -4.49 4.82 -0.02 -1.26 -4.96 135.00 132.00 1y8b n PRO 93 Ca -0.13 0.02 -0.26 0.00 -2.02 0.00 0.00 63.50 61.11 1y8b n PRO 93 Cb 0.59 -1.40 -0.13 0.00 -0.02 0.00 0.00 33.50 32.54 1y8b n PRO 93 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 1y8b s GLN 94 N -2.40 1.35 0.87 -0.52 1.03 -1.26 -4.98 119.66 113.75 1y8b s GLN 94 Ca 0.53 -1.14 -0.18 0.00 0.04 0.00 0.00 55.36 54.61 1y8b s GLN 94 Cb -0.28 -1.62 -0.14 0.00 0.03 0.00 0.00 33.01 31.00 1y8b s GLN 94 CO 0.71 0.39 -0.92 -2.30 -2.54 0.00 0.00 175.29 170.63 1y8b n PRO 95 N 1.34 0.00 0.20 9.60 -0.02 -1.26 -4.84 135.00 140.03 1y8b n PRO 95 Ca -0.18 0.00 0.12 0.00 -2.02 0.00 0.00 63.50 61.42 1y8b n PRO 95 Cb 0.53 -0.87 0.15 0.00 -0.02 0.00 0.00 33.50 33.29 1y8b n PRO 95 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1y8b h GLU 96 N -0.87 0.00 -3.01 -0.52 4.81 -2.02 -3.47 114.58 109.50 1y8b h GLU 96 Ca -0.37 0.00 0.07 0.00 -0.13 0.00 0.00 59.36 58.93 1y8b h GLU 96 Cb 1.16 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.49 1y8b h GLU 96 CO 0.19 0.00 0.23 1.03 -0.73 0.00 0.00 179.01 179.73 1y8b s ARG 97 N -3.23 1.79 -0.00 1.92 1.81 -1.26 -5.18 118.95 114.80 1y8b s ARG 97 Ca 0.06 -0.99 -0.03 0.00 -1.72 0.00 0.00 55.73 53.04 1y8b s ARG 97 Cb 0.06 0.61 -0.00 0.00 -0.45 0.00 0.00 34.95 35.16 1y8b s ARG 97 CO 0.69 -0.82 0.06 0.08 -0.68 0.00 0.00 175.30 174.63 1y8b s VAL 98 N -3.92 0.07 -0.47 3.52 1.01 -1.26 -5.11 120.40 114.23 1y8b s VAL 98 Ca 0.11 -0.55 -0.01 0.00 0.00 0.00 0.00 61.98 61.53 1y8b s VAL 98 Cb -0.06 -0.28 0.13 0.00 0.00 0.00 0.00 36.38 36.17 1y8b s VAL 98 CO 0.07 -0.30 0.25 0.42 0.00 0.00 0.00 175.10 175.54 1y8b s THR 99 N -0.96 3.15 -0.00 3.92 -4.23 -1.26 -5.06 115.64 111.19 1y8b s THR 99 Ca -0.11 -2.51 -0.30 0.00 -1.18 0.00 0.00 61.69 57.59 1y8b s THR 99 Cb -0.06 -3.15 -0.05 0.00 1.34 0.00 0.00 72.50 70.58 1y8b s THR 99 CO 0.00 -0.74 1.36 -0.69 -0.54 0.00 0.00 174.62 174.02 1y8b s VAL 100 N 0.59 3.79 -0.17 2.29 1.01 -1.26 -4.89 120.40 121.75 1y8b s VAL 100 Ca 0.12 1.17 -0.01 0.00 0.00 0.00 0.00 61.98 63.27 1y8b s VAL 100 Cb -0.22 -3.75 0.05 0.00 0.00 0.00 0.00 36.38 32.45 1y8b s VAL 100 CO -0.04 0.00 -0.03 -1.83 0.00 0.00 0.00 175.10 173.20 1y8b s GLU 101 N 2.31 1.25 0.05 2.72 4.04 -1.23 -5.11 118.70 122.73 1y8b s GLU 101 Ca 0.62 -0.52 0.03 0.00 0.04 0.00 0.00 54.97 55.14 1y8b s GLU 101 Cb -0.30 -2.04 -0.03 0.00 0.02 0.00 0.00 34.13 31.78 1y8b s GLU 101 CO 0.26 -0.49 -0.09 -0.08 -1.84 0.00 0.00 175.26 173.02 1y8b s THR 102 N 1.67 0.67 0.25 1.83 -1.32 -1.26 -4.66 115.64 112.81 1y8b s THR 102 Ca -0.00 -1.16 -0.04 0.00 -1.21 0.00 0.00 61.69 59.28 1y8b s THR 102 Cb -0.16 -0.74 0.06 0.00 -1.51 0.00 0.00 72.50 70.15 1y8b s THR 102 CO -0.07 -0.37 0.34 0.35 -2.21 0.00 0.00 174.62 172.66 1y8b n THR 103 N 1.37 0.00 -2.46 5.08 -2.24 -1.26 -4.91 114.28 109.87 1y8b n THR 103 Ca -0.22 -0.25 -0.39 0.00 -2.27 0.00 0.00 64.05 60.92 1y8b n THR 103 Cb 0.55 -1.87 -0.03 0.00 -2.10 0.00 0.00 70.33 66.88 1y8b n THR 103 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1y8b s GLY 104 N -3.75 0.95 0.00 3.38 0.00 -1.26 -4.40 107.32 102.24 1y8b s GLY 104 Ca 0.20 -1.82 0.00 0.00 0.00 0.00 0.00 44.72 43.10 1y8b s GLY 104 CO 0.14 2.83 0.00 0.29 0.00 0.00 0.00 173.10 176.36 1y8b n ILE 105 N 6.91 0.00 0.19 0.90 -6.64 -1.26 -4.90 119.36 114.55 1y8b n ILE 105 Ca 0.25 0.00 0.00 0.00 -1.77 0.00 0.00 62.75 61.23 1y8b n ILE 105 Cb 0.50 0.00 0.00 0.00 -1.44 0.00 0.00 39.64 38.70 1y8b n ILE 105 CO 0.00 0.00 0.00 0.47 -1.77 0.00 0.00 176.55 175.25 1y8b n ASP 106 N -1.31 0.44 -0.24 7.28 8.00 -1.26 -4.08 116.55 125.39 1y8b n ASP 106 Ca 0.00 -0.38 0.32 0.00 0.71 0.00 0.00 54.79 55.44 1y8b n ASP 106 Cb 0.00 -0.10 0.64 0.00 -0.02 0.00 0.00 41.12 41.64 1y8b n ASP 106 CO 0.00 0.00 0.00 -1.28 -0.39 0.00 0.00 177.20 175.53 1y8b h SER 107 N 1.35 0.00 0.10 -2.24 0.87 -1.90 -0.37 113.55 111.35 1y8b h SER 107 Ca 0.00 0.00 0.02 0.00 -1.23 0.00 0.00 61.79 60.58 1y8b h SER 107 Cb 0.16 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 62.07 1y8b h SER 107 CO 0.00 0.00 -0.38 -0.33 -0.53 0.00 0.00 176.83 175.59 1y8b h GLU 108 N 0.00 -0.58 0.00 2.24 4.39 -1.91 2.61 114.58 121.33 1y8b h GLU 108 Ca 0.50 0.04 -0.05 0.00 0.34 0.00 0.00 59.36 60.19 1y8b h GLU 108 Cb 2.48 0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 31.25 1y8b h GLU 108 CO -0.01 -0.39 -0.23 -0.84 -1.16 0.00 0.00 179.01 176.39 1y8b h ILE 109 N -0.60 0.45 0.00 3.13 3.07 -1.24 2.42 117.51 124.74 1y8b h ILE 109 Ca 0.03 -1.34 0.00 0.00 1.55 0.00 0.00 64.86 65.10 1y8b h ILE 109 Cb 0.64 1.98 0.00 0.00 -0.27 0.00 0.00 36.82 39.17 1y8b h ILE 109 CO -0.24 0.22 -0.83 0.41 -1.05 0.00 0.00 178.15 176.66 1y8b n THR 110 N -3.24 0.13 -0.50 0.16 -1.04 -0.77 -4.47 114.28 104.55 1y8b n THR 110 Ca 0.02 -0.16 0.00 0.00 -2.04 0.00 0.00 64.05 61.87 1y8b n THR 110 Cb 0.53 0.25 0.00 0.00 -1.82 0.00 0.00 70.33 69.29 1y8b n THR 110 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1y8b n SER 111 N -1.82 0.00 -3.31 8.00 7.64 0.87 -5.02 113.62 119.99 1y8b n SER 111 Ca 0.03 -0.44 -0.20 0.00 1.01 0.00 0.00 58.87 59.27 1y8b n SER 111 Cb 0.40 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.53 1y8b n SER 111 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1y8b n GLN 112 N 0.00 0.47 0.00 1.43 6.02 0.82 -4.67 117.38 121.45 1y8b n GLN 112 Ca 0.00 -3.08 0.00 0.00 -0.01 0.00 0.00 57.00 53.91 1y8b n GLN 112 Cb 0.11 2.14 0.00 0.00 1.02 0.00 0.00 30.24 33.51 1y8b n GLN 112 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1y8b n ALA 113 N -1.06 0.00 -3.74 -1.58 0.00 -1.24 -4.21 120.51 108.68 1y8b n ALA 113 Ca -0.12 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.28 1y8b n ALA 113 Cb 0.55 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.99 1y8b n ALA 113 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1y8b s GLY 114 N 0.00 -0.25 0.63 0.00 0.00 -1.26 -4.60 107.32 101.84 1y8b s GLY 114 Ca 0.00 0.18 -0.16 0.00 0.00 0.00 0.00 44.72 44.74 1y8b s GLY 114 CO 0.00 0.03 -0.36 -1.05 0.00 0.00 0.00 173.10 171.72 1y8b n PRO 115 N -0.45 0.00 -4.41 2.90 -0.02 -1.26 -4.51 135.00 127.24 1y8b n PRO 115 Ca -0.06 0.00 -0.34 0.00 -2.02 0.00 0.00 63.50 61.08 1y8b n PRO 115 Cb 0.61 -0.91 -0.14 0.00 -0.02 0.00 0.00 33.50 33.04 1y8b n PRO 115 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1y8b s GLN 116 N -1.27 3.39 0.08 -0.52 -1.52 -1.11 -3.21 119.66 115.49 1y8b s GLN 116 Ca 0.46 -0.66 0.05 0.00 -1.95 0.00 0.00 55.36 53.26 1y8b s GLN 116 Cb -0.34 -2.78 -0.04 0.00 -0.22 0.00 0.00 33.01 29.63 1y8b s GLN 116 CO 0.66 0.05 -0.06 -1.17 -0.25 0.00 0.00 175.29 174.53 1y8b s LEU 117 N 0.78 3.21 0.22 2.90 2.96 -1.11 -1.58 118.68 126.07 1y8b s LEU 117 Ca -0.04 -0.26 0.11 0.00 -0.22 0.00 0.00 54.13 53.71 1y8b s LEU 117 Cb -0.15 -1.96 -0.04 0.00 0.50 0.00 0.00 46.19 44.54 1y8b s LEU 117 CO 0.01 0.20 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.40 1y8b s VAL 118 N -1.20 2.79 -0.03 1.68 1.01 -0.98 -1.93 120.40 121.73 1y8b s VAL 118 Ca 0.22 -2.00 -0.01 0.00 0.00 0.00 0.00 61.98 60.19 1y8b s VAL 118 Cb -0.11 -2.41 0.03 0.00 0.00 0.00 0.00 36.38 33.89 1y8b s VAL 118 CO 0.14 -0.22 0.07 0.68 0.00 0.00 0.00 175.10 175.77 1y8b s VAL 119 N -1.98 -0.04 -0.37 2.92 -7.23 -1.19 -4.67 120.40 107.84 1y8b s VAL 119 Ca 0.26 0.16 -0.44 0.00 -1.81 0.00 0.00 61.98 60.15 1y8b s VAL 119 Cb -0.07 -0.13 -0.20 0.00 0.56 0.00 0.00 36.38 36.54 1y8b s VAL 119 CO 0.14 0.07 1.44 -2.65 -0.31 0.00 0.00 175.10 173.78 1y8b n PRO 120 N 3.97 0.00 0.00 4.82 -0.02 -1.26 -4.02 135.00 138.50 1y8b n PRO 120 Ca -0.24 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.24 1y8b n PRO 120 Cb 0.52 -1.47 0.00 0.00 -0.02 0.00 0.00 33.50 32.54 1y8b n PRO 120 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1y8b n ALA 121 N 3.31 0.00 -2.21 3.55 0.00 -1.26 0.14 120.51 124.04 1y8b n ALA 121 Ca 0.28 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.74 1y8b n ALA 121 Cb -0.03 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.45 1y8b n ALA 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1y8b n MET 122 N -0.74 0.11 -2.86 0.00 0.00 -1.26 -4.63 117.12 107.74 1y8b n MET 122 Ca 0.00 -1.66 -0.42 0.00 0.00 0.00 0.00 57.70 55.62 1y8b n MET 122 Cb 0.28 -0.32 -0.04 0.00 0.00 0.00 0.00 33.22 33.14 1y8b n MET 122 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 175.97 175.17 1y8b s ASN 123 N -1.67 6.88 0.00 3.17 -0.87 0.36 -4.98 114.94 117.84 1y8b s ASN 123 Ca 0.20 1.09 0.00 0.00 -1.57 0.00 0.00 52.86 52.58 1y8b s ASN 123 Cb 0.22 -2.45 0.00 0.00 -0.02 0.00 0.00 41.25 39.00 1y8b s ASN 123 CO -0.09 -0.53 0.00 0.00 -2.57 0.00 0.00 177.10 173.91 1y8b n ALA 124 N 5.99 0.00 -0.29 0.60 0.00 -1.26 -3.73 120.51 121.82 1y8b n ALA 124 Ca 0.06 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.53 1y8b n ALA 124 Cb 0.47 0.00 0.10 0.00 0.00 0.00 0.00 19.45 20.02 1y8b n ALA 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1y8b h ARG 125 N 0.00 -0.01 -0.99 0.00 3.08 -1.93 0.82 114.38 115.34 1y8b h ARG 125 Ca 0.00 0.00 0.14 0.00 0.07 0.00 0.00 59.98 60.19 1y8b h ARG 125 Cb 0.00 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 29.96 1y8b h ARG 125 CO 0.00 -0.01 0.62 1.88 -1.07 0.00 0.00 179.97 181.40 1y8b h TYR 126 N -0.01 1.09 -0.12 3.04 -1.99 -1.98 -0.41 116.97 116.58 1y8b h TYR 126 Ca 0.39 0.03 -0.18 0.00 2.00 0.00 0.00 58.73 60.97 1y8b h TYR 126 Cb 0.61 -0.34 -0.00 0.00 2.00 0.00 0.00 36.73 38.99 1y8b h TYR 126 CO -0.67 0.38 -0.67 0.00 -0.00 0.00 0.00 178.16 177.21 1y8b h ALA 127 N 1.57 0.61 -0.94 3.88 0.00 0.46 -3.11 119.26 121.73 1y8b h ALA 127 Ca 0.51 -0.57 0.28 0.00 0.00 0.00 0.00 54.91 55.13 1y8b h ALA 127 Cb 0.62 -0.06 -0.15 0.00 0.00 0.00 0.00 17.79 18.20 1y8b h ALA 127 CO -0.29 0.73 0.39 1.25 0.00 0.00 0.00 179.25 181.33 1y8b h LEU 128 N 0.35 0.24 -0.45 0.00 6.46 0.88 1.00 115.31 123.79 1y8b h LEU 128 Ca -0.02 0.20 -0.18 0.00 -0.12 0.00 0.00 57.88 57.76 1y8b h LEU 128 Cb 1.23 0.21 -0.01 0.00 -0.73 0.00 0.00 40.66 41.36 1y8b h LEU 128 CO 0.12 -0.15 -0.73 -1.13 -0.62 0.00 0.00 178.44 175.94 1y8b h ASN 129 N 0.26 0.38 0.50 1.25 -0.73 -1.50 -2.99 115.58 112.76 1y8b h ASN 129 Ca 0.64 -0.25 -0.02 0.00 1.87 0.00 0.00 56.30 58.54 1y8b h ASN 129 Cb 1.39 -0.11 0.00 0.00 0.27 0.00 0.00 38.32 39.87 1y8b h ASN 129 CO -0.64 0.98 -0.24 0.00 -0.37 0.00 0.00 177.43 177.16 1y8b h ALA 130 N 1.01 -0.75 -1.18 1.57 0.00 0.91 2.86 119.26 123.69 1y8b h ALA 130 Ca -0.03 -0.15 0.34 0.00 0.00 0.00 0.00 54.91 55.08 1y8b h ALA 130 Cb 1.29 0.26 -0.10 0.00 0.00 0.00 0.00 17.79 19.24 1y8b h ALA 130 CO 0.12 -0.70 0.77 0.00 0.00 0.00 0.00 179.25 179.44 1y8b h ALA 131 N -1.31 2.56 -0.18 0.00 0.00 -0.81 2.22 119.26 121.72 1y8b h ALA 131 Ca -0.07 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1y8b h ALA 131 Cb 0.52 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1y8b h ALA 131 CO 0.11 -1.04 0.00 0.09 0.00 0.00 0.00 179.25 178.42 1y8b n ASN 132 N -4.58 1.25 0.00 0.00 4.13 -1.13 -0.01 115.26 114.92 1y8b n ASN 132 Ca 0.30 -2.05 0.00 0.00 1.68 0.00 0.00 54.58 54.51 1y8b n ASN 132 Cb 1.15 -0.21 0.00 0.00 -1.54 0.00 0.00 39.78 39.18 1y8b n ASN 132 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1y8b n ALA 133 N 0.08 0.00 0.00 5.41 0.00 0.75 -3.36 120.51 123.39 1y8b n ALA 133 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 1y8b n ALA 133 Cb 0.22 -0.59 0.00 0.00 0.00 0.00 0.00 19.45 19.08 1y8b n ALA 133 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1y8b n ARG 134 N -1.50 0.00 -2.51 0.00 3.00 0.95 0.20 116.66 116.81 1y8b n ARG 134 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 1y8b n ARG 134 Cb 0.14 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.60 1y8b n ARG 134 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.63 174.96 1y8b n TRP 135 N 0.00 0.00 0.00 -0.14 4.27 -1.21 -4.70 117.44 115.66 1y8b n TRP 135 Ca 0.00 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.61 1y8b n TRP 135 Cb 0.00 -0.80 0.00 0.00 -1.36 0.00 0.00 31.31 29.15 1y8b n TRP 135 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1y8b n GLY 136 N 1.94 0.78 0.00 -1.67 0.00 -1.25 -4.85 105.19 100.14 1y8b n GLY 136 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.27 1y8b n GLY 136 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1y8b n SER 137 N 0.00 0.00 -0.22 1.61 3.41 -1.22 -4.82 113.62 112.37 1y8b n SER 137 Ca 0.00 -0.56 -0.07 0.00 -0.26 0.00 0.00 58.87 57.97 1y8b n SER 137 Cb 0.00 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 63.98 1y8b n SER 137 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1y8b h LEU 138 N 0.00 0.87 0.17 1.04 6.46 -1.91 2.16 115.31 124.10 1y8b h LEU 138 Ca 0.00 -0.18 -0.30 0.00 -0.12 0.00 0.00 57.88 57.29 1y8b h LEU 138 Cb 0.28 -0.23 0.01 0.00 -0.73 0.00 0.00 40.66 40.00 1y8b h LEU 138 CO 0.00 0.81 -1.33 0.22 -0.62 0.00 0.00 178.44 177.52 1y8b h TYR 139 N 0.88 0.64 0.00 1.25 3.20 -1.92 -3.27 116.97 117.76 1y8b h TYR 139 Ca 0.21 -0.47 0.00 0.00 3.14 0.00 0.00 58.73 61.61 1y8b h TYR 139 Cb 0.22 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 38.46 1y8b h TYR 139 CO 0.01 1.37 -0.18 -0.44 -1.64 0.00 0.00 178.16 177.29 1y8b h ASP 140 N 0.10 0.00 -0.35 -2.11 5.19 -1.84 -3.13 116.42 114.28 1y8b h ASP 140 Ca -0.18 -0.02 -0.06 0.00 -0.62 0.00 0.00 57.03 56.16 1y8b h ASP 140 Cb 2.04 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 41.53 1y8b h ASP 140 CO 0.22 0.01 0.00 0.00 -3.12 0.00 0.00 179.24 176.35 1y8b h ALA 141 N 2.19 0.48 0.12 3.45 0.00 0.35 -3.06 119.26 122.79 1y8b h ALA 141 Ca 0.00 -0.25 -0.19 0.00 0.00 0.00 0.00 54.91 54.47 1y8b h ALA 141 Cb 0.90 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.57 1y8b h ALA 141 CO 0.00 0.24 -0.89 -0.07 0.00 0.00 0.00 179.25 178.53 1y8b h LEU 142 N 0.44 0.38 -0.83 0.00 3.38 -1.67 -3.30 115.31 113.71 1y8b h LEU 142 Ca 0.10 -0.92 0.20 0.00 0.09 0.00 0.00 57.88 57.36 1y8b h LEU 142 Cb 0.46 -0.13 -0.14 0.00 0.09 0.00 0.00 40.66 40.94 1y8b h LEU 142 CO 0.02 1.41 0.06 0.22 0.09 0.00 0.00 178.44 180.24 1y8b h TYR 143 N -0.44 0.04 -1.09 1.13 5.03 -1.62 0.11 116.97 120.13 1y8b h TYR 143 Ca -0.17 0.06 -0.67 0.00 2.58 0.00 0.00 58.73 60.52 1y8b h TYR 143 Cb 1.60 0.11 -0.28 0.00 1.55 0.00 0.00 36.73 39.71 1y8b h TYR 143 CO 0.19 -0.27 0.88 0.41 -1.32 0.00 0.00 178.16 178.05 1y8b n GLY 144 N -1.43 5.75 3.19 1.82 0.00 -1.16 -4.95 105.19 108.42 1y8b n GLY 144 Ca 0.17 -2.27 -0.12 0.00 0.00 0.00 0.00 46.02 43.80 1y8b n GLY 144 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1y8b s SER 145 N -1.65 0.48 0.00 1.61 1.04 0.40 -5.02 113.70 110.56 1y8b s SER 145 Ca 0.62 -1.27 0.23 0.00 0.48 0.00 0.00 55.95 56.00 1y8b s SER 145 Cb 0.49 0.28 1.08 0.00 0.10 0.00 0.00 66.02 67.97 1y8b s SER 145 CO -0.06 -0.74 1.73 0.47 0.98 0.00 0.00 173.24 175.62 1y8b n ASP 146 N -0.20 0.80 0.00 7.02 9.92 -1.26 -3.82 116.55 129.01 1y8b n ASP 146 Ca -0.03 -1.48 0.01 0.00 -0.53 0.00 0.00 54.79 52.76 1y8b n ASP 146 Cb 0.65 -0.04 0.05 0.00 -0.64 0.00 0.00 41.12 41.13 1y8b n ASP 146 CO 0.00 0.00 0.00 -0.38 0.13 0.00 0.00 177.20 176.95 1y8b n ILE 147 N -0.29 0.60 -4.08 0.53 5.41 -1.26 -4.18 119.36 116.09 1y8b n ILE 147 Ca 0.17 0.15 -0.32 0.00 1.00 0.00 0.00 62.75 63.75 1y8b n ILE 147 Cb 0.21 -1.12 -0.15 0.00 -0.71 0.00 0.00 39.64 37.86 1y8b n ILE 147 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 1y8b s ILE 148 N -2.32 2.10 -0.45 1.39 1.01 -1.25 -4.96 121.20 116.72 1y8b s ILE 148 Ca 0.02 -1.38 -0.45 0.00 0.00 0.00 0.00 60.65 58.84 1y8b s ILE 148 Cb 0.01 -2.11 -0.19 0.00 0.01 0.00 0.00 42.46 40.18 1y8b s ILE 148 CO 0.02 0.16 1.65 -2.65 0.00 0.00 0.00 174.94 174.12 1y8b n PRO 149 N 4.51 0.28 -1.58 2.79 -0.02 -1.26 -4.43 135.00 135.29 1y8b n PRO 149 Ca -0.16 0.10 0.03 0.00 -2.02 0.00 0.00 63.50 61.45 1y8b n PRO 149 Cb 0.45 -1.65 -0.01 0.00 -0.02 0.00 0.00 33.50 32.26 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 4.44 -4.01 0.00 -0.52 7.27 -1.26 -5.06 117.38 118.23 1y8b n GLN 150 Ca 0.31 3.14 0.00 0.00 0.07 0.00 0.00 57.00 60.51 1y8b n GLN 150 Cb -0.01 -4.01 0.00 0.00 2.41 0.00 0.00 30.24 28.62 1y8b n GLN 150 CO 0.00 0.00 0.00 -0.85 0.07 0.00 0.00 177.06 176.28 1y8b n GLU 151 N -2.89 0.00 0.00 3.69 0.28 -1.26 -5.06 120.64 115.40 1y8b n GLU 151 Ca -0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.99 1y8b n GLU 151 Cb 0.52 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.39 1y8b n GLU 151 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1y8b n GLY 152 N 0.00 1.35 0.00 -1.84 0.00 -1.26 -5.02 105.19 98.41 1y8b n GLY 152 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.90 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 -3.00 0.00 -1.08 4.61 0.00 -1.26 -5.08 120.51 114.70 1y8b n ALA 153 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1y8b n ALA 153 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1y8b n ALA 153 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1y8b n MET 154 N 0.00 0.00 -3.71 0.00 2.81 -1.26 -4.83 117.12 110.12 1y8b n MET 154 Ca 0.00 0.00 -0.12 0.00 -1.81 0.00 0.00 57.70 55.77 1y8b n MET 154 Cb 0.00 0.00 -0.11 0.00 -0.71 0.00 0.00 33.22 32.40 1y8b n MET 154 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 1y8b s VAL 155 N 0.05 -0.01 -0.19 2.03 -7.23 -1.26 -5.04 120.40 108.74 1y8b s VAL 155 Ca 0.00 0.05 0.06 0.00 -1.81 0.00 0.00 61.98 60.28 1y8b s VAL 155 Cb 0.00 -0.58 0.19 0.00 0.56 0.00 0.00 36.38 36.55 1y8b s VAL 155 CO 0.00 0.02 1.02 -0.24 -0.31 0.00 0.00 175.10 175.59 1y8b n SER 156 N 3.64 -0.80 -0.16 4.85 2.88 -1.26 -5.14 113.62 117.61 1y8b n SER 156 Ca -0.19 -1.63 0.02 0.00 -1.33 0.00 0.00 58.87 55.74 1y8b n SER 156 Cb 0.56 0.43 -0.01 0.00 -0.75 0.00 0.00 64.21 64.44 1y8b n SER 156 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1y8b n GLY 157 N -0.70 -1.87 3.78 0.46 0.00 -1.26 -4.85 105.19 100.75 1y8b n GLY 157 Ca -0.10 -1.46 -0.38 0.00 0.00 0.00 0.00 46.02 44.07 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 -1.92 3.68 -0.32 1.61 2.02 -1.26 -5.04 117.35 116.12 1y8b s TYR 158 Ca 0.00 1.10 -0.18 0.00 -0.37 0.00 0.00 57.07 57.61 1y8b s TYR 158 Cb 0.00 -2.49 -0.01 0.00 -0.40 0.00 0.00 41.96 39.06 1y8b s TYR 158 CO 0.00 0.43 0.54 0.34 -1.57 0.00 0.00 175.55 175.29 1y8b s ASP 159 N -0.42 6.37 0.45 2.29 -1.08 -1.26 -4.91 116.67 118.11 1y8b s ASP 159 Ca 0.28 0.17 0.04 0.00 -0.52 0.00 0.00 52.55 52.51 1y8b s ASP 159 Cb -0.17 -2.28 0.19 0.00 -1.46 0.00 0.00 42.92 39.20 1y8b s ASP 159 CO 0.15 -0.44 0.97 -0.65 0.52 0.00 0.00 175.17 175.72 1y8b h PRO 160 N 8.33 0.00 0.63 4.34 0.11 -2.00 -1.24 132.00 142.17 1y8b h PRO 160 Ca -0.28 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.80 1y8b h PRO 160 Cb 1.13 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.24 1y8b h PRO 160 CO 0.77 0.00 -0.30 1.96 -0.21 0.00 0.00 178.00 180.21 1y8b h GLN 161 N 0.00 -0.82 -0.68 1.05 1.08 -2.01 -2.97 115.11 110.75 1y8b h GLN 161 Ca 0.00 0.06 0.15 0.00 -1.45 0.00 0.00 58.65 57.40 1y8b h GLN 161 Cb 1.49 0.19 -0.04 0.00 -0.05 0.00 0.00 27.48 29.06 1y8b h GLN 161 CO 0.00 -0.55 0.46 0.00 -0.95 0.00 0.00 178.83 177.80 1y8b h ARG 162 N -1.13 0.30 -0.59 1.46 3.08 -1.62 0.23 114.38 116.11 1y8b h ARG 162 Ca -0.09 -0.02 0.11 0.00 0.07 0.00 0.00 59.98 60.05 1y8b h ARG 162 Cb 0.65 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.60 1y8b h ARG 162 CO 0.14 0.20 0.40 0.78 -1.07 0.00 0.00 179.97 180.42 1y8b h GLY 163 N 0.31 0.49 1.06 0.04 0.00 -1.53 0.26 103.07 103.70 1y8b h GLY 163 Ca 0.33 -0.14 -0.14 0.00 0.00 0.00 0.00 47.33 47.38 1y8b h GLY 163 CO -0.08 0.08 -0.34 -2.09 0.00 0.00 0.00 176.54 174.11 1y8b h GLU 164 N 0.34 0.84 0.00 4.80 4.81 -0.41 -2.32 114.58 122.64 1y8b h GLU 164 Ca 0.27 -0.44 -0.00 0.00 -0.13 0.00 0.00 59.36 59.06 1y8b h GLU 164 Cb 0.63 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 30.02 1y8b h GLU 164 CO -0.07 1.08 -0.01 1.96 -0.73 0.00 0.00 179.01 181.24 1y8b h GLN 165 N 0.64 0.00 0.11 1.92 4.20 -1.03 -3.24 115.11 117.70 1y8b h GLN 165 Ca 0.06 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.76 1y8b h GLN 165 Cb 0.92 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.70 1y8b h GLN 165 CO 0.08 0.01 -0.05 0.28 -0.67 0.00 0.00 178.83 178.49 1y8b h VAL 166 N 0.00 1.10 -0.31 -0.54 2.07 -0.19 -2.99 116.25 115.39 1y8b h VAL 166 Ca -0.00 -1.16 0.09 0.00 0.82 0.00 0.00 66.70 66.44 1y8b h VAL 166 Cb 0.76 1.79 -0.01 0.00 -1.52 0.00 0.00 31.29 32.31 1y8b h VAL 166 CO 0.00 0.26 0.50 0.16 0.02 0.00 0.00 177.57 178.52 1y8b h ILE 167 N -0.72 0.20 -0.08 4.57 3.07 -1.45 0.16 117.51 123.26 1y8b h ILE 167 Ca -0.01 0.00 -0.12 0.00 1.55 0.00 0.00 64.86 66.27 1y8b h ILE 167 Cb 0.54 0.57 0.01 0.00 -0.27 0.00 0.00 36.82 37.67 1y8b h ILE 167 CO 0.02 0.00 -0.43 0.00 -1.05 0.00 0.00 178.15 176.70 1y8b h ALA 168 N 1.29 0.15 0.72 0.16 0.00 -1.61 -1.74 119.26 118.23 1y8b h ALA 168 Ca 0.15 -0.48 -0.04 0.00 0.00 0.00 0.00 54.91 54.54 1y8b h ALA 168 Cb 1.15 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.94 1y8b h ALA 168 CO -0.00 0.29 -0.35 -1.49 0.00 0.00 0.00 179.25 177.70 1y8b h TRP 169 N -0.03 -0.90 -0.42 0.00 6.55 -0.66 -2.15 115.95 118.34 1y8b h TRP 169 Ca -0.03 -0.02 0.09 0.00 0.95 0.00 0.00 58.89 59.87 1y8b h TRP 169 Cb 1.08 0.30 -0.09 0.00 -0.86 0.00 0.00 29.16 29.59 1y8b h TRP 169 CO 0.12 -0.55 -0.18 0.28 -1.05 0.00 0.00 178.44 177.06 1y8b h VAL 170 N -1.22 0.43 -0.49 1.49 2.07 -1.52 -1.05 116.25 115.97 1y8b h VAL 170 Ca -0.10 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.51 1y8b h VAL 170 Cb 0.76 0.43 -0.10 0.00 -1.52 0.00 0.00 31.29 30.86 1y8b h VAL 170 CO 0.16 0.00 -0.31 -0.09 0.02 0.00 0.00 177.57 177.36 1y8b h ARG 171 N -0.10 -0.19 -0.79 1.57 1.12 -1.28 0.28 114.38 114.99 1y8b h ARG 171 Ca 0.20 0.01 0.17 0.00 -1.11 0.00 0.00 59.98 59.26 1y8b h ARG 171 Cb 0.41 0.04 -0.11 0.00 -0.01 0.00 0.00 29.97 30.31 1y8b h ARG 171 CO -0.49 -0.12 0.29 0.00 -3.11 0.00 0.00 179.97 176.54 1y8b h ARG 172 N -0.19 0.37 0.13 0.20 2.47 -0.51 -1.22 114.38 115.62 1y8b h ARG 172 Ca 0.21 -0.02 -0.01 0.00 -1.26 0.00 0.00 59.98 58.90 1y8b h ARG 172 Cb 0.53 -0.08 0.00 0.00 -1.65 0.00 0.00 29.97 28.77 1y8b h ARG 172 CO -0.59 0.25 -0.06 0.35 0.56 0.00 0.00 179.97 180.47 1y8b h PHE 173 N 0.38 -0.17 0.00 3.04 3.57 -0.09 -2.49 116.94 121.18 1y8b h PHE 173 Ca 0.46 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.95 1y8b h PHE 173 Cb 0.78 0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.57 1y8b h PHE 173 CO -0.19 0.17 0.34 -0.07 -2.23 0.00 0.00 178.31 176.33 1y8b h LEU 174 N -0.52 0.00 -0.07 0.59 3.38 0.38 0.46 115.31 119.53 1y8b h LEU 174 Ca -0.02 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.75 1y8b h LEU 174 Cb 0.41 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.13 1y8b h LEU 174 CO 0.03 0.00 -0.97 0.44 0.09 0.00 0.00 178.44 178.03 1y8b h ASP 175 N 0.00 0.01 0.08 -0.43 3.32 -0.79 -2.60 116.42 116.01 1y8b h ASP 175 Ca 0.00 -0.01 -0.34 0.00 0.02 0.00 0.00 57.03 56.70 1y8b h ASP 175 Cb 0.68 -0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.19 1y8b h ASP 175 CO 0.00 0.97 -1.92 -0.62 -1.72 0.00 0.00 179.24 175.95 1y8b n GLU 176 N -3.40 0.70 -0.19 3.56 4.71 0.15 -2.60 120.64 123.56 1y8b n GLU 176 Ca -0.00 0.32 -0.09 0.00 -0.01 0.00 0.00 57.16 57.38 1y8b n GLU 176 Cb 0.91 -1.68 0.02 0.00 -1.01 0.00 0.00 31.44 29.67 1y8b n GLU 176 CO 0.00 0.00 0.00 0.66 0.09 0.00 0.00 177.13 177.88 1y8b h SER 177 N -0.23 0.85 -2.21 1.62 4.64 -1.27 -3.36 113.55 113.59 1y8b h SER 177 Ca -0.44 -0.25 -0.58 0.00 -0.47 0.00 0.00 61.79 60.05 1y8b h SER 177 Cb 1.83 -0.22 -0.39 0.00 -0.31 0.00 0.00 62.40 63.31 1y8b h SER 177 CO -0.03 0.88 -1.00 0.18 -0.87 0.00 0.00 176.83 175.99 1y8b n LEU 178 N -4.38 0.25 -4.52 5.97 4.32 -0.98 -4.93 117.00 112.74 1y8b n LEU 178 Ca 0.02 -4.63 -0.29 0.00 -0.02 0.00 0.00 56.01 51.09 1y8b n LEU 178 Cb 0.25 0.46 0.24 0.00 -1.62 0.00 0.00 43.42 42.75 1y8b n LEU 178 CO 0.41 1.97 0.54 -2.84 -1.22 0.00 0.00 177.39 176.25 1y8b s PRO 179 N -0.77 -0.97 -0.01 3.23 0.02 -1.07 -4.60 135.00 130.83 1y8b s PRO 179 Ca 0.34 0.51 0.05 0.00 0.02 0.00 0.00 61.00 61.92 1y8b s PRO 179 Cb 0.11 -1.57 -0.01 0.00 0.02 0.00 0.00 34.50 33.04 1y8b s PRO 179 CO -0.14 -3.67 -0.16 -0.51 -0.33 0.00 0.00 177.00 172.19 1y8b s LEU 180 N -7.09 2.03 0.00 -5.54 1.43 -1.26 -4.10 118.68 104.15 1y8b s LEU 180 Ca 0.68 -0.28 0.00 0.00 -1.03 0.00 0.00 54.13 53.50 1y8b s LEU 180 Cb -0.20 -0.80 0.00 0.00 0.03 0.00 0.00 46.19 45.22 1y8b s LEU 180 CO 0.61 0.19 0.58 -1.84 0.23 0.00 0.00 176.35 176.12 1y8b n GLU 181 N 2.70 0.94 0.00 1.70 0.28 -1.10 -3.97 120.64 121.18 1y8b n GLU 181 Ca -0.14 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.86 1y8b n GLU 181 Cb 0.55 -1.35 0.00 0.00 1.43 0.00 0.00 31.44 32.06 1y8b n GLU 181 CO 0.00 0.00 0.00 -1.71 -0.16 0.00 0.00 177.13 175.26 1y8b n ASN 182 N -0.10 0.06 0.00 -1.84 5.15 -1.26 -4.93 115.26 112.34 1y8b n ASN 182 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 1y8b n ASN 182 Cb 0.18 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.43 1y8b n ASN 182 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1y8b n GLY 183 N 1.76 4.66 1.44 8.20 0.00 -1.25 -5.16 105.19 114.84 1y8b n GLY 183 Ca 0.00 -0.51 -0.12 0.00 0.00 0.00 0.00 46.02 45.39 1y8b n GLY 183 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1y8b n SER 184 N 0.00 2.13 0.07 1.61 3.41 -1.26 -4.07 113.62 115.51 1y8b n SER 184 Ca 0.00 -1.90 0.13 0.00 -0.26 0.00 0.00 58.87 56.85 1y8b n SER 184 Cb 0.00 0.23 0.48 0.00 -0.26 0.00 0.00 64.21 64.65 1y8b n SER 184 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1y8b n TYR 185 N -0.47 0.61 0.05 7.33 9.36 -1.26 -3.41 117.16 129.38 1y8b n TYR 185 Ca -0.07 0.18 -0.03 0.00 3.32 0.00 0.00 57.90 61.30 1y8b n TYR 185 Cb 0.26 -0.79 0.21 0.00 -0.63 0.00 0.00 39.34 38.38 1y8b n TYR 185 CO 0.00 0.00 0.00 1.96 0.22 0.00 0.00 176.86 179.04 1y8b h GLN 186 N 0.00 0.37 0.00 2.98 4.20 -1.95 -2.82 115.11 117.89 1y8b h GLN 186 Ca 0.00 -0.16 0.00 0.00 0.06 0.00 0.00 58.65 58.55 1y8b h GLN 186 Cb 0.65 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.41 1y8b h GLN 186 CO 0.00 0.67 -0.72 0.38 -0.67 0.00 0.00 178.83 178.49 1y8b h ASP 187 N 0.32 0.00 -3.19 1.46 2.03 -1.96 -3.47 116.42 111.61 1y8b h ASP 187 Ca 0.04 -0.07 -0.47 0.00 -0.73 0.00 0.00 57.03 55.80 1y8b h ASP 187 Cb 0.75 0.00 0.22 0.00 -0.83 0.00 0.00 39.33 39.47 1y8b h ASP 187 CO 0.06 0.03 -0.30 0.52 -1.03 0.00 0.00 179.24 178.52 1y8b n VAL 188 N -2.55 0.00 0.00 4.15 0.31 -1.07 0.32 118.33 119.49 1y8b n VAL 188 Ca 0.02 -0.31 0.00 0.00 -0.01 0.00 0.00 64.34 64.04 1y8b n VAL 188 Cb 0.51 -0.86 0.00 0.00 -0.91 0.00 0.00 33.84 32.58 1y8b n VAL 188 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 1y8b n VAL 189 N -4.59 0.00 -3.56 2.52 0.24 -0.49 -4.48 118.33 107.97 1y8b n VAL 189 Ca 0.04 0.00 -0.09 0.00 -2.04 0.00 0.00 64.34 62.25 1y8b n VAL 189 Cb 0.56 -0.30 -0.02 0.00 -1.47 0.00 0.00 33.84 32.60 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 -1.69 -1.59 0.20 2.33 0.00 -1.26 -4.00 121.76 115.74 1y8b s ALA 190 Ca 0.00 0.42 0.11 0.00 0.00 0.00 0.00 51.96 52.49 1y8b s ALA 190 Cb 0.00 0.74 -0.04 0.00 0.00 0.00 0.00 23.12 23.81 1y8b s ALA 190 CO 0.00 -0.83 -0.20 -0.06 0.00 0.00 0.00 175.76 174.67 1y8b s PHE 191 N -3.57 2.39 0.09 0.00 0.08 -1.26 -3.56 117.98 112.15 1y8b s PHE 191 Ca 0.05 -0.32 -0.02 0.00 0.12 0.00 0.00 56.93 56.76 1y8b s PHE 191 Cb -0.02 -1.17 -0.03 0.00 -0.57 0.00 0.00 43.02 41.23 1y8b s PHE 191 CO -0.06 0.52 0.05 0.15 -0.10 0.00 0.00 175.22 175.77 1y8b s LYS 192 N -2.76 0.79 -0.50 0.44 1.02 -1.26 -4.79 119.74 112.69 1y8b s LYS 192 Ca 0.22 -1.27 -0.18 0.00 0.02 0.00 0.00 55.97 54.77 1y8b s LYS 192 Cb -0.08 0.25 0.07 0.00 -0.52 0.00 0.00 37.83 37.55 1y8b s LYS 192 CO 0.12 -0.21 0.54 0.08 -0.92 0.00 0.00 175.35 174.96 1y8b s VAL 193 N -3.96 5.01 0.11 3.17 1.01 -0.42 -1.83 120.40 123.49 1y8b s VAL 193 Ca 0.14 -0.76 0.06 0.00 0.00 0.00 0.00 61.98 61.42 1y8b s VAL 193 Cb 0.07 -4.25 -0.04 0.00 0.00 0.00 0.00 36.38 32.16 1y8b s VAL 193 CO -0.05 -0.75 -0.04 -0.69 0.00 0.00 0.00 175.10 173.57 1y8b s VAL 194 N 2.25 3.69 -1.00 2.92 1.01 -0.62 -4.70 120.40 123.94 1y8b s VAL 194 Ca 0.11 -1.20 0.00 0.00 0.00 0.00 0.00 61.98 60.88 1y8b s VAL 194 Cb -0.22 -2.77 0.00 0.00 0.00 0.00 0.00 36.38 33.40 1y8b s VAL 194 CO 0.09 0.06 0.05 -0.67 0.00 0.00 0.00 175.10 174.64 1y8b n ASP 195 N 0.47 0.00 0.05 3.32 2.03 -1.26 -1.44 116.55 119.72 1y8b n ASP 195 Ca -0.12 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.19 1y8b n ASP 195 Cb 0.53 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.93 1y8b n ASP 195 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 1y8b n LYS 196 N -0.35 0.00 0.00 -0.67 4.81 -1.26 -5.16 118.16 115.52 1y8b n LYS 196 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1y8b n LYS 196 Cb 0.00 -0.35 0.00 0.00 0.02 0.00 0.00 35.03 34.70 1y8b n LYS 196 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 1y8b n GLN 197 N -3.25 0.00 -2.26 1.64 6.02 -0.52 -5.11 117.38 113.90 1y8b n GLN 197 Ca 0.00 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.56 1y8b n GLN 197 Cb 0.13 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.37 1y8b n GLN 197 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1y8b s LEU 198 N 0.00 4.25 -0.93 1.08 1.02 -1.24 -1.59 118.68 121.27 1y8b s LEU 198 Ca 0.00 1.94 -0.24 0.00 0.02 0.00 0.00 54.13 55.85 1y8b s LEU 198 Cb 0.00 -3.54 -0.02 0.00 0.02 0.00 0.00 46.19 42.65 1y8b s LEU 198 CO 0.00 -0.80 1.82 -0.60 0.02 0.00 0.00 176.35 176.79 1y8b s ARG 199 N 3.41 2.83 -0.52 1.70 6.06 -0.76 -4.73 118.95 126.93 1y8b s ARG 199 Ca 0.62 -0.51 -0.28 0.00 -2.50 0.00 0.00 55.73 53.07 1y8b s ARG 199 Cb -0.27 -5.14 0.01 0.00 0.06 0.00 0.00 34.95 29.61 1y8b s ARG 199 CO 0.22 -3.07 1.46 0.42 -2.50 0.00 0.00 175.30 171.83 1y8b s ILE 200 N 8.75 3.77 -0.16 4.11 -1.09 -1.26 -4.01 121.20 131.31 1y8b s ILE 200 Ca 0.64 0.69 -0.06 0.00 -2.23 0.00 0.00 60.65 59.68 1y8b s ILE 200 Cb -0.05 -4.32 -0.04 0.00 -1.58 0.00 0.00 42.46 36.48 1y8b s ILE 200 CO -0.03 -1.02 0.05 0.00 -1.23 0.00 0.00 174.94 172.71 1y8b s GLN 201 N 5.48 3.75 0.21 2.79 -2.07 -1.23 -2.23 119.66 126.36 1y8b s GLN 201 Ca 0.57 -0.34 0.03 0.00 -1.82 0.00 0.00 55.36 53.79 1y8b s GLN 201 Cb -0.12 -3.13 -0.03 0.00 -1.09 0.00 0.00 33.01 28.64 1y8b s GLN 201 CO 0.27 0.39 0.35 -0.51 -1.32 0.00 0.00 175.29 174.47 1y8b s LEU 202 N 0.02 4.29 0.00 2.60 1.43 -0.31 -1.39 118.68 125.33 1y8b s LEU 202 Ca 0.05 0.17 0.00 0.00 -1.03 0.00 0.00 54.13 53.32 1y8b s LEU 202 Cb -0.12 -2.94 0.00 0.00 0.03 0.00 0.00 46.19 43.16 1y8b s LEU 202 CO 0.01 -0.04 0.51 1.17 0.23 0.00 0.00 176.35 178.23 1y8b n LYS 203 N -1.06 0.00 -0.10 1.70 3.00 0.94 0.77 118.16 123.42 1y8b n LYS 203 Ca -0.08 0.11 0.07 0.00 -0.00 0.00 0.00 58.31 58.42 1y8b n LYS 203 Cb 0.56 -1.55 0.12 0.00 0.00 0.00 0.00 35.03 34.16 1y8b n LYS 203 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1y8b n ASN 204 N -1.01 2.63 0.00 3.14 3.02 -1.26 -4.93 115.26 116.84 1y8b n ASN 204 Ca 0.00 -1.77 0.00 0.00 -0.03 0.00 0.00 54.58 52.78 1y8b n ASN 204 Cb 0.05 -0.13 0.00 0.00 -0.61 0.00 0.00 39.78 39.09 1y8b n ASN 204 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1y8b n GLY 205 N 0.82 0.72 3.85 7.41 0.00 0.23 -5.01 105.19 113.21 1y8b n GLY 205 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 1y8b n GLY 205 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1y8b s LYS 206 N -0.02 3.98 -0.02 1.61 -0.14 -1.25 -4.79 119.74 119.10 1y8b s LYS 206 Ca 0.00 0.56 -0.01 0.00 -1.36 0.00 0.00 55.97 55.16 1y8b s LYS 206 Cb 0.00 -2.64 -0.04 0.00 -1.68 0.00 0.00 37.83 33.47 1y8b s LYS 206 CO 0.00 0.29 0.09 -1.83 -0.76 0.00 0.00 175.35 173.14 1y8b s GLU 207 N -2.60 3.12 0.29 1.68 -1.05 -1.26 -1.16 118.70 117.71 1y8b s GLU 207 Ca 0.48 -0.43 0.03 0.00 -0.15 0.00 0.00 54.97 54.90 1y8b s GLU 207 Cb -0.12 -2.90 -0.04 0.00 -0.44 0.00 0.00 34.13 30.63 1y8b s GLU 207 CO 0.19 0.67 0.19 -0.08 0.95 0.00 0.00 175.26 177.18 1y8b s THR 208 N -1.16 0.14 0.23 1.83 -1.32 -0.95 -4.96 115.64 109.46 1y8b s THR 208 Ca 0.21 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 58.70 1y8b s THR 208 Cb -0.12 -2.50 -0.04 0.00 -1.51 0.00 0.00 72.50 68.33 1y8b s THR 208 CO 0.12 0.00 0.13 0.42 -2.21 0.00 0.00 174.62 173.08 1y8b s THR 209 N -3.69 0.22 0.02 5.08 -4.23 -1.26 -4.09 115.64 107.69 1y8b s THR 209 Ca 0.38 -2.00 -0.23 0.00 -1.18 0.00 0.00 61.69 58.66 1y8b s THR 209 Cb 0.05 -2.55 -0.05 0.00 1.34 0.00 0.00 72.50 71.28 1y8b s THR 209 CO 0.19 0.00 0.68 -0.76 -0.54 0.00 0.00 174.62 174.20 1y8b s LEU 210 N -3.24 4.43 0.24 4.79 1.43 -1.26 -2.72 118.68 122.35 1y8b s LEU 210 Ca 0.38 1.31 -0.09 0.00 -1.03 0.00 0.00 54.13 54.70 1y8b s LEU 210 Cb 0.07 -3.08 0.38 0.00 0.03 0.00 0.00 46.19 43.59 1y8b s LEU 210 CO 0.14 0.06 1.62 0.08 0.23 0.00 0.00 176.35 178.47 1y8b h ARG 211 N 5.66 0.04 -4.97 1.70 0.11 -1.94 -3.35 114.38 111.63 1y8b h ARG 211 Ca -0.44 -0.00 -0.66 0.00 0.10 0.00 0.00 59.98 58.97 1y8b h ARG 211 Cb 1.20 -0.01 -0.36 0.00 1.11 0.00 0.00 29.97 31.92 1y8b h ARG 211 CO 0.70 0.03 -0.84 0.95 0.10 0.00 0.00 179.97 180.91 1y8b s THR 212 N -6.18 2.03 -0.73 0.08 -4.23 -1.26 -4.99 115.64 100.36 1y8b s THR 212 Ca -0.14 -1.08 0.26 0.00 -1.18 0.00 0.00 61.69 59.55 1y8b s THR 212 Cb 0.22 -1.92 0.27 0.00 1.34 0.00 0.00 72.50 72.41 1y8b s THR 212 CO 0.75 0.39 1.78 -0.81 -0.54 0.00 0.00 174.62 176.19 1y8b n PRO 213 N 4.59 0.21 0.00 3.99 -0.04 -1.26 -3.43 135.00 139.06 1y8b n PRO 213 Ca -0.19 0.22 0.03 0.00 -0.04 0.00 0.00 63.50 63.52 1y8b n PRO 213 Cb 0.48 -1.77 0.16 0.00 -0.04 0.00 0.00 33.50 32.33 1y8b n PRO 213 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1y8b n ALA 214 N -1.74 1.71 0.05 0.55 0.00 -1.26 -1.36 120.51 118.46 1y8b n ALA 214 Ca 0.05 -0.03 -0.01 0.00 0.00 0.00 0.00 53.44 53.45 1y8b n ALA 214 Cb 0.38 -1.09 -0.07 0.00 0.00 0.00 0.00 19.45 18.67 1y8b n ALA 214 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1y8b h GLN 215 N 0.00 0.00 -6.58 0.00 4.20 -1.74 -3.44 115.11 107.54 1y8b h GLN 215 Ca 0.00 0.00 -0.57 0.00 0.06 0.00 0.00 58.65 58.14 1y8b h GLN 215 Cb 0.00 0.00 -0.08 0.00 0.30 0.00 0.00 27.48 27.70 1y8b h GLN 215 CO 0.00 0.42 0.85 0.12 -0.67 0.00 0.00 178.83 179.55 1y8b s PHE 216 N -2.87 2.84 -0.07 2.96 5.36 -0.46 0.14 117.98 125.88 1y8b s PHE 216 Ca -0.01 0.64 -0.05 0.00 -0.96 0.00 0.00 56.93 56.54 1y8b s PHE 216 Cb 0.08 -4.33 -0.02 0.00 -0.34 0.00 0.00 43.02 38.42 1y8b s PHE 216 CO 0.80 -1.23 -0.10 0.28 -1.46 0.00 0.00 175.22 173.50 1y8b n VAL 217 N 6.74 0.70 -2.72 3.12 0.31 -1.16 -4.83 118.33 120.49 1y8b n VAL 217 Ca 0.11 0.35 0.00 0.00 -0.01 0.00 0.00 64.34 64.79 1y8b n VAL 217 Cb 0.49 -1.93 0.00 0.00 -0.91 0.00 0.00 33.84 31.49 1y8b n VAL 217 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1y8b n GLY 218 N 1.64 3.53 3.85 2.92 0.00 -1.26 -0.33 105.19 115.55 1y8b n GLY 218 Ca -0.04 -1.10 -0.05 0.00 0.00 0.00 0.00 46.02 44.82 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 -3.51 0.09 0.12 1.61 1.13 0.51 -1.91 117.35 115.39 1y8b s TYR 219 Ca 0.00 -0.61 0.04 0.00 -1.41 0.00 0.00 57.07 55.09 1y8b s TYR 219 Cb 0.00 0.76 -0.04 0.00 -1.10 0.00 0.00 41.96 41.58 1y8b s TYR 219 CO 0.00 -1.19 -0.10 0.50 -2.51 0.00 0.00 175.55 172.25 1y8b s ARG 220 N -2.21 0.93 0.58 -3.49 3.52 -1.09 0.21 118.95 117.40 1y8b s ARG 220 Ca 0.19 -1.28 0.00 0.00 -0.13 0.00 0.00 55.73 54.51 1y8b s ARG 220 Cb -0.04 -0.56 0.00 0.00 -1.56 0.00 0.00 34.95 32.79 1y8b s ARG 220 CO 0.08 0.08 0.00 0.41 -0.81 0.00 0.00 175.30 175.05 1y8b n GLY 221 N 0.24 -1.85 3.85 8.12 0.00 -1.26 -1.33 105.19 112.95 1y8b n GLY 221 Ca -0.14 -1.74 -0.32 0.00 0.00 0.00 0.00 46.02 43.83 1y8b n GLY 221 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1y8b s ASP 222 N -4.00 6.39 0.46 1.61 2.15 -1.15 -4.78 116.67 117.35 1y8b s ASP 222 Ca 0.00 1.54 0.15 0.00 0.43 0.00 0.00 52.55 54.67 1y8b s ASP 222 Cb 0.00 -2.50 1.10 0.00 -0.30 0.00 0.00 42.92 41.22 1y8b s ASP 222 CO 0.00 -0.75 2.03 0.00 -0.17 0.00 0.00 175.17 176.28 1y8b h ALA 223 N 0.44 2.02 -0.58 3.66 0.00 -1.91 0.23 119.26 123.12 1y8b h ALA 223 Ca -0.46 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1y8b h ALA 223 Cb 1.19 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1y8b h ALA 223 CO 0.61 -0.11 0.00 0.00 0.00 0.00 0.00 179.25 179.75 1y8b n ALA 224 N -2.53 2.40 -2.73 0.00 0.00 -1.26 -1.31 120.51 115.08 1y8b n ALA 224 Ca 0.06 -1.11 -0.09 0.00 0.00 0.00 0.00 53.44 52.30 1y8b n ALA 224 Cb 0.29 -0.94 0.06 0.00 0.00 0.00 0.00 19.45 18.86 1y8b n ALA 224 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1y8b n ALA 225 N 1.44 2.29 -1.55 0.00 0.00 0.71 -5.00 120.51 118.39 1y8b n ALA 225 Ca 0.22 -2.45 -0.14 0.00 0.00 0.00 0.00 53.44 51.06 1y8b n ALA 225 Cb 0.57 -0.97 -0.09 0.00 0.00 0.00 0.00 19.45 18.95 1y8b n ALA 225 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1y8b n PRO 226 N -0.17 0.48 -0.32 0.00 -0.04 -0.56 -2.92 135.00 131.46 1y8b n PRO 226 Ca 0.07 -0.75 0.19 0.00 -0.04 0.00 0.00 63.50 62.97 1y8b n PRO 226 Cb 0.81 -3.33 0.40 0.00 -0.04 0.00 0.00 33.50 31.34 1y8b n PRO 226 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 1y8b h THR 227 N 7.59 0.36 -3.86 0.52 2.02 -1.49 -3.42 112.91 114.63 1y8b h THR 227 Ca 0.01 -0.12 -0.10 0.00 0.77 0.00 0.00 66.41 66.97 1y8b h THR 227 Cb 1.02 -0.02 -0.12 0.00 -1.74 0.00 0.00 68.15 67.29 1y8b h THR 227 CO 1.09 0.06 -0.29 0.00 0.37 0.00 0.00 175.52 176.75 1y8b s ILE 229 N -3.97 0.95 -0.14 0.00 -4.36 -1.24 -2.69 121.20 109.75 1y8b s ILE 229 Ca 0.18 -0.96 -0.02 0.00 -0.26 0.00 0.00 60.65 59.58 1y8b s ILE 229 Cb 0.03 -0.88 -0.03 0.00 1.25 0.00 0.00 42.46 42.83 1y8b s ILE 229 CO 0.01 -0.07 -0.06 -0.22 0.24 0.00 0.00 174.94 174.85 1y8b s LEU 230 N -1.16 3.16 0.06 0.37 2.96 -0.80 -3.54 118.68 119.72 1y8b s LEU 230 Ca -0.01 -0.14 0.02 0.00 -0.22 0.00 0.00 54.13 53.79 1y8b s LEU 230 Cb -0.08 -1.74 -0.03 0.00 0.50 0.00 0.00 46.19 44.84 1y8b s LEU 230 CO 0.01 0.20 -0.07 -0.76 -1.32 0.00 0.00 176.35 174.41 1y8b s LEU 231 N 0.15 2.34 -0.04 -0.68 1.43 0.14 -2.97 118.68 119.04 1y8b s LEU 231 Ca -0.02 -0.69 0.02 0.00 -1.03 0.00 0.00 54.13 52.41 1y8b s LEU 231 Cb -0.14 -0.13 0.01 0.00 0.03 0.00 0.00 46.19 45.96 1y8b s LEU 231 CO 0.03 -0.29 -0.10 -0.75 0.23 0.00 0.00 176.35 175.47 1y8b s LYS 232 N -2.29 1.29 0.16 1.70 2.20 0.37 0.11 119.74 123.28 1y8b s LYS 232 Ca -0.03 -0.35 -0.24 0.00 -0.36 0.00 0.00 55.97 54.99 1y8b s LYS 232 Cb -0.05 -1.14 0.06 0.00 -1.51 0.00 0.00 37.83 35.19 1y8b s LYS 232 CO -0.01 0.07 0.72 1.21 -0.36 0.00 0.00 175.35 176.98 1y8b s ASN 233 N 0.45 -0.41 -0.21 1.43 3.04 -0.72 -4.30 114.94 114.21 1y8b s ASN 233 Ca -0.09 -0.19 0.00 0.00 0.04 0.00 0.00 52.86 52.63 1y8b s ASN 233 Cb -0.12 0.58 0.00 0.00 -1.54 0.00 0.00 41.25 40.16 1y8b s ASN 233 CO 0.02 -0.99 0.00 0.59 -3.04 0.00 0.00 177.10 173.68 1y8b n ASN 234 N -0.38 -2.07 0.00 -4.21 4.13 -1.26 0.11 115.26 111.58 1y8b n ASN 234 Ca -0.11 0.05 0.00 0.00 1.68 0.00 0.00 54.58 56.20 1y8b n ASN 234 Cb 0.62 -1.69 0.00 0.00 -1.54 0.00 0.00 39.78 37.17 1y8b n ASN 234 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1y8b n GLY 235 N 0.22 2.46 3.90 7.41 0.00 -1.26 -4.12 105.19 113.80 1y8b n GLY 235 Ca -0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.67 1y8b n GLY 235 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1y8b s LEU 236 N 0.00 4.36 0.18 0.99 2.34 0.31 -4.44 118.68 122.43 1y8b s LEU 236 Ca 0.00 0.40 -0.30 0.00 0.06 0.00 0.00 54.13 54.29 1y8b s LEU 236 Cb 0.00 -2.72 -0.08 0.00 -0.56 0.00 0.00 46.19 42.83 1y8b s LEU 236 CO 0.00 0.23 1.01 -1.00 -1.06 0.00 0.00 176.35 175.54 1y8b s HIS 237 N -1.37 3.76 -0.14 3.48 3.76 -1.26 -1.75 115.29 121.78 1y8b s HIS 237 Ca 0.29 1.76 0.01 0.00 -0.15 0.00 0.00 55.06 56.97 1y8b s HIS 237 Cb -0.13 -3.13 0.02 0.00 1.11 0.00 0.00 32.58 30.45 1y8b s HIS 237 CO 0.20 -0.07 -0.16 0.42 -0.85 0.00 0.00 174.74 174.28 1y8b s ILE 238 N -0.50 1.69 -0.08 0.60 1.01 0.30 -2.23 121.20 121.99 1y8b s ILE 238 Ca 0.46 -0.73 0.01 0.00 0.00 0.00 0.00 60.65 60.39 1y8b s ILE 238 Cb -0.27 -1.55 0.02 0.00 0.01 0.00 0.00 42.46 40.67 1y8b s ILE 238 CO 0.33 0.48 -0.09 -1.61 0.00 0.00 0.00 174.94 174.05 1y8b s GLU 239 N 1.20 1.51 -0.16 2.79 8.01 0.13 0.27 118.70 132.45 1y8b s GLU 239 Ca -0.00 -0.31 -0.18 0.00 0.01 0.00 0.00 54.97 54.48 1y8b s GLU 239 Cb -0.14 -1.38 -0.04 0.00 -4.31 0.00 0.00 34.13 28.26 1y8b s GLU 239 CO -0.07 -0.09 0.50 -0.51 0.01 0.00 0.00 175.26 175.10 1y8b s LEU 240 N 1.06 4.21 -0.22 1.80 1.43 -1.23 -0.98 118.68 124.74 1y8b s LEU 240 Ca -0.07 0.74 -0.11 0.00 -1.03 0.00 0.00 54.13 53.65 1y8b s LEU 240 Cb -0.14 -2.70 -0.05 0.00 0.03 0.00 0.00 46.19 43.32 1y8b s LEU 240 CO -0.01 -0.10 0.19 -1.58 0.23 0.00 0.00 176.35 175.08 1y8b s GLN 241 N 1.17 4.13 0.53 1.70 2.00 -0.66 -3.67 119.66 124.86 1y8b s GLN 241 Ca 0.25 -0.17 -0.18 0.00 -2.00 0.00 0.00 55.36 53.26 1y8b s GLN 241 Cb -0.15 -3.49 -0.07 0.00 0.80 0.00 0.00 33.01 30.10 1y8b s GLN 241 CO 0.10 0.14 1.03 0.42 -0.50 0.00 0.00 175.29 176.47 1y8b s ILE 242 N 0.83 4.03 -0.46 -2.34 -1.09 -1.26 -1.99 121.20 118.92 1y8b s ILE 242 Ca 0.10 1.07 -0.34 0.00 -2.23 0.00 0.00 60.65 59.24 1y8b s ILE 242 Cb -0.13 -3.50 -0.16 0.00 -1.58 0.00 0.00 42.46 37.10 1y8b s ILE 242 CO 0.03 -0.46 1.78 -0.67 -1.23 0.00 0.00 174.94 174.39 1y8b n ASP 243 N -1.52 0.55 0.00 3.58 -0.08 -1.25 -4.69 116.55 113.13 1y8b n ASP 243 Ca 0.08 0.49 0.00 0.00 -1.51 0.00 0.00 54.79 53.85 1y8b n ASP 243 Cb 0.53 -0.73 0.00 0.00 2.34 0.00 0.00 41.12 43.27 1y8b n ASP 243 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1y8b n ALA 244 N 6.37 1.35 0.00 -1.67 0.00 -1.26 -4.97 120.51 120.33 1y8b n ALA 244 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.89 1y8b n ALA 244 Cb -0.02 0.02 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1y8b n ALA 244 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1y8b n ASN 245 N -1.04 0.00 -4.64 0.00 2.85 -1.26 -5.13 115.26 106.03 1y8b n ASN 245 Ca 0.00 0.00 -0.41 0.00 -0.11 0.00 0.00 54.58 54.06 1y8b n ASN 245 Cb 0.04 0.00 0.01 0.00 1.24 0.00 0.00 39.78 41.07 1y8b n ASN 245 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1y8b n GLY 246 N -0.16 0.05 0.07 8.20 0.00 -1.26 -4.92 105.19 107.17 1y8b n GLY 246 Ca 0.00 0.18 -0.15 0.00 0.00 0.00 0.00 46.02 46.05 1y8b n GLY 246 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1y8b h ARG 247 N 1.77 0.04 -1.06 1.61 9.65 -2.00 -3.23 114.38 121.17 1y8b h ARG 247 Ca -0.45 -0.06 0.31 0.00 -1.10 0.00 0.00 59.98 58.68 1y8b h ARG 247 Cb 1.32 0.02 -0.04 0.00 -1.39 0.00 0.00 29.97 29.88 1y8b h ARG 247 CO 0.58 0.97 0.90 0.97 2.80 0.00 0.00 179.97 186.19 1y8b h ILE 248 N -0.85 0.27 0.00 1.20 6.09 -1.95 0.41 117.51 122.67 1y8b h ILE 248 Ca -0.01 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.48 1y8b h ILE 248 Cb 1.01 0.33 0.00 0.00 0.47 0.00 0.00 36.82 38.63 1y8b h ILE 248 CO 0.02 0.00 0.29 0.61 -3.07 0.00 0.00 178.15 176.00 1y8b n GLY 249 N -1.71 -0.45 0.07 8.18 0.00 -1.22 -1.08 105.19 108.97 1y8b n GLY 249 Ca 0.23 0.06 -0.09 0.00 0.00 0.00 0.00 46.02 46.22 1y8b n GLY 249 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1y8b h LYS 250 N 0.00 0.00 -1.64 1.61 1.79 -0.42 -3.30 116.57 114.61 1y8b h LYS 250 Ca 0.00 0.00 -0.06 0.00 -2.18 0.00 0.00 60.65 58.41 1y8b h LYS 250 Cb 0.59 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.21 1y8b h LYS 250 CO 0.00 0.61 0.08 -3.47 -1.08 0.00 0.00 179.45 175.60 1y8b n ASP 251 N -4.65 4.87 -4.16 0.86 -0.08 -0.24 -4.74 116.55 108.40 1y8b n ASP 251 Ca -0.08 -2.44 -0.34 0.00 -1.51 0.00 0.00 54.79 50.42 1y8b n ASP 251 Cb 0.32 -0.95 -0.14 0.00 2.34 0.00 0.00 41.12 42.70 1y8b n ASP 251 CO 0.00 0.00 0.00 -1.81 0.12 0.00 0.00 177.20 175.51 1y8b s ASP 252 N 1.37 4.77 0.39 1.67 1.01 -1.17 -4.97 116.67 119.75 1y8b s ASP 252 Ca 0.06 -1.26 0.24 0.00 0.71 0.00 0.00 52.55 52.30 1y8b s ASP 252 Cb 0.05 -1.68 0.53 0.00 1.01 0.00 0.00 42.92 42.83 1y8b s ASP 252 CO 0.00 -0.24 1.68 1.55 0.21 0.00 0.00 175.17 178.37 1y8b h PRO 253 N 7.96 0.00 0.00 8.23 0.13 -1.90 -3.11 132.00 143.31 1y8b h PRO 253 Ca -0.22 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.91 1y8b h PRO 253 Cb 1.06 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.19 1y8b h PRO 253 CO 0.52 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.29 1y8b n ALA 254 N -2.02 2.43 0.00 -0.56 0.00 -1.26 -4.85 120.51 114.25 1y8b n ALA 254 Ca 0.04 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1y8b n ALA 254 Cb 0.49 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.46 1y8b n ALA 254 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1y8b n HIS 255 N -1.30 0.00 -1.95 0.00 -0.00 -1.18 -4.25 115.22 106.54 1y8b n HIS 255 Ca 0.13 0.00 -0.33 0.00 0.46 0.00 0.00 57.72 57.98 1y8b n HIS 255 Cb 0.24 0.00 0.03 0.00 -0.12 0.00 0.00 29.99 30.14 1y8b n HIS 255 CO 0.00 0.00 0.00 0.42 0.46 0.00 0.00 176.34 177.22 1y8b s ILE 256 N -0.77 3.39 0.00 3.57 1.09 -1.26 -3.89 121.20 123.33 1y8b s ILE 256 Ca 0.00 0.69 0.00 0.00 -1.10 0.00 0.00 60.65 60.24 1y8b s ILE 256 Cb 0.00 -3.22 0.00 0.00 -1.06 0.00 0.00 42.46 38.18 1y8b s ILE 256 CO 0.00 -0.35 0.00 -3.20 -0.10 0.00 0.00 174.94 171.29 1y8b n ASN 257 N -2.06 0.00 -4.78 3.58 4.05 -0.84 -4.76 115.26 110.46 1y8b n ASN 257 Ca 0.10 0.00 -0.39 0.00 0.45 0.00 0.00 54.58 54.74 1y8b n ASN 257 Cb 0.52 0.00 -0.06 0.00 1.23 0.00 0.00 39.78 41.47 1y8b n ASN 257 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 1y8b s ASP 258 N 1.00 7.30 -0.23 1.20 -1.08 -1.18 -4.77 116.67 118.91 1y8b s ASP 258 Ca 0.00 1.54 -0.10 0.00 -0.52 0.00 0.00 52.55 53.47 1y8b s ASP 258 Cb 0.00 -2.47 -0.05 0.00 -1.46 0.00 0.00 42.92 38.94 1y8b s ASP 258 CO 0.00 0.18 0.14 -0.69 0.52 0.00 0.00 175.17 175.32 1y8b s VAL 259 N -0.93 5.22 -0.27 1.11 1.01 -1.26 -1.66 120.40 123.63 1y8b s VAL 259 Ca 0.35 0.13 -0.05 0.00 0.00 0.00 0.00 61.98 62.41 1y8b s VAL 259 Cb -0.22 -3.42 0.01 0.00 0.00 0.00 0.00 36.38 32.75 1y8b s VAL 259 CO 0.24 0.37 0.03 -0.63 0.00 0.00 0.00 175.10 175.12 1y8b s ILE 260 N 0.91 3.69 0.05 2.22 1.09 -0.16 -3.42 121.20 125.59 1y8b s ILE 260 Ca 0.07 -0.68 0.01 0.00 -1.10 0.00 0.00 60.65 58.95 1y8b s ILE 260 Cb -0.13 -2.85 -0.03 0.00 -1.06 0.00 0.00 42.46 38.39 1y8b s ILE 260 CO 0.03 0.18 -0.06 0.68 -0.10 0.00 0.00 174.94 175.67 1y8b s VAL 261 N 1.47 0.41 -0.60 2.92 -7.23 -1.26 0.18 120.40 116.29 1y8b s VAL 261 Ca 0.03 -1.26 -0.27 0.00 -1.81 0.00 0.00 61.98 58.66 1y8b s VAL 261 Cb -0.16 -0.80 -0.01 0.00 0.56 0.00 0.00 36.38 35.97 1y8b s VAL 261 CO 0.00 -0.57 1.68 -1.61 -0.31 0.00 0.00 175.10 174.29 1y8b s GLU 262 N -2.21 2.90 0.08 4.82 0.41 -0.95 -3.53 118.70 120.23 1y8b s GLU 262 Ca -0.06 0.52 -0.28 0.00 -0.41 0.00 0.00 54.97 54.74 1y8b s GLU 262 Cb -0.05 -4.29 -0.17 0.00 -1.78 0.00 0.00 34.13 27.84 1y8b s GLU 262 CO -0.02 -2.42 1.68 0.00 -0.49 0.00 0.00 175.26 174.02 1y8b h ALA 263 N 13.27 -0.44 -3.49 5.21 0.00 -0.60 -3.38 119.26 129.82 1y8b h ALA 263 Ca -0.27 -0.10 -0.68 0.00 0.00 0.00 0.00 54.91 53.86 1y8b h ALA 263 Cb 1.13 0.18 -0.36 0.00 0.00 0.00 0.00 17.79 18.74 1y8b h ALA 263 CO 1.20 -0.75 -0.67 0.00 0.00 0.00 0.00 179.25 179.03 1y8b s ALA 264 N -6.12 2.90 0.55 0.00 0.00 -1.24 -3.66 121.76 114.19 1y8b s ALA 264 Ca -0.15 -2.17 0.35 0.00 0.00 0.00 0.00 51.96 49.99 1y8b s ALA 264 Cb 0.05 -2.04 1.51 0.00 0.00 0.00 0.00 23.12 22.64 1y8b s ALA 264 CO 0.64 -1.51 1.79 0.97 0.00 0.00 0.00 175.76 177.64 1y8b h ILE 265 N 6.51 0.37 -2.37 0.00 6.09 -1.74 -3.41 117.51 122.97 1y8b h ILE 265 Ca -0.14 0.00 -0.08 0.00 -1.37 0.00 0.00 64.86 63.27 1y8b h ILE 265 Cb 1.04 0.41 -0.20 0.00 0.47 0.00 0.00 36.82 38.54 1y8b h ILE 265 CO 0.57 0.00 0.01 -0.55 -3.07 0.00 0.00 178.15 175.11 1y8b s SER 266 N -5.06 -0.51 -0.02 2.19 0.15 -1.26 -2.49 113.70 106.69 1y8b s SER 266 Ca -0.05 0.64 0.04 0.00 0.70 0.00 0.00 55.95 57.28 1y8b s SER 266 Cb 0.22 0.62 -0.01 0.00 -1.71 0.00 0.00 66.02 65.14 1y8b s SER 266 CO 0.75 -0.47 -0.14 0.28 1.20 0.00 0.00 173.24 174.86 1y8b s THR 267 N -0.90 1.16 -0.24 6.45 -1.32 -1.18 -2.77 115.64 116.84 1y8b s THR 267 Ca -0.09 -0.60 -0.12 0.00 -1.21 0.00 0.00 61.69 59.66 1y8b s THR 267 Cb -0.02 -0.99 -0.05 0.00 -1.51 0.00 0.00 72.50 69.93 1y8b s THR 267 CO 0.06 0.34 0.25 0.27 -2.21 0.00 0.00 174.62 173.33 1y8b s ILE 268 N -0.14 5.29 0.13 5.08 -4.36 -0.82 -0.77 121.20 125.63 1y8b s ILE 268 Ca 0.01 0.35 0.06 0.00 -0.26 0.00 0.00 60.65 60.81 1y8b s ILE 268 Cb -0.08 -3.58 -0.04 0.00 1.25 0.00 0.00 42.46 40.01 1y8b s ILE 268 CO 0.00 0.29 0.03 -0.76 0.24 0.00 0.00 174.94 174.73 1y8b s LEU 269 N 1.35 3.48 0.00 0.37 1.43 -0.87 -3.18 118.68 121.26 1y8b s LEU 269 Ca 0.11 -0.24 0.00 0.00 -1.03 0.00 0.00 54.13 52.97 1y8b s LEU 269 Cb -0.14 -2.16 0.00 0.00 0.03 0.00 0.00 46.19 43.92 1y8b s LEU 269 CO 0.07 0.12 0.00 -0.67 0.23 0.00 0.00 176.35 176.10 1y8b n ASP 270 N 0.15 -0.17 -4.53 2.29 -0.08 -1.26 -3.36 116.55 109.60 1y8b n ASP 270 Ca -0.10 0.00 -0.43 0.00 -1.51 0.00 0.00 54.79 52.75 1y8b n ASP 270 Cb 0.54 -0.04 -0.00 0.00 2.34 0.00 0.00 41.12 43.95 1y8b n ASP 270 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1y8b h GLU 272 N 7.37 0.00 0.00 0.00 4.57 -1.95 2.47 114.58 127.04 1y8b h GLU 272 Ca 0.39 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.57 1y8b h GLU 272 Cb 0.87 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.46 1y8b h GLU 272 CO 1.36 0.00 -0.26 -0.44 -1.18 0.00 0.00 179.01 178.49 1y8b h ASP 273 N 0.00 0.00 0.00 1.04 5.19 -1.97 -3.37 116.42 117.31 1y8b h ASP 273 Ca 0.00 -0.08 -0.02 0.00 -0.62 0.00 0.00 57.03 56.30 1y8b h ASP 273 Cb 1.02 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.53 1y8b h ASP 273 CO 0.00 0.04 -0.52 0.77 -3.12 0.00 0.00 179.24 176.41 1y8b h SER 274 N 0.00 0.00 -3.46 6.45 4.64 0.39 -3.46 113.55 118.11 1y8b h SER 274 Ca 0.00 -0.06 -0.53 0.00 -0.47 0.00 0.00 61.79 60.73 1y8b h SER 274 Cb 0.76 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.82 1y8b h SER 274 CO 0.00 0.80 -0.10 -0.69 -0.87 0.00 0.00 176.83 175.97 1y8b s VAL 275 N -2.17 4.91 -0.29 0.95 1.01 -1.19 -5.01 120.40 118.61 1y8b s VAL 275 Ca -0.14 0.50 -0.03 0.00 0.00 0.00 0.00 61.98 62.30 1y8b s VAL 275 Cb 0.02 -3.62 0.11 0.00 0.00 0.00 0.00 36.38 32.89 1y8b s VAL 275 CO 0.24 -0.09 0.15 0.00 0.00 0.00 0.00 175.10 175.40 1y8b s ALA 276 N -1.84 0.51 0.06 5.51 0.00 -1.26 -4.75 121.76 119.98 1y8b s ALA 276 Ca 0.48 -1.04 -0.15 0.00 0.00 0.00 0.00 51.96 51.25 1y8b s ALA 276 Cb -0.11 -1.45 0.03 0.00 0.00 0.00 0.00 23.12 21.59 1y8b s ALA 276 CO 0.21 -1.68 0.35 0.00 0.00 0.00 0.00 175.76 174.64 1y8b s ALA 277 N 2.08 -0.80 -0.31 0.00 0.00 -1.26 -3.90 121.76 117.57 1y8b s ALA 277 Ca 0.09 0.07 0.06 0.00 0.00 0.00 0.00 51.96 52.18 1y8b s ALA 277 Cb -0.16 0.39 0.20 0.00 0.00 0.00 0.00 23.12 23.54 1y8b s ALA 277 CO -0.35 -0.46 0.61 0.14 0.00 0.00 0.00 175.76 175.70 1y8b s VAL 278 N -2.77 -0.98 0.03 0.00 -7.23 -1.26 -4.87 120.40 103.31 1y8b s VAL 278 Ca -0.03 0.00 -0.19 0.00 -1.81 0.00 0.00 61.98 59.94 1y8b s VAL 278 Cb -0.00 -0.82 0.04 0.00 0.56 0.00 0.00 36.38 36.16 1y8b s VAL 278 CO -0.05 0.00 0.44 -0.62 -0.31 0.00 0.00 175.10 174.56 1y8b s ASP 279 N 2.67 -0.33 0.12 4.85 2.15 -1.26 -4.94 116.67 119.94 1y8b s ASP 279 Ca 0.11 0.10 -0.21 0.00 0.43 0.00 0.00 52.55 52.99 1y8b s ASP 279 Cb -0.09 0.43 -0.04 0.00 -0.30 0.00 0.00 42.92 42.92 1y8b s ASP 279 CO -0.23 -0.64 1.70 0.00 -0.17 0.00 0.00 175.17 175.84 1y8b h ALA 280 N 3.09 0.07 0.00 3.66 0.00 -1.88 -1.69 119.26 122.52 1y8b h ALA 280 Ca -0.31 0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.62 1y8b h ALA 280 Cb 1.20 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 19.14 1y8b h ALA 280 CO 0.42 -0.50 -0.48 1.05 0.00 0.00 0.00 179.25 179.73 1y8b h GLU 281 N -0.04 0.00 0.23 0.00 4.11 -1.97 -3.37 114.58 113.55 1y8b h GLU 281 Ca 0.08 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.50 1y8b h GLU 281 Cb 0.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.41 1y8b h GLU 281 CO -0.18 0.17 -0.11 -0.44 0.07 0.00 0.00 179.01 178.52 1y8b h ASP 282 N 0.00 -0.26 -0.01 3.06 5.19 -1.85 -3.12 116.42 119.43 1y8b h ASP 282 Ca -0.02 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.40 1y8b h ASP 282 Cb 1.17 0.07 -0.00 0.00 0.18 0.00 0.00 39.33 40.75 1y8b h ASP 282 CO 0.02 -0.02 0.95 0.11 -3.12 0.00 0.00 179.24 177.18 1y8b h LYS 283 N -0.63 0.00 -0.06 3.56 1.79 -1.50 1.44 116.57 121.17 1y8b h LYS 283 Ca -0.03 0.00 -0.13 0.00 -2.18 0.00 0.00 60.65 58.31 1y8b h LYS 283 Cb 0.24 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.87 1y8b h LYS 283 CO 0.05 0.00 -0.54 0.82 -1.08 0.00 0.00 179.45 178.71 1y8b h ILE 284 N 0.00 1.37 -0.17 1.86 1.08 -1.70 -1.89 117.51 118.07 1y8b h ILE 284 Ca 0.00 -1.83 -0.16 0.00 -0.39 0.00 0.00 64.86 62.48 1y8b h ILE 284 Cb 1.90 1.92 -0.01 0.00 -3.07 0.00 0.00 36.82 37.56 1y8b h ILE 284 CO -0.00 0.54 -0.58 0.25 -0.69 0.00 0.00 178.15 177.67 1y8b h LEU 285 N 0.13 0.59 0.13 1.44 5.85 0.19 -1.64 115.31 122.00 1y8b h LEU 285 Ca 0.00 -0.32 -0.01 0.00 0.84 0.00 0.00 57.88 58.39 1y8b h LEU 285 Cb 0.99 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.85 1y8b h LEU 285 CO 0.08 1.04 -0.06 -0.07 -0.34 0.00 0.00 178.44 179.09 1y8b h LEU 286 N 0.40 -0.14 -2.19 2.25 3.38 -1.58 -3.20 115.31 114.23 1y8b h LEU 286 Ca 0.00 -0.31 0.06 0.00 0.09 0.00 0.00 57.88 57.72 1y8b h LEU 286 Cb 1.12 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.90 1y8b h LEU 286 CO 0.11 0.45 0.21 1.88 0.09 0.00 0.00 178.44 181.18 1y8b h TYR 287 N -0.96 0.00 0.00 1.13 -1.99 -1.44 0.21 116.97 113.92 1y8b h TYR 287 Ca -0.02 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.70 1y8b h TYR 287 Cb 0.45 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.18 1y8b h TYR 287 CO 0.08 0.00 -0.07 -0.09 -0.00 0.00 0.00 178.16 178.09 1y8b h ARG 288 N 0.00 0.00 0.13 4.88 2.43 -1.29 -2.07 114.38 118.47 1y8b h ARG 288 Ca 0.10 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.26 1y8b h ARG 288 Cb 0.51 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.07 1y8b h ARG 288 CO -0.00 0.07 -0.06 -0.97 -1.51 0.00 0.00 179.97 177.49 1y8b h ASN 289 N 0.00 -0.15 -0.84 -3.80 -0.73 -0.63 -3.16 115.58 106.27 1y8b h ASN 289 Ca -0.00 0.01 0.19 0.00 1.87 0.00 0.00 56.30 58.36 1y8b h ASN 289 Cb 0.17 0.04 -0.11 0.00 0.27 0.00 0.00 38.32 38.69 1y8b h ASN 289 CO 0.01 0.16 0.35 -0.07 -0.37 0.00 0.00 177.43 177.50 1y8b h LEU 290 N -0.70 0.30 -0.04 0.34 -0.00 -1.58 1.12 115.31 114.74 1y8b h LEU 290 Ca -0.02 0.14 0.04 0.00 -0.00 0.00 0.00 57.88 58.03 1y8b h LEU 290 Cb 0.14 0.12 -0.05 0.00 -0.00 0.00 0.00 40.66 40.87 1y8b h LEU 290 CO 0.03 0.04 -0.25 -0.07 -0.00 0.00 0.00 178.44 178.19 1y8b h LEU 291 N 0.42 -0.75 0.00 1.67 3.38 -1.49 -2.87 115.31 115.67 1y8b h LEU 291 Ca 0.50 0.11 -0.20 0.00 0.09 0.00 0.00 57.88 58.38 1y8b h LEU 291 Cb 0.88 0.32 -0.03 0.00 0.09 0.00 0.00 40.66 41.91 1y8b h LEU 291 CO -0.48 -0.31 -1.06 1.23 0.09 0.00 0.00 178.44 177.90 1y8b h GLY 292 N -0.37 0.00 -1.38 0.83 0.00 -1.26 -3.34 103.07 97.56 1y8b h GLY 292 Ca 0.07 0.00 0.48 0.00 0.00 0.00 0.00 47.33 47.89 1y8b h GLY 292 CO -0.25 0.00 1.12 -2.00 0.00 0.00 0.00 176.54 175.41 1y8b h LEU 293 N 0.00 0.09 -0.92 3.11 7.12 0.15 2.66 115.31 127.51 1y8b h LEU 293 Ca -0.08 0.05 -0.02 0.00 0.13 0.00 0.00 57.88 57.96 1y8b h LEU 293 Cb 1.71 0.04 -0.00 0.00 -0.53 0.00 0.00 40.66 41.88 1y8b h LEU 293 CO 0.10 -0.06 -0.10 0.24 -0.13 0.00 0.00 178.44 178.48 1y8b h MET 294 N 0.03 0.00 0.00 1.25 2.86 -1.68 -3.37 114.93 114.02 1y8b h MET 294 Ca 0.83 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 58.40 1y8b h MET 294 Cb 3.08 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 34.73 1y8b h MET 294 CO -0.15 0.10 -0.88 0.00 1.06 0.00 0.00 176.91 177.05 1y8b n GLN 295 N -3.19 0.16 0.00 1.72 10.64 0.79 -5.07 117.38 122.44 1y8b n GLN 295 Ca 0.01 0.07 0.00 0.00 -1.83 0.00 0.00 57.00 55.25 1y8b n GLN 295 Cb 0.42 -0.78 0.00 0.00 -0.86 0.00 0.00 30.24 29.02 1y8b n GLN 295 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1y8b n GLY 296 N 2.69 -1.47 0.01 2.61 0.00 0.40 -4.52 105.19 104.92 1y8b n GLY 296 Ca -0.10 0.82 0.12 0.00 0.00 0.00 0.00 46.02 46.85 1y8b n GLY 296 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1y8b n THR 297 N 0.00 0.00 -1.50 2.61 5.66 -1.19 -4.84 114.28 115.03 1y8b n THR 297 Ca 0.00 -0.01 0.00 0.00 -3.05 0.00 0.00 64.05 60.99 1y8b n THR 297 Cb 0.00 0.41 0.00 0.00 -1.55 0.00 0.00 70.33 69.19 1y8b n THR 297 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 1y8b n LEU 298 N -1.45 0.00 -3.65 1.09 4.32 -1.26 -4.98 117.00 111.07 1y8b n LEU 298 Ca 0.06 0.00 -0.02 0.00 -0.02 0.00 0.00 56.01 56.03 1y8b n LEU 298 Cb 0.34 0.00 -0.06 0.00 -1.62 0.00 0.00 43.42 42.07 1y8b n LEU 298 CO 0.36 0.00 0.72 0.00 -1.22 0.00 0.00 177.39 177.25 1y8b s GLN 299 N 2.26 0.34 -0.02 3.23 1.03 -1.26 -5.05 119.66 120.19 1y8b s GLN 299 Ca 0.00 0.58 0.04 0.00 0.04 0.00 0.00 55.36 56.02 1y8b s GLN 299 Cb 0.00 0.07 -0.01 0.00 0.03 0.00 0.00 33.01 33.10 1y8b s GLN 299 CO 0.00 -0.07 -0.15 -2.00 -2.54 0.00 0.00 175.29 170.53 1y8b s GLU 300 N 1.30 1.32 -0.23 9.60 2.12 -1.26 -4.85 118.70 126.70 1y8b s GLU 300 Ca -0.09 -0.53 -0.20 0.00 0.36 0.00 0.00 54.97 54.51 1y8b s GLU 300 Cb -0.03 -1.23 0.06 0.00 0.26 0.00 0.00 34.13 33.18 1y8b s GLU 300 CO -0.14 0.28 0.61 0.21 -0.54 0.00 0.00 175.26 175.68 1y8b s LYS 301 N -0.21 0.70 0.16 4.30 2.20 -1.26 -4.80 119.74 120.83 1y8b s LYS 301 Ca 0.03 0.88 -0.15 0.00 -0.36 0.00 0.00 55.97 56.36 1y8b s LYS 301 Cb -0.07 0.32 0.02 0.00 -1.51 0.00 0.00 37.83 36.59 1y8b s LYS 301 CO 0.00 -0.09 0.43 -1.64 -0.36 0.00 0.00 175.35 173.68 1y8b s MET 302 N 0.46 1.20 -0.18 4.03 -1.94 -1.26 -5.06 119.30 116.55 1y8b s MET 302 Ca -0.01 -0.84 -0.04 0.00 -1.71 0.00 0.00 55.69 53.08 1y8b s MET 302 Cb -0.04 0.47 0.08 0.00 2.01 0.00 0.00 34.83 37.35 1y8b s MET 302 CO -0.01 -0.48 0.18 -1.21 -0.01 0.00 0.00 175.02 173.49 1y8b s GLU 303 N -3.86 0.14 -0.46 2.03 8.01 -1.26 -4.60 118.70 118.70 1y8b s GLU 303 Ca 0.07 0.18 0.03 0.00 0.01 0.00 0.00 54.97 55.26 1y8b s GLU 303 Cb 0.01 -1.24 0.13 0.00 -4.31 0.00 0.00 34.13 28.72 1y8b s GLU 303 CO -0.07 -0.61 0.23 0.15 0.01 0.00 0.00 175.26 174.97 1y8b s LYS 304 N 2.27 1.57 0.00 1.61 1.02 0.44 -4.79 119.74 121.87 1y8b s LYS 304 Ca 0.05 -2.22 0.00 0.00 0.02 0.00 0.00 55.97 53.82 1y8b s LYS 304 Cb -0.15 -2.80 0.00 0.00 -0.52 0.00 0.00 37.83 34.35 1y8b s LYS 304 CO -0.10 -1.11 0.00 -1.71 -0.92 0.00 0.00 175.35 171.50 1y8b n ASN 305 N 3.47 0.00 0.00 2.83 4.05 -1.26 -1.27 115.26 123.08 1y8b n ASN 305 Ca 0.06 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.09 1y8b n ASN 305 Cb 0.34 -0.59 0.00 0.00 1.23 0.00 0.00 39.78 40.76 1y8b n ASN 305 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1y8b n GLY 306 N -1.46 0.48 3.95 8.20 0.00 -1.26 -5.14 105.19 109.97 1y8b n GLY 306 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1y8b n GLY 306 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1y8b s ARG 307 N 0.00 3.46 -0.28 1.61 6.06 -0.39 -5.06 118.95 124.35 1y8b s ARG 307 Ca 0.00 -0.58 -0.21 0.00 -2.50 0.00 0.00 55.73 52.44 1y8b s ARG 307 Cb 0.00 -2.84 0.12 0.00 0.06 0.00 0.00 34.95 32.28 1y8b s ARG 307 CO 0.00 0.38 0.92 1.14 -2.50 0.00 0.00 175.30 175.24 1y8b s GLN 308 N -3.84 0.54 -0.49 5.12 -2.07 -1.26 -0.42 119.66 117.25 1y8b s GLN 308 Ca 0.36 0.77 -0.18 0.00 -1.82 0.00 0.00 55.36 54.49 1y8b s GLN 308 Cb -0.10 0.20 0.06 0.00 -1.09 0.00 0.00 33.01 32.08 1y8b s GLN 308 CO 0.30 -0.08 0.54 0.96 -1.32 0.00 0.00 175.29 175.69 1y8b s ILE 309 N 0.79 4.99 -0.01 3.63 -4.36 -1.26 -4.98 121.20 120.00 1y8b s ILE 309 Ca -0.03 -0.60 0.08 0.00 -0.26 0.00 0.00 60.65 59.84 1y8b s ILE 309 Cb -0.05 -4.22 -0.02 0.00 1.25 0.00 0.00 42.46 39.42 1y8b s ILE 309 CO -0.10 -0.70 -0.24 -0.69 0.24 0.00 0.00 174.94 173.45 1y8b s VAL 310 N 2.33 1.92 -0.40 8.37 1.01 -1.26 -4.82 120.40 127.55 1y8b s VAL 310 Ca 0.12 -1.08 -0.12 0.00 0.00 0.00 0.00 61.98 60.90 1y8b s VAL 310 Cb -0.20 -1.60 0.04 0.00 0.00 0.00 0.00 36.38 34.62 1y8b s VAL 310 CO 0.11 0.50 0.25 -0.13 0.00 0.00 0.00 175.10 175.83 1y8b s ARG 311 N -0.68 2.82 0.08 2.72 0.52 -1.26 -5.06 118.95 118.08 1y8b s ARG 311 Ca 0.09 -1.17 0.06 0.00 -0.52 0.00 0.00 55.73 54.20 1y8b s ARG 311 Cb -0.09 -3.82 -0.03 0.00 0.52 0.00 0.00 34.95 31.53 1y8b s ARG 311 CO -0.00 -0.79 -0.17 -1.59 0.02 0.00 0.00 175.30 172.77 1y8b s LYS 312 N 1.56 0.97 -0.54 3.54 -2.85 -1.26 -4.77 119.74 116.39 1y8b s LYS 312 Ca 0.03 -1.03 -0.02 0.00 -1.00 0.00 0.00 55.97 53.95 1y8b s LYS 312 Cb -0.20 -1.08 0.14 0.00 -2.06 0.00 0.00 37.83 34.62 1y8b s LYS 312 CO 0.06 0.25 0.34 -0.51 0.10 0.00 0.00 175.35 175.59 1y8b s LEU 313 N -1.75 5.13 0.00 2.77 1.02 -1.26 -4.96 118.68 119.62 1y8b s LEU 313 Ca 0.02 -2.60 0.00 0.00 0.02 0.00 0.00 54.13 51.57 1y8b s LEU 313 Cb -0.10 -1.82 0.00 0.00 0.02 0.00 0.00 46.19 44.30 1y8b s LEU 313 CO 0.03 -0.41 0.00 -0.46 0.02 0.00 0.00 176.35 175.53 1y8b n ASN 314 N 3.80 0.00 -1.76 2.29 6.94 -1.26 -4.86 115.26 120.42 1y8b n ASN 314 Ca 0.04 0.00 -0.10 0.00 -0.02 0.00 0.00 54.58 54.50 1y8b n ASN 314 Cb 0.38 0.00 0.18 0.00 -2.36 0.00 0.00 39.78 37.98 1y8b n ASN 314 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 1y8b n ASP 315 N 0.00 3.80 -0.26 0.53 5.68 -1.26 -5.03 116.55 120.02 1y8b n ASP 315 Ca 0.00 -2.99 0.03 0.00 -0.50 0.00 0.00 54.79 51.33 1y8b n ASP 315 Cb 0.00 -0.71 -0.01 0.00 -1.14 0.00 0.00 41.12 39.26 1y8b n ASP 315 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1y8b n ASP 316 N -0.32 -1.55 -4.55 -1.12 8.00 -1.26 -4.90 116.55 110.85 1y8b n ASP 316 Ca 0.35 0.13 -0.34 0.00 0.71 0.00 0.00 54.79 55.65 1y8b n ASP 316 Cb 1.21 -0.80 -0.12 0.00 -0.02 0.00 0.00 41.12 41.39 1y8b n ASP 316 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1y8b s ARG 317 N -1.60 2.67 0.33 -1.24 3.00 -1.26 -5.05 118.95 115.79 1y8b s ARG 317 Ca 0.00 -0.60 -0.05 0.00 0.00 0.00 0.00 55.73 55.08 1y8b s ARG 317 Cb 0.00 -2.52 -0.05 0.00 0.00 0.00 0.00 34.95 32.38 1y8b s ARG 317 CO 0.00 0.65 0.60 -1.01 0.00 0.00 0.00 175.30 175.54 1y8b s HIS 318 N -0.78 3.49 0.09 -0.53 3.76 -1.26 -2.65 115.29 117.40 1y8b s HIS 318 Ca 0.12 0.68 -0.10 0.00 -0.15 0.00 0.00 55.06 55.61 1y8b s HIS 318 Cb -0.11 -2.14 0.01 0.00 1.11 0.00 0.00 32.58 31.44 1y8b s HIS 318 CO 0.01 0.09 0.23 0.71 -0.85 0.00 0.00 174.74 174.94 1y8b s TYR 319 N -2.20 0.07 -0.13 1.40 1.51 0.28 -4.83 117.35 113.44 1y8b s TYR 319 Ca 0.45 -0.45 -0.19 0.00 -1.01 0.00 0.00 57.07 55.87 1y8b s TYR 319 Cb -0.10 0.01 -0.04 0.00 -0.11 0.00 0.00 41.96 41.71 1y8b s TYR 319 CO 0.32 -0.56 0.52 0.99 -1.11 0.00 0.00 175.55 175.70 1y8b s THR 320 N -3.71 5.15 0.54 -0.71 2.01 0.13 -1.30 115.64 117.75 1y8b s THR 320 Ca 0.03 1.01 -0.21 0.00 0.31 0.00 0.00 61.69 62.84 1y8b s THR 320 Cb 0.04 -3.85 -0.05 0.00 0.01 0.00 0.00 72.50 68.65 1y8b s THR 320 CO -0.10 0.28 1.26 0.00 -0.69 0.00 0.00 174.62 175.36 1y8b s ALA 321 N 0.92 2.78 0.42 7.40 0.00 0.38 -0.36 121.76 133.29 1y8b s ALA 321 Ca 0.27 1.13 0.20 0.00 0.00 0.00 0.00 51.96 53.56 1y8b s ALA 321 Cb -0.15 -3.48 1.14 0.00 0.00 0.00 0.00 23.12 20.63 1y8b s ALA 321 CO 0.11 -1.12 1.79 0.00 0.00 0.00 0.00 175.76 176.54 1y8b h ALA 322 N 1.45 2.31 -0.14 0.00 0.00 -0.97 1.37 119.26 123.27 1y8b h ALA 322 Ca -0.50 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.42 1y8b h ALA 322 Cb 1.29 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.08 1y8b h ALA 322 CO 0.57 -0.69 0.04 -0.25 0.00 0.00 0.00 179.25 178.92 1y8b n ASP 323 N -4.56 2.29 0.00 0.00 9.92 -1.26 -4.79 116.55 118.15 1y8b n ASP 323 Ca 0.24 -2.23 0.00 0.00 -0.53 0.00 0.00 54.79 52.27 1y8b n ASP 323 Cb 0.88 -0.55 0.00 0.00 -0.64 0.00 0.00 41.12 40.81 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 0.14 2.00 3.42 0.44 0.00 0.47 -4.97 105.19 106.69 1y8b n GLY 324 Ca 0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.79 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 -3.34 -0.21 -0.11 1.61 0.01 -1.22 -4.46 113.70 105.97 1y8b s SER 325 Ca 0.00 0.81 -0.10 0.00 1.31 0.00 0.00 55.95 57.98 1y8b s SER 325 Cb 0.00 -1.16 -0.05 0.00 0.21 0.00 0.00 66.02 65.03 1y8b s SER 325 CO 0.00 -4.84 0.21 -1.61 0.41 0.00 0.00 173.24 167.41 1y8b s GLU 326 N -5.16 3.73 0.16 12.44 8.01 -1.26 0.14 118.70 136.76 1y8b s GLU 326 Ca 0.69 -0.00 -0.16 0.00 0.01 0.00 0.00 54.97 55.51 1y8b s GLU 326 Cb -0.13 -3.25 0.03 0.00 -4.31 0.00 0.00 34.13 26.47 1y8b s GLU 326 CO 0.58 0.64 0.44 -1.50 0.01 0.00 0.00 175.26 175.43 1y8b s ILE 327 N -0.69 0.05 -0.01 -1.63 2.07 -0.42 -4.68 121.20 115.88 1y8b s ILE 327 Ca 0.16 -0.73 0.00 0.00 -1.41 0.00 0.00 60.65 58.68 1y8b s ILE 327 Cb -0.13 -1.40 0.01 0.00 0.13 0.00 0.00 42.46 41.07 1y8b s ILE 327 CO 0.05 -0.23 -0.01 -0.55 -1.91 0.00 0.00 174.94 172.29 1y8b s SER 328 N -2.85 0.24 -0.11 4.50 0.15 -1.26 0.99 113.70 115.36 1y8b s SER 328 Ca 0.07 -0.02 -0.04 0.00 0.70 0.00 0.00 55.95 56.65 1y8b s SER 328 Cb 0.01 -0.07 0.06 0.00 -1.71 0.00 0.00 66.02 64.30 1y8b s SER 328 CO -0.07 -0.02 0.23 -0.76 1.20 0.00 0.00 173.24 173.81 1y8b s LEU 329 N 0.32 -0.13 0.02 3.45 1.02 -1.09 -4.92 118.68 117.35 1y8b s LEU 329 Ca -0.03 0.50 -0.05 0.00 0.02 0.00 0.00 54.13 54.58 1y8b s LEU 329 Cb -0.05 0.57 -0.02 0.00 0.02 0.00 0.00 46.19 46.71 1y8b s LEU 329 CO -0.01 -0.23 1.08 0.45 0.02 0.00 0.00 176.35 177.66 1y8b h HIS 330 N 8.16 -0.24 -0.02 0.29 3.86 -1.97 -3.41 115.15 121.82 1y8b h HIS 330 Ca -0.18 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.05 1y8b h HIS 330 Cb 1.12 0.11 0.00 0.00 1.06 0.00 0.00 27.41 29.70 1y8b h HIS 330 CO 0.39 -0.08 0.00 0.41 0.86 0.00 0.00 177.93 179.51 1y8b n GLY 331 N -1.06 1.67 3.50 2.45 0.00 -1.26 -4.73 105.19 105.76 1y8b n GLY 331 Ca -0.01 -0.07 -0.25 0.00 0.00 0.00 0.00 46.02 45.69 1y8b n GLY 331 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1y8b s ARG 332 N -1.08 1.73 0.30 1.61 1.04 -1.26 -4.86 118.95 116.44 1y8b s ARG 332 Ca 0.00 -1.87 -0.29 0.00 -1.04 0.00 0.00 55.73 52.53 1y8b s ARG 332 Cb 0.00 -1.60 -0.10 0.00 -2.04 0.00 0.00 34.95 31.22 1y8b s ARG 332 CO 0.00 0.15 1.13 -1.54 -0.04 0.00 0.00 175.30 175.00 1y8b s SER 333 N -3.55 7.11 0.63 -2.89 1.04 0.98 -4.79 113.70 112.23 1y8b s SER 333 Ca 0.31 2.32 -0.19 0.00 0.48 0.00 0.00 55.95 58.87 1y8b s SER 333 Cb 0.01 -2.63 -0.02 0.00 0.10 0.00 0.00 66.02 63.49 1y8b s SER 333 CO 0.15 -0.26 1.26 0.00 0.98 0.00 0.00 173.24 175.37 1y8b n LEU 334 N 0.96 5.65 -4.54 2.42 -0.00 -1.04 -4.63 117.00 115.83 1y8b n LEU 334 Ca -0.00 0.85 -0.42 0.00 -0.00 0.00 0.00 56.01 56.44 1y8b n LEU 334 Cb 0.45 -1.54 -0.08 0.00 -0.00 0.00 0.00 43.42 42.25 1y8b n LEU 334 CO 0.54 -1.05 0.15 -0.22 -0.00 0.00 0.00 177.39 176.81 1y8b s LEU 335 N -3.88 4.48 -0.13 1.47 2.96 -1.26 -3.13 118.68 119.19 1y8b s LEU 335 Ca 0.80 -0.24 -0.09 0.00 -0.22 0.00 0.00 54.13 54.39 1y8b s LEU 335 Cb -0.39 -2.47 -0.04 0.00 0.50 0.00 0.00 46.19 43.78 1y8b s LEU 335 CO 0.42 -0.47 0.17 0.12 -1.32 0.00 0.00 176.35 175.27 1y8b s PHE 336 N 2.24 3.57 -0.03 5.38 2.19 0.05 -4.56 117.98 126.82 1y8b s PHE 336 Ca 0.15 0.53 0.02 0.00 0.33 0.00 0.00 56.93 57.97 1y8b s PHE 336 Cb -0.16 -2.03 0.01 0.00 -1.31 0.00 0.00 43.02 39.52 1y8b s PHE 336 CO 0.13 0.62 -0.10 0.42 1.83 0.00 0.00 175.22 178.12 1y8b s ILE 337 N -0.68 0.85 -0.16 3.12 1.01 -1.12 -2.05 121.20 122.17 1y8b s ILE 337 Ca 0.14 -0.38 -0.02 0.00 0.00 0.00 0.00 60.65 60.40 1y8b s ILE 337 Cb -0.12 -0.77 -0.02 0.00 0.01 0.00 0.00 42.46 41.56 1y8b s ILE 337 CO 0.04 0.27 -0.09 -0.60 0.00 0.00 0.00 174.94 174.56 1y8b s ARG 338 N 0.33 3.46 -0.04 2.79 3.00 -1.21 0.27 118.95 127.55 1y8b s ARG 338 Ca -0.06 -0.63 -0.14 0.00 -1.00 0.00 0.00 55.73 53.90 1y8b s ARG 338 Cb -0.11 -2.80 -0.05 0.00 0.00 0.00 0.00 34.95 32.00 1y8b s ARG 338 CO 0.01 0.12 0.38 -0.80 0.00 0.00 0.00 175.30 175.01 1y8b s ASN 339 N 0.63 6.73 -0.17 -2.12 -0.87 -0.89 -4.81 114.94 113.43 1y8b s ASN 339 Ca -0.05 0.86 -0.25 0.00 -1.57 0.00 0.00 52.86 51.86 1y8b s ASN 339 Cb -0.15 -2.23 -0.02 0.00 -0.02 0.00 0.00 41.25 38.83 1y8b s ASN 339 CO 0.03 0.27 0.81 0.54 -2.57 0.00 0.00 177.10 176.18 1y8b s VAL 340 N -0.72 4.89 0.00 1.60 0.11 -1.26 -4.78 120.40 120.24 1y8b s VAL 340 Ca 0.23 1.59 0.00 0.00 -2.93 0.00 0.00 61.98 60.86 1y8b s VAL 340 Cb -0.16 -4.12 0.00 0.00 -1.53 0.00 0.00 36.38 30.57 1y8b s VAL 340 CO 0.11 0.03 0.00 0.61 -3.33 0.00 0.00 175.10 172.52 1y8b n GLY 341 N 3.50 -2.02 0.00 6.54 0.00 -1.26 -4.73 105.19 107.22 1y8b n GLY 341 Ca 0.04 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1y8b n GLY 341 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1y8b n HIS 342 N 0.00 0.00 -0.16 1.61 -0.00 -1.26 -4.88 115.22 110.53 1y8b n HIS 342 Ca 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 57.72 57.64 1y8b n HIS 342 Cb 0.00 0.02 0.01 0.00 -0.00 0.00 0.00 29.99 30.02 1y8b n HIS 342 CO 0.00 0.00 0.00 1.37 -0.00 0.00 0.00 176.34 177.71 1y8b h LEU 343 N 0.00 0.59 -0.60 2.41 -0.00 -1.98 -2.42 115.31 113.31 1y8b h LEU 343 Ca 0.00 -0.11 0.11 0.00 -0.00 0.00 0.00 57.88 57.88 1y8b h LEU 343 Cb 0.34 -0.15 -0.09 0.00 -0.00 0.00 0.00 40.66 40.76 1y8b h LEU 343 CO 0.00 0.54 0.12 0.24 -0.00 0.00 0.00 178.44 179.34 1y8b h MET 344 N 0.60 0.25 -0.63 0.17 2.86 -1.90 -3.48 114.93 112.79 1y8b h MET 344 Ca 0.16 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.78 1y8b h MET 344 Cb 0.09 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 31.70 1y8b h MET 344 CO -0.02 0.16 0.00 2.41 1.06 0.00 0.00 176.91 180.52 1y8b n THR 345 N -5.13 -1.54 -3.16 2.22 -1.04 -0.91 -4.91 114.28 99.80 1y8b n THR 345 Ca 0.09 0.00 0.03 0.00 -2.04 0.00 0.00 64.05 62.13 1y8b n THR 345 Cb 0.32 -1.54 -0.00 0.00 -1.82 0.00 0.00 70.33 67.29 1y8b n THR 345 CO 0.00 0.00 0.00 0.27 -0.64 0.00 0.00 175.07 174.70 1y8b s ILE 346 N -0.27 -0.97 0.46 12.58 -4.36 -1.26 -5.12 121.20 122.25 1y8b s ILE 346 Ca 0.00 -0.02 -0.22 0.00 -0.26 0.00 0.00 60.65 60.15 1y8b s ILE 346 Cb 0.00 -0.99 -0.10 0.00 1.25 0.00 0.00 42.46 42.62 1y8b s ILE 346 CO 0.00 -0.02 0.81 -2.65 0.24 0.00 0.00 174.94 173.32 1y8b n PRO 347 N 5.40 0.96 0.22 0.37 -0.02 -1.26 -4.39 135.00 136.29 1y8b n PRO 347 Ca 0.05 0.35 0.00 0.00 -2.02 0.00 0.00 63.50 61.88 1y8b n PRO 347 Cb 0.54 -1.87 0.00 0.00 -0.02 0.00 0.00 33.50 32.15 1y8b n PRO 347 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1y8b n VAL 348 N -0.91 0.00 -4.11 -1.45 0.31 -1.26 -4.49 118.33 106.41 1y8b n VAL 348 Ca 0.11 0.00 -0.30 0.00 -0.01 0.00 0.00 64.34 64.14 1y8b n VAL 348 Cb 0.41 -0.10 -0.08 0.00 -0.91 0.00 0.00 33.84 33.16 1y8b n VAL 348 CO 0.00 0.00 0.00 0.27 -1.32 0.00 0.00 176.83 175.78 1y8b s ILE 349 N -1.97 4.13 -0.16 2.52 -4.36 -1.26 -4.62 121.20 115.49 1y8b s ILE 349 Ca 0.00 -0.93 -0.18 0.00 -0.26 0.00 0.00 60.65 59.27 1y8b s ILE 349 Cb 0.00 -2.97 -0.04 0.00 1.25 0.00 0.00 42.46 40.70 1y8b s ILE 349 CO 0.00 0.13 0.51 0.26 0.24 0.00 0.00 174.94 176.07 1y8b s TRP 350 N -1.32 3.44 0.79 1.37 0.52 -1.23 -4.22 118.94 118.29 1y8b s TRP 350 Ca 0.26 0.84 -0.12 0.00 0.02 0.00 0.00 56.10 57.11 1y8b s TRP 350 Cb -0.12 -2.62 0.06 0.00 -1.15 0.00 0.00 33.47 29.64 1y8b s TRP 350 CO 0.19 0.03 1.14 -0.51 0.02 0.00 0.00 176.95 177.81 1y8b s ASP 351 N 0.90 4.68 0.38 2.95 1.11 -1.26 -2.73 116.67 122.71 1y8b s ASP 351 Ca 0.25 0.99 0.24 0.00 0.18 0.00 0.00 52.55 54.21 1y8b s ASP 351 Cb -0.15 -1.62 0.50 0.00 1.07 0.00 0.00 42.92 42.71 1y8b s ASP 351 CO 0.10 -1.81 1.67 -1.28 1.18 0.00 0.00 175.17 175.03 1y8b h SER 352 N -0.99 0.00 0.36 0.27 0.87 -1.94 -3.06 113.55 109.06 1y8b h SER 352 Ca -0.46 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.10 1y8b h SER 352 Cb 1.30 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.26 1y8b h SER 352 CO 0.64 0.00 -0.43 -0.62 -0.53 0.00 0.00 176.83 175.89 1y8b n GLU 353 N -2.88 0.36 -2.62 2.24 1.02 -1.26 -4.98 120.64 112.52 1y8b n GLU 353 Ca 0.04 -0.22 -0.02 0.00 -0.02 0.00 0.00 57.16 56.94 1y8b n GLU 353 Cb 0.49 -1.50 0.01 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 1.44 -0.88 3.64 0.62 0.00 -1.16 -4.92 105.19 103.92 1y8b n GLY 354 Ca 0.08 0.28 -0.43 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.81 6.89 0.29 1.61 0.02 -1.26 -4.86 114.94 114.82 1y8b s ASN 355 Ca 0.06 1.10 0.22 0.00 -1.02 0.00 0.00 52.86 53.22 1y8b s ASN 355 Cb -0.01 -2.54 0.98 0.00 0.02 0.00 0.00 41.25 39.70 1y8b s ASN 355 CO 0.52 -0.91 1.00 -1.84 0.02 0.00 0.00 177.10 175.89 1y8b n GLU 356 N 6.94 -0.02 -3.63 -0.60 0.00 -1.26 -2.18 120.64 119.89 1y8b n GLU 356 Ca 0.12 0.79 -0.29 0.00 0.00 0.00 0.00 57.16 57.78 1y8b n GLU 356 Cb 0.47 -1.59 -0.13 0.00 0.00 0.00 0.00 31.44 30.20 1y8b n GLU 356 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.13 177.55 1y8b s ILE 357 N -4.59 1.01 0.00 3.84 1.01 -1.26 -5.11 121.20 116.10 1y8b s ILE 357 Ca -0.04 -2.33 0.00 0.00 0.00 0.00 0.00 60.65 58.27 1y8b s ILE 357 Cb 0.19 -1.71 0.00 0.00 0.01 0.00 0.00 42.46 40.95 1y8b s ILE 357 CO 0.53 -0.94 0.00 -2.65 0.00 0.00 0.00 174.94 171.88 1y8b n PRO 358 N 3.64 1.37 -0.64 2.79 -0.02 -0.92 -4.97 135.00 136.24 1y8b n PRO 358 Ca 0.11 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.59 1y8b n PRO 358 Cb 0.36 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.84 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 -1.82 0.00 -0.52 0.00 -1.26 -4.75 120.64 112.29 1y8b n GLU 359 Ca 0.00 1.37 0.00 0.00 0.00 0.00 0.00 57.16 58.53 1y8b n GLU 359 Cb 0.00 -1.56 0.00 0.00 0.00 0.00 0.00 31.44 29.88 1y8b n GLU 359 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1y8b n GLY 360 N -1.11 3.33 0.16 8.31 0.00 -1.26 -5.00 105.19 109.62 1y8b n GLY 360 Ca 0.00 -0.65 0.13 0.00 0.00 0.00 0.00 46.02 45.50 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 0.00 0.00 -1.00 -0.61 -2.65 -1.90 -3.32 117.51 108.02 1y8b h ILE 361 Ca 0.00 -0.73 0.29 0.00 1.03 0.00 0.00 64.86 65.45 1y8b h ILE 361 Cb 0.00 1.72 -0.04 0.00 -2.05 0.00 0.00 36.82 36.45 1y8b h ILE 361 CO 0.00 0.00 1.19 0.17 0.03 0.00 0.00 178.15 179.54 1y8b h LEU 362 N 0.00 0.00 0.01 0.16 -0.00 -1.95 0.60 115.31 114.14 1y8b h LEU 362 Ca 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 57.88 1y8b h LEU 362 Cb 0.87 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.53 1y8b h LEU 362 CO 0.00 0.00 -0.00 -2.24 -0.00 0.00 0.00 178.44 176.20 1y8b h ASP 363 N 0.00 -0.01 0.21 0.17 2.03 -1.95 -1.39 116.42 115.48 1y8b h ASP 363 Ca 0.48 -0.60 -0.08 0.00 -0.73 0.00 0.00 57.03 56.10 1y8b h ASP 363 Cb 2.85 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 41.34 1y8b h ASP 363 CO -0.01 0.60 -0.31 1.23 -1.03 0.00 0.00 179.24 179.72 1y8b h GLY 364 N -0.63 0.17 0.44 7.15 0.00 -0.10 -2.82 103.07 107.29 1y8b h GLY 364 Ca -0.00 -0.14 -0.01 0.00 0.00 0.00 0.00 47.33 47.18 1y8b h GLY 364 CO 0.00 0.13 -0.10 -2.08 0.00 0.00 0.00 176.54 174.48 1y8b h VAL 365 N 0.14 0.75 0.00 4.60 2.07 -1.30 -2.94 116.25 119.58 1y8b h VAL 365 Ca 0.02 -0.95 0.00 0.00 0.82 0.00 0.00 66.70 66.59 1y8b h VAL 365 Cb 0.62 1.22 0.00 0.00 -1.52 0.00 0.00 31.29 31.61 1y8b h VAL 365 CO 0.05 0.18 0.13 -0.03 0.02 0.00 0.00 177.57 177.91 1y8b h MET 366 N -0.85 0.00 0.00 1.57 -1.53 -1.23 0.21 114.93 113.09 1y8b h MET 366 Ca -0.03 0.00 -0.06 0.00 -3.44 0.00 0.00 59.70 56.17 1y8b h MET 366 Cb 0.51 0.00 -0.01 0.00 -0.55 0.00 0.00 31.60 31.55 1y8b h MET 366 CO 0.05 0.00 -0.27 1.15 0.14 0.00 0.00 176.91 177.98 1y8b h THR 367 N 0.00 0.51 0.00 -0.77 2.02 -1.30 -2.97 112.91 110.40 1y8b h THR 367 Ca 0.00 -1.49 0.00 0.00 0.77 0.00 0.00 66.41 65.69 1y8b h THR 367 Cb 0.26 2.07 0.00 0.00 -1.74 0.00 0.00 68.15 68.74 1y8b h THR 367 CO 0.00 0.26 0.00 0.61 0.37 0.00 0.00 175.52 176.76 1y8b n GLY 368 N 0.80 -1.32 0.13 2.16 0.00 0.73 -2.59 105.19 105.10 1y8b n GLY 368 Ca 0.02 0.04 -0.03 0.00 0.00 0.00 0.00 46.02 46.05 1y8b n GLY 368 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y8b h ALA 369 N 2.37 0.86 0.00 4.61 0.00 -1.64 -2.97 119.26 122.49 1y8b h ALA 369 Ca 0.00 -0.60 -0.08 0.00 0.00 0.00 0.00 54.91 54.23 1y8b h ALA 369 Cb 0.42 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1y8b h ALA 369 CO 0.00 0.82 -0.37 0.82 0.00 0.00 0.00 179.25 180.52 1y8b h ILE 370 N 0.04 0.85 -0.14 0.00 2.04 -1.67 -2.97 117.51 115.66 1y8b h ILE 370 Ca -0.01 -1.52 0.04 0.00 1.00 0.00 0.00 64.86 64.37 1y8b h ILE 370 Cb 1.19 1.94 -0.01 0.00 -0.74 0.00 0.00 36.82 39.21 1y8b h ILE 370 CO 0.09 0.36 0.11 0.00 0.00 0.00 0.00 178.15 178.71 1y8b h ALA 371 N 1.63 2.04 -0.22 1.87 0.00 -1.62 -2.07 119.26 120.89 1y8b h ALA 371 Ca -0.00 -0.00 0.06 0.00 0.00 0.00 0.00 54.91 54.97 1y8b h ALA 371 Cb 0.91 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 1y8b h ALA 371 CO 0.05 -0.18 0.82 -0.07 0.00 0.00 0.00 179.25 179.87 1y8b h LEU 372 N 0.00 0.00 -1.03 0.00 3.38 -1.66 0.52 115.31 116.52 1y8b h LEU 372 Ca 0.07 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 1y8b h LEU 372 Cb 0.28 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 1y8b h LEU 372 CO -0.00 0.00 0.32 0.22 0.09 0.00 0.00 178.44 179.07 1y8b h TYR 373 N 0.00 1.01 0.00 1.13 3.20 -1.63 0.29 116.97 120.97 1y8b h TYR 373 Ca 0.10 -0.05 -0.03 0.00 3.14 0.00 0.00 58.73 61.90 1y8b h TYR 373 Cb 1.74 -0.31 -0.00 0.00 1.54 0.00 0.00 36.73 39.69 1y8b h TYR 373 CO 0.00 0.75 -0.81 0.22 -1.64 0.00 0.00 178.16 176.67 1y8b h ASP 374 N 1.00 0.00 0.03 -2.11 1.82 -0.20 -3.34 116.42 113.62 1y8b h ASP 374 Ca 0.24 0.00 -0.18 0.00 -0.39 0.00 0.00 57.03 56.70 1y8b h ASP 374 Cb 0.13 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.12 1y8b h ASP 374 CO -0.03 0.09 -0.95 -0.07 -1.61 0.00 0.00 179.24 176.67 1y8b h LEU 375 N 0.00 0.10 -0.11 2.28 3.38 -1.26 -3.32 115.31 116.37 1y8b h LEU 375 Ca -0.02 -0.74 0.05 0.00 0.09 0.00 0.00 57.88 57.26 1y8b h LEU 375 Cb 1.09 -0.03 -0.06 0.00 0.09 0.00 0.00 40.66 41.75 1y8b h LEU 375 CO 0.01 1.39 -0.30 0.11 0.09 0.00 0.00 178.44 179.74 1y8b h LYS 376 N -0.81 -0.37 -0.90 1.13 1.57 -0.60 -1.80 116.57 114.78 1y8b h LYS 376 Ca -0.24 0.03 0.08 0.00 -1.87 0.00 0.00 60.65 58.65 1y8b h LYS 376 Cb 1.34 0.08 -0.11 0.00 0.08 0.00 0.00 32.23 33.63 1y8b h LYS 376 CO -0.08 -0.25 -0.53 1.33 -0.57 0.00 0.00 179.45 179.35 1y8b n VAL 377 N -5.40 -0.62 -0.30 0.50 0.24 -1.25 -4.59 118.33 106.91 1y8b n VAL 377 Ca -0.03 2.32 0.00 0.00 -2.04 0.00 0.00 64.34 64.59 1y8b n VAL 377 Cb 0.32 -2.88 0.00 0.00 -1.47 0.00 0.00 33.84 29.80 1y8b n VAL 377 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 1y8b n GLN 378 N -5.04 -0.91 0.00 7.34 7.27 -0.68 -3.99 117.38 121.36 1y8b n GLN 378 Ca 0.02 0.09 0.00 0.00 0.07 0.00 0.00 57.00 57.18 1y8b n GLN 378 Cb 0.24 -2.92 0.00 0.00 2.41 0.00 0.00 30.24 29.96 1y8b n GLN 378 CO 0.00 0.00 0.00 1.63 0.07 0.00 0.00 177.06 178.76 1y8b n LYS 379 N 0.07 0.00 -3.16 3.69 4.76 -1.26 -5.05 118.16 117.21 1y8b n LYS 379 Ca 0.00 0.00 0.04 0.00 -2.87 0.00 0.00 58.31 55.48 1y8b n LYS 379 Cb 0.09 -0.12 -0.00 0.00 -1.84 0.00 0.00 35.03 33.16 1y8b n LYS 379 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 1y8b s ASN 380 N 0.00 -1.58 0.05 4.39 3.84 -1.26 -5.15 114.94 115.23 1y8b s ASN 380 Ca 0.00 0.06 -0.06 0.00 0.21 0.00 0.00 52.86 53.07 1y8b s ASN 380 Cb 0.00 2.00 -0.01 0.00 -0.55 0.00 0.00 41.25 42.69 1y8b s ASN 380 CO 0.00 -0.28 0.11 -0.94 -2.79 0.00 0.00 177.10 173.20 1y8b s SER 381 N 2.71 0.18 -0.02 -4.21 1.04 -1.26 -4.81 113.70 107.33 1y8b s SER 381 Ca 0.11 -0.56 -0.22 0.00 0.48 0.00 0.00 55.95 55.76 1y8b s SER 381 Cb -0.09 0.25 -0.24 0.00 0.10 0.00 0.00 66.02 66.04 1y8b s SER 381 CO -0.23 -0.55 1.06 -0.09 0.98 0.00 0.00 173.24 174.41 1y8b h ARG 382 N 3.48 0.32 -0.06 4.02 9.65 -1.99 -3.35 114.38 126.45 1y8b h ARG 382 Ca -0.33 -0.35 0.00 0.00 -1.10 0.00 0.00 59.98 58.20 1y8b h ARG 382 Cb 1.18 0.10 0.00 0.00 -1.39 0.00 0.00 29.97 29.87 1y8b h ARG 382 CO 0.52 1.05 0.00 2.41 2.80 0.00 0.00 179.97 186.75 1y8b n THR 383 N -4.31 0.49 -1.52 0.20 -1.04 -1.26 -4.95 114.28 101.88 1y8b n THR 383 Ca -0.10 -0.74 -0.02 0.00 -2.04 0.00 0.00 64.05 61.14 1y8b n THR 383 Cb 0.62 0.80 -0.01 0.00 -1.82 0.00 0.00 70.33 69.92 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 0.03 -0.04 3.31 3.41 0.00 -1.26 -4.28 105.19 106.37 1y8b n GLY 384 Ca 0.03 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 1y8b n GLY 384 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1y8b s SER 385 N -1.44 0.38 -0.24 1.61 0.15 -1.26 -3.88 113.70 109.02 1y8b s SER 385 Ca 0.00 -1.36 -0.09 0.00 0.70 0.00 0.00 55.95 55.20 1y8b s SER 385 Cb 0.00 0.47 -0.04 0.00 -1.71 0.00 0.00 66.02 64.74 1y8b s SER 385 CO 0.00 -0.97 0.11 -0.69 1.20 0.00 0.00 173.24 172.89 1y8b s VAL 386 N -3.94 4.76 -0.65 4.45 1.01 -1.26 -4.83 120.40 119.93 1y8b s VAL 386 Ca 0.35 -0.03 -0.23 0.00 0.00 0.00 0.00 61.98 62.08 1y8b s VAL 386 Cb 0.04 -3.22 0.06 0.00 0.00 0.00 0.00 36.38 33.26 1y8b s VAL 386 CO 0.14 0.34 1.00 -0.31 0.00 0.00 0.00 175.10 176.28 1y8b s TYR 387 N 1.35 2.64 -0.05 5.22 1.51 -1.26 -2.89 117.35 123.86 1y8b s TYR 387 Ca 0.06 -0.41 -0.01 0.00 -1.01 0.00 0.00 57.07 55.70 1y8b s TYR 387 Cb -0.15 -4.30 0.03 0.00 -0.11 0.00 0.00 41.96 37.43 1y8b s TYR 387 CO 0.05 -1.66 0.02 0.96 -1.11 0.00 0.00 175.55 173.80 1y8b s ILE 388 N 4.27 0.18 -0.42 2.71 -4.36 -1.25 -2.77 121.20 119.54 1y8b s ILE 388 Ca 0.25 0.19 -0.11 0.00 -0.26 0.00 0.00 60.65 60.72 1y8b s ILE 388 Cb -0.15 -0.34 0.07 0.00 1.25 0.00 0.00 42.46 43.29 1y8b s ILE 388 CO 0.12 0.20 0.28 -0.69 0.24 0.00 0.00 174.94 175.09 1y8b s VAL 389 N 1.69 4.55 0.01 8.37 1.01 0.78 -3.59 120.40 133.23 1y8b s VAL 389 Ca -0.00 -1.21 0.01 0.00 0.00 0.00 0.00 61.98 60.78 1y8b s VAL 389 Cb -0.13 -3.72 -0.01 0.00 0.00 0.00 0.00 36.38 32.53 1y8b s VAL 389 CO -0.03 -0.47 -0.03 -1.59 0.00 0.00 0.00 175.10 172.97 1y8b s LYS 390 N 1.51 0.24 0.00 2.72 -2.85 -1.25 -2.09 119.74 118.03 1y8b s LYS 390 Ca 0.03 -0.28 0.00 0.00 -1.00 0.00 0.00 55.97 54.72 1y8b s LYS 390 Cb -0.23 -0.12 0.00 0.00 -2.06 0.00 0.00 37.83 35.42 1y8b s LYS 390 CO 0.04 0.03 0.00 -2.30 0.10 0.00 0.00 175.35 173.22 1y8b n PRO 391 N 2.52 0.00 -0.99 1.78 -0.02 -1.26 -4.48 135.00 132.54 1y8b n PRO 391 Ca -0.16 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.32 1y8b n PRO 391 Cb 0.58 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.06 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 0.00 0.00 -4.71 -0.52 5.02 -1.26 -4.49 118.16 112.20 1y8b n LYS 392 Ca 0.00 0.38 -0.33 0.00 -2.02 0.00 0.00 58.31 56.34 1y8b n LYS 392 Cb 0.00 -3.73 -0.14 0.00 -0.02 0.00 0.00 35.03 31.13 1y8b n LYS 392 CO 0.00 0.00 0.00 1.41 -0.52 0.00 0.00 177.40 178.29 1y8b s MET 393 N -1.51 3.36 0.00 1.97 1.75 -1.26 -4.69 119.30 118.92 1y8b s MET 393 Ca 0.00 -0.69 0.00 0.00 -1.25 0.00 0.00 55.69 53.75 1y8b s MET 393 Cb 0.00 -2.65 0.00 0.00 2.84 0.00 0.00 34.83 35.02 1y8b s MET 393 CO 0.00 0.17 0.00 0.72 -0.65 0.00 0.00 175.02 175.26 1y8b n HIS 394 N 3.65 0.00 -3.62 4.11 8.25 -1.26 -4.72 115.22 121.64 1y8b n HIS 394 Ca -0.18 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.26 1y8b n HIS 394 Cb 0.52 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.62 1y8b n HIS 394 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1y8b s GLY 395 N 0.00 -0.28 0.20 -1.41 0.00 -1.26 -4.95 107.32 99.61 1y8b s GLY 395 Ca 0.00 1.59 -0.04 0.00 0.00 0.00 0.00 44.72 46.27 1y8b s GLY 395 CO 0.00 0.51 1.55 -0.56 0.00 0.00 0.00 173.10 174.60 1y8b h PRO 396 N 2.00 0.65 0.00 2.90 0.13 -1.99 -3.14 132.00 132.54 1y8b h PRO 396 Ca -0.10 -0.34 -0.22 0.00 -0.87 0.00 0.00 66.00 64.46 1y8b h PRO 396 Cb 1.15 0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.26 1y8b h PRO 396 CO 0.22 0.95 -1.32 -0.56 -0.23 0.00 0.00 178.00 177.06 1y8b h GLN 397 N 0.53 0.00 -0.33 0.86 -0.00 -2.00 -3.31 115.11 110.86 1y8b h GLN 397 Ca 0.04 0.00 -0.01 0.00 -0.00 0.00 0.00 58.65 58.68 1y8b h GLN 397 Cb 0.95 0.00 -0.02 0.00 -0.00 0.00 0.00 27.48 28.41 1y8b h GLN 397 CO 0.09 0.57 0.17 1.49 -0.00 0.00 0.00 178.83 181.15 1y8b h GLU 398 N 0.00 0.45 0.00 0.06 4.81 -1.93 -1.07 114.58 116.90 1y8b h GLU 398 Ca -0.15 -0.04 -0.13 0.00 -0.13 0.00 0.00 59.36 58.90 1y8b h GLU 398 Cb 1.78 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 31.04 1y8b h GLU 398 CO 0.08 0.34 -0.64 0.28 -0.73 0.00 0.00 179.01 178.34 1y8b h VAL 399 N 0.46 1.33 0.00 0.32 2.07 -1.63 -2.79 116.25 116.00 1y8b h VAL 399 Ca 0.12 -2.29 0.00 0.00 0.82 0.00 0.00 66.70 65.34 1y8b h VAL 399 Cb 0.03 2.28 0.00 0.00 -1.52 0.00 0.00 31.29 32.08 1y8b h VAL 399 CO -0.02 0.63 0.00 0.00 0.02 0.00 0.00 177.57 178.20 1y8b h ALA 400 N 1.36 1.00 0.03 1.67 0.00 -1.28 -1.74 119.26 120.30 1y8b h ALA 400 Ca -0.01 0.00 -0.24 0.00 0.00 0.00 0.00 54.91 54.66 1y8b h ALA 400 Cb 1.23 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.99 1y8b h ALA 400 CO 0.08 0.00 -1.23 0.35 0.00 0.00 0.00 179.25 178.46 1y8b h PHE 401 N 0.00 0.10 0.08 0.00 3.04 -1.31 -3.27 116.94 115.58 1y8b h PHE 401 Ca 0.00 -0.08 -0.00 0.00 3.98 0.00 0.00 57.97 61.87 1y8b h PHE 401 Cb 0.34 -0.00 0.00 0.00 2.56 0.00 0.00 35.95 38.85 1y8b h PHE 401 CO 0.00 1.07 -0.04 0.00 -2.02 0.00 0.00 178.31 177.32 1y8b h ALA 402 N 0.90 -0.11 -1.38 2.41 0.00 -1.37 -3.05 119.26 116.66 1y8b h ALA 402 Ca -0.10 -0.18 0.40 0.00 0.00 0.00 0.00 54.91 55.03 1y8b h ALA 402 Cb 1.87 0.04 -0.06 0.00 0.00 0.00 0.00 17.79 19.64 1y8b h ALA 402 CO 0.13 -0.12 1.07 -0.97 0.00 0.00 0.00 179.25 179.36 1y8b h ASN 403 N -0.99 0.00 0.23 0.00 -1.24 -1.51 2.54 115.58 114.61 1y8b h ASN 403 Ca -0.01 0.00 -0.01 0.00 0.71 0.00 0.00 56.30 56.99 1y8b h ASN 403 Cb 0.39 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.44 1y8b h ASN 403 CO 0.02 0.00 -0.11 0.50 -1.29 0.00 0.00 177.43 176.55 1y8b h LYS 404 N 0.00 -0.30 -0.18 6.67 3.11 -1.60 -3.23 116.57 121.05 1y8b h LYS 404 Ca 0.65 0.02 -0.17 0.00 -2.81 0.00 0.00 60.65 58.35 1y8b h LYS 404 Cb 2.79 0.07 -0.00 0.00 -1.00 0.00 0.00 32.23 34.08 1y8b h LYS 404 CO -0.01 -0.20 -0.58 -0.07 -2.81 0.00 0.00 179.45 175.79 1y8b h LEU 405 N -0.75 0.64 -1.85 5.20 3.38 -1.01 -2.86 115.31 118.05 1y8b h LEU 405 Ca -0.03 -0.35 0.30 0.00 0.09 0.00 0.00 57.88 57.89 1y8b h LEU 405 Cb 0.24 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.76 1y8b h LEU 405 CO 0.05 1.07 0.85 0.15 0.09 0.00 0.00 178.44 180.66 1y8b h PHE 406 N 0.43 0.00 0.00 1.13 3.57 0.42 1.58 116.94 124.07 1y8b h PHE 406 Ca 0.00 0.00 -0.15 0.00 3.53 0.00 0.00 57.97 61.35 1y8b h PHE 406 Cb 1.13 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.85 1y8b h PHE 406 CO 0.05 0.00 -0.99 1.79 -2.23 0.00 0.00 178.31 176.93 1y8b h THR 407 N 0.00 0.78 -0.24 4.41 1.35 -1.51 -3.02 112.91 114.67 1y8b h THR 407 Ca 0.49 -2.25 -0.03 0.00 -0.55 0.00 0.00 66.41 64.07 1y8b h THR 407 Cb 2.18 2.29 -0.01 0.00 -1.73 0.00 0.00 68.15 70.88 1y8b h THR 407 CO -0.01 0.45 0.03 -0.09 -0.25 0.00 0.00 175.52 175.65 1y8b h ARG 408 N 0.00 0.41 -0.19 4.72 2.43 0.23 0.50 114.38 122.48 1y8b h ARG 408 Ca -0.08 -0.12 -0.17 0.00 -0.81 0.00 0.00 59.98 58.81 1y8b h ARG 408 Cb 1.53 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 31.03 1y8b h ARG 408 CO 0.06 0.55 -0.56 -0.84 -1.51 0.00 0.00 179.97 177.67 1y8b h ILE 409 N 0.21 1.32 -0.22 1.20 3.07 -1.55 -2.39 117.51 119.14 1y8b h ILE 409 Ca 0.07 -1.81 -0.12 0.00 1.55 0.00 0.00 64.86 64.55 1y8b h ILE 409 Cb 0.35 1.77 -0.00 0.00 -0.27 0.00 0.00 36.82 38.67 1y8b h ILE 409 CO 0.01 0.57 -0.34 -0.33 -1.05 0.00 0.00 178.15 177.00 1y8b h GLU 410 N 0.45 0.63 0.00 0.16 3.07 -1.39 -0.18 114.58 117.32 1y8b h GLU 410 Ca 0.01 -0.37 -0.01 0.00 -0.50 0.00 0.00 59.36 58.49 1y8b h GLU 410 Cb 1.12 0.03 -0.00 0.00 -0.84 0.00 0.00 28.75 29.06 1y8b h GLU 410 CO 0.11 0.98 -0.03 1.79 -1.40 0.00 0.00 179.01 180.46 1y8b h THR 411 N 0.32 0.25 0.00 1.13 1.35 0.04 0.63 112.91 116.63 1y8b h THR 411 Ca 0.02 -0.22 -0.05 0.00 -0.55 0.00 0.00 66.41 65.61 1y8b h THR 411 Cb 0.93 1.17 -0.01 0.00 -1.73 0.00 0.00 68.15 68.50 1y8b h THR 411 CO 0.08 0.03 -0.45 -0.03 -0.25 0.00 0.00 175.52 174.90 1y8b h MET 412 N 0.00 0.00 -0.99 4.72 1.85 -1.05 -3.15 114.93 116.31 1y8b h MET 412 Ca -0.00 0.00 -0.22 0.00 -0.61 0.00 0.00 59.70 58.87 1y8b h MET 412 Cb 0.16 0.00 -0.13 0.00 0.43 0.00 0.00 31.60 32.06 1y8b h MET 412 CO 0.00 0.39 0.28 1.28 -0.40 0.00 0.00 176.91 178.46 1y8b n LEU 413 N -4.62 4.58 0.07 3.39 4.77 -0.11 -4.63 117.00 120.44 1y8b n LEU 413 Ca -0.11 -2.39 0.00 0.00 -0.03 0.00 0.00 56.01 53.48 1y8b n LEU 413 Cb 0.32 -0.65 0.00 0.00 -2.33 0.00 0.00 43.42 40.76 1y8b n LEU 413 CO 0.13 0.73 0.00 0.61 -1.33 0.00 0.00 177.39 177.53 1y8b n GLY 414 N -0.20 -1.69 2.81 -0.72 0.00 0.02 -4.38 105.19 101.04 1y8b n GLY 414 Ca 0.26 0.56 -0.01 0.00 0.00 0.00 0.00 46.02 46.82 1y8b n GLY 414 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1y8b n MET 415 N -2.85 -2.99 0.00 1.61 1.56 -0.10 -4.96 117.12 109.39 1y8b n MET 415 Ca 0.00 2.45 0.00 0.00 -0.27 0.00 0.00 57.70 59.88 1y8b n MET 415 Cb 0.00 -4.08 0.00 0.00 2.15 0.00 0.00 33.22 31.29 1y8b n MET 415 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1y8b n ALA 416 N 1.24 0.00 0.00 -5.12 0.00 -1.26 -5.05 120.51 110.32 1y8b n ALA 416 Ca -0.11 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.33 1y8b n ALA 416 Cb 0.26 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.70 1y8b n ALA 416 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1y8b h PRO 417 N 0.00 -0.02 -5.14 0.00 0.13 -2.00 -3.47 132.00 121.50 1y8b h PRO 417 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1y8b h PRO 417 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1y8b h PRO 417 CO 0.00 -0.01 -0.24 0.27 -0.23 0.00 0.00 178.00 177.79 1y8b n ASN 418 N -2.62 -6.01 -0.33 1.44 6.94 -1.26 -4.69 115.26 108.73 1y8b n ASN 418 Ca -0.00 0.65 0.19 0.00 -0.02 0.00 0.00 54.58 55.40 1y8b n ASN 418 Cb 0.01 -1.27 0.43 0.00 -2.36 0.00 0.00 39.78 36.60 1y8b n ASN 418 CO 0.00 0.00 0.00 0.71 -1.03 0.00 0.00 177.26 176.94 1y8b h THR 419 N 4.11 0.59 -4.89 5.53 1.35 -1.92 -3.47 112.91 114.22 1y8b h THR 419 Ca 0.00 -0.18 0.01 0.00 -0.55 0.00 0.00 66.41 65.68 1y8b h THR 419 Cb 0.24 0.01 -0.11 0.00 -1.73 0.00 0.00 68.15 66.56 1y8b h THR 419 CO 0.00 0.10 -1.47 0.18 -0.25 0.00 0.00 175.52 174.08 1y8b n LEU 420 N -4.70 -6.16 -4.95 3.87 4.77 -1.26 -4.70 117.00 103.87 1y8b n LEU 420 Ca 0.24 2.40 -0.23 0.00 -0.03 0.00 0.00 56.01 58.39 1y8b n LEU 420 Cb 0.75 -3.25 0.02 0.00 -2.33 0.00 0.00 43.42 38.61 1y8b n LEU 420 CO 0.23 -3.78 0.37 -1.59 -1.33 0.00 0.00 177.39 171.29 1y8b s LYS 421 N -0.67 2.87 -0.28 3.23 -2.85 -1.14 -4.73 119.74 116.16 1y8b s LYS 421 Ca -0.23 -0.44 -0.16 0.00 -1.00 0.00 0.00 55.97 54.14 1y8b s LYS 421 Cb 0.02 -2.46 0.11 0.00 -2.06 0.00 0.00 37.83 33.43 1y8b s LYS 421 CO 0.63 -0.51 0.79 0.00 0.10 0.00 0.00 175.35 176.36 1y8b s MET 422 N -4.73 0.59 -0.66 1.78 0.23 -1.20 -3.96 119.30 111.34 1y8b s MET 422 Ca 0.52 1.04 -0.26 0.00 -1.03 0.00 0.00 55.69 55.96 1y8b s MET 422 Cb -0.10 0.15 0.04 0.00 -1.53 0.00 0.00 34.83 33.39 1y8b s MET 422 CO 0.40 -0.13 1.14 0.20 -2.03 0.00 0.00 175.02 174.60 1y8b s GLY 423 N 1.61 1.12 -0.48 3.16 0.00 -0.66 -3.20 107.32 108.86 1y8b s GLY 423 Ca -0.09 -1.35 -0.29 0.00 0.00 0.00 0.00 44.72 42.99 1y8b s GLY 423 CO -0.18 2.40 1.29 -0.42 0.00 0.00 0.00 173.10 176.19 1y8b s ILE 424 N 4.95 4.00 -0.19 0.90 -1.09 -1.26 -3.74 121.20 124.77 1y8b s ILE 424 Ca 0.33 0.98 -0.02 0.00 -2.23 0.00 0.00 60.65 59.71 1y8b s ILE 424 Cb -0.11 -4.46 -0.01 0.00 -1.58 0.00 0.00 42.46 36.31 1y8b s ILE 424 CO 0.17 -1.00 -0.09 0.00 -1.23 0.00 0.00 174.94 172.79 1y8b s MET 425 N 4.88 3.35 1.02 2.79 0.23 -1.26 -4.90 119.30 125.42 1y8b s MET 425 Ca 0.53 -0.66 -0.17 0.00 -1.03 0.00 0.00 55.69 54.36 1y8b s MET 425 Cb -0.10 -2.84 0.26 0.00 -1.53 0.00 0.00 34.83 30.62 1y8b s MET 425 CO 0.30 -0.05 0.59 -0.40 -2.03 0.00 0.00 175.02 173.43 1y8b n ASP 426 N 4.33 -3.46 0.00 -1.18 5.68 -1.26 -4.56 116.55 116.10 1y8b n ASP 426 Ca -0.18 -0.59 0.00 0.00 -0.50 0.00 0.00 54.79 53.51 1y8b n ASP 426 Cb 0.51 -0.70 0.00 0.00 -1.14 0.00 0.00 41.12 39.80 1y8b n ASP 426 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1y8b n GLU 427 N -4.34 0.57 -3.17 0.11 1.02 -1.26 -4.95 120.64 108.62 1y8b n GLU 427 Ca 0.09 0.00 -0.24 0.00 -0.02 0.00 0.00 57.16 56.99 1y8b n GLU 427 Cb 0.41 -0.09 -0.05 0.00 -0.02 0.00 0.00 31.44 31.68 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 -0.24 1.92 -2.66 3.49 -0.58 -1.26 -4.84 120.64 116.47 1y8b n GLU 428 Ca 0.00 -4.06 -0.04 0.00 -0.42 0.00 0.00 57.16 52.64 1y8b n GLU 428 Cb 0.00 -1.88 0.02 0.00 -0.57 0.00 0.00 31.44 29.01 1y8b n GLU 428 CO 0.00 0.00 0.00 2.89 -0.48 0.00 0.00 177.13 179.54 1y8b n ARG 429 N 0.49 0.26 0.00 3.49 1.85 -1.26 -4.81 116.66 116.68 1y8b n ARG 429 Ca 0.27 -0.80 0.00 0.00 -1.00 0.00 0.00 57.85 56.32 1y8b n ARG 429 Cb 0.50 -0.05 0.00 0.00 -1.05 0.00 0.00 32.46 31.86 1y8b n ARG 429 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 1y8b n ARG 430 N -0.36 0.00 0.03 2.89 5.12 -1.26 -3.82 116.66 119.26 1y8b n ARG 430 Ca -0.22 0.00 -0.01 0.00 -1.93 0.00 0.00 57.85 55.68 1y8b n ARG 430 Cb 0.68 0.00 -0.01 0.00 -1.16 0.00 0.00 32.46 31.97 1y8b n ARG 430 CO 0.00 0.00 0.00 1.15 -1.93 0.00 0.00 177.63 176.85 1y8b h THR 431 N 0.00 0.00 -1.46 0.55 2.02 -1.94 -3.46 112.91 108.63 1y8b h THR 431 Ca 0.00 -0.14 -0.29 0.00 0.77 0.00 0.00 66.41 66.74 1y8b h THR 431 Cb 0.00 0.00 -0.23 0.00 -1.74 0.00 0.00 68.15 66.18 1y8b h THR 431 CO 0.00 0.00 -0.65 -0.94 0.37 0.00 0.00 175.52 174.30 1y8b s SER 432 N -3.18 -0.48 -0.22 4.18 1.04 -1.26 -4.79 113.70 108.99 1y8b s SER 432 Ca -0.01 -2.15 -0.01 0.00 0.48 0.00 0.00 55.95 54.26 1y8b s SER 432 Cb 0.00 1.12 -0.19 0.00 0.10 0.00 0.00 66.02 67.05 1y8b s SER 432 CO 0.04 -0.10 -0.08 0.18 0.98 0.00 0.00 173.24 174.27 1y8b n LEU 433 N 2.97 2.83 -2.98 2.42 4.32 -1.25 -4.47 117.00 120.84 1y8b n LEU 433 Ca 0.22 -0.02 -0.34 0.00 -0.02 0.00 0.00 56.01 55.84 1y8b n LEU 433 Cb 0.53 -0.96 0.01 0.00 -1.62 0.00 0.00 43.42 41.38 1y8b n LEU 433 CO 0.02 0.89 0.86 -3.20 -1.22 0.00 0.00 177.39 174.74 1y8b n ASN 434 N -3.38 6.09 -0.01 -1.43 2.85 -1.26 -4.77 115.26 113.35 1y8b n ASN 434 Ca -0.43 -3.74 -0.17 0.00 -0.11 0.00 0.00 54.58 50.14 1y8b n ASN 434 Cb 1.00 -0.82 -0.14 0.00 1.24 0.00 0.00 39.78 41.06 1y8b n ASN 434 CO 0.00 0.00 0.00 0.25 -2.11 0.00 0.00 177.26 175.40 1y8b h LEU 435 N 3.17 0.22 -1.04 1.20 6.46 -1.88 -3.28 115.31 120.17 1y8b h LEU 435 Ca 0.40 -0.97 0.18 0.00 -0.12 0.00 0.00 57.88 57.37 1y8b h LEU 435 Cb 0.43 -0.07 -0.03 0.00 -0.73 0.00 0.00 40.66 40.26 1y8b h LEU 435 CO 1.09 1.18 0.99 0.03 -0.62 0.00 0.00 178.44 181.10 1y8b h ARG 436 N -0.70 0.00 0.00 1.25 -0.00 -1.86 0.31 114.38 113.38 1y8b h ARG 436 Ca -0.06 0.00 -0.07 0.00 -0.50 0.00 0.00 59.98 59.35 1y8b h ARG 436 Cb 1.29 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 31.25 1y8b h ARG 436 CO 0.07 0.00 -0.40 0.77 0.00 0.00 0.00 179.97 180.41 1y8b h SER 437 N 0.00 0.00 -1.22 7.04 0.02 -1.88 -2.44 113.55 115.07 1y8b h SER 437 Ca 0.30 -0.63 0.35 0.00 -0.84 0.00 0.00 61.79 60.97 1y8b h SER 437 Cb 2.27 0.00 -0.08 0.00 0.14 0.00 0.00 62.40 64.73 1y8b h SER 437 CO -0.00 1.04 0.83 0.00 -1.14 0.00 0.00 176.83 177.56 1y8b h ILE 439 N 0.16 1.54 0.00 0.00 1.08 -1.52 -3.34 117.51 115.43 1y8b h ILE 439 Ca 0.66 -2.40 -0.04 0.00 -0.39 0.00 0.00 64.86 62.69 1y8b h ILE 439 Cb 2.18 3.15 -0.01 0.00 -3.07 0.00 0.00 36.82 39.07 1y8b h ILE 439 CO -0.19 0.62 -0.17 0.00 -0.69 0.00 0.00 178.15 177.72 1y8b h ALA 440 N -0.03 1.45 0.00 1.87 0.00 -0.30 -2.55 119.26 119.70 1y8b h ALA 440 Ca -0.11 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1y8b h ALA 440 Cb 1.31 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1y8b h ALA 440 CO 0.03 0.21 0.00 0.00 0.00 0.00 0.00 179.25 179.49 1y8b n GLN 441 N -3.94 0.40 -1.37 0.00 10.64 0.89 -2.99 117.38 121.01 1y8b n GLN 441 Ca -0.02 0.00 -0.06 0.00 -1.83 0.00 0.00 57.00 55.09 1y8b n GLN 441 Cb 0.26 -1.26 -0.02 0.00 -0.86 0.00 0.00 30.24 28.36 1y8b n GLN 441 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1y8b n ALA 442 N -0.76 3.37 0.00 2.61 0.00 -0.98 -4.96 120.51 119.79 1y8b n ALA 442 Ca 0.05 -0.73 0.00 0.00 0.00 0.00 0.00 53.44 52.76 1y8b n ALA 442 Cb 0.02 -0.44 0.00 0.00 0.00 0.00 0.00 19.45 19.03 1y8b n ALA 442 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1y8b n ARG 443 N -0.35 0.00 0.00 0.00 0.00 -1.09 -2.22 116.66 113.00 1y8b n ARG 443 Ca -0.25 0.05 0.00 0.00 -0.00 0.00 0.00 57.85 57.65 1y8b n ARG 443 Cb 0.73 -1.87 0.00 0.00 -0.00 0.00 0.00 32.46 31.31 1y8b n ARG 443 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.63 177.90 1y8b n ASN 444 N -0.98 0.00 -2.65 2.89 6.94 -1.26 -3.50 115.26 116.70 1y8b n ASN 444 Ca 0.00 0.00 -0.29 0.00 -0.02 0.00 0.00 54.58 54.27 1y8b n ASN 444 Cb 0.37 0.00 -0.05 0.00 -2.36 0.00 0.00 39.78 37.74 1y8b n ASN 444 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 1y8b n ARG 445 N -0.00 2.78 -2.79 -3.83 5.12 -1.17 -4.48 116.66 112.29 1y8b n ARG 445 Ca 0.00 -2.49 -0.43 0.00 -1.93 0.00 0.00 57.85 53.01 1y8b n ARG 445 Cb 0.00 -2.23 -0.04 0.00 -1.16 0.00 0.00 32.46 29.04 1y8b n ARG 445 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 1y8b s VAL 446 N -1.89 4.21 -0.36 1.55 0.11 -0.94 -3.90 120.40 119.17 1y8b s VAL 446 Ca 0.59 -0.06 0.03 0.00 -2.93 0.00 0.00 61.98 59.61 1y8b s VAL 446 Cb 0.34 -4.71 0.11 0.00 -1.53 0.00 0.00 36.38 30.59 1y8b s VAL 446 CO -0.19 -1.47 0.09 0.00 -3.33 0.00 0.00 175.10 170.20 1y8b s ALA 447 N 4.40 2.73 -0.25 1.54 0.00 -1.19 -4.90 121.76 124.08 1y8b s ALA 447 Ca 0.27 -2.52 -0.03 0.00 0.00 0.00 0.00 51.96 49.68 1y8b s ALA 447 Cb -0.14 -1.94 0.14 0.00 0.00 0.00 0.00 23.12 21.18 1y8b s ALA 447 CO 0.13 -1.74 0.44 0.12 0.00 0.00 0.00 175.76 174.70 1y8b s PHE 448 N 0.82 -1.01 -0.04 0.00 5.36 -1.24 -1.66 117.98 120.22 1y8b s PHE 448 Ca 0.12 1.14 0.00 0.00 -0.96 0.00 0.00 56.93 57.23 1y8b s PHE 448 Cb -0.20 0.19 0.03 0.00 -0.34 0.00 0.00 43.02 42.70 1y8b s PHE 448 CO -0.09 -0.73 -0.01 0.42 -1.46 0.00 0.00 175.22 173.35 1y8b s ILE 449 N 2.63 0.29 -0.03 3.12 -1.09 -1.26 -4.83 121.20 120.03 1y8b s ILE 449 Ca 0.13 0.06 -0.31 0.00 -2.23 0.00 0.00 60.65 58.30 1y8b s ILE 449 Cb -0.15 -0.39 0.12 0.00 -1.58 0.00 0.00 42.46 40.47 1y8b s ILE 449 CO -0.17 0.19 1.28 0.21 -1.23 0.00 0.00 174.94 175.22 1y8b s ASN 450 N 1.23 -0.07 0.00 3.58 3.84 -1.23 -4.68 114.94 117.62 1y8b s ASN 450 Ca -0.07 -0.12 0.00 0.00 0.21 0.00 0.00 52.86 52.88 1y8b s ASN 450 Cb -0.13 0.16 0.00 0.00 -0.55 0.00 0.00 41.25 40.73 1y8b s ASN 450 CO -0.02 -0.30 0.00 1.07 -2.79 0.00 0.00 177.10 175.07 1y8b n THR 451 N -0.45 0.00 0.00 -5.21 5.66 -1.24 -4.73 114.28 108.31 1y8b n THR 451 Ca -0.08 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.92 1y8b n THR 451 Cb 0.62 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.40 1y8b n THR 451 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1y8b n GLY 452 N -0.07 -1.22 3.87 1.09 0.00 0.51 -4.86 105.19 104.52 1y8b n GLY 452 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 1y8b n GLY 452 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1y8b s PHE 453 N 0.00 0.04 -0.05 1.61 -0.71 -1.26 -4.72 117.98 112.89 1y8b s PHE 453 Ca 0.00 -0.38 -0.30 0.00 -1.04 0.00 0.00 56.93 55.21 1y8b s PHE 453 Cb 0.00 0.67 0.11 0.00 -1.21 0.00 0.00 43.02 42.59 1y8b s PHE 453 CO 0.00 -0.80 0.94 -1.17 -1.34 0.00 0.00 175.22 172.85 1y8b s LEU 454 N -3.38 -0.34 0.63 -1.99 0.20 -1.26 -4.94 118.68 107.60 1y8b s LEU 454 Ca 0.21 0.05 0.20 0.00 0.69 0.00 0.00 54.13 55.29 1y8b s LEU 454 Cb -0.02 1.93 0.89 0.00 -0.43 0.00 0.00 46.19 48.56 1y8b s LEU 454 CO 0.04 -0.54 1.43 -0.78 -0.29 0.00 0.00 176.35 176.21 1y8b h ASP 455 N 2.07 0.00 1.06 3.68 3.58 -1.99 2.07 116.42 126.89 1y8b h ASP 455 Ca -0.20 0.00 -0.20 0.00 0.42 0.00 0.00 57.03 57.05 1y8b h ASP 455 Cb 1.22 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 42.24 1y8b h ASP 455 CO 0.30 0.00 -0.94 0.03 -2.88 0.00 0.00 179.24 175.75 1y8b h ARG 456 N 0.00 0.00 0.03 0.28 3.08 -1.96 -3.14 114.38 112.67 1y8b h ARG 456 Ca 0.23 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 60.17 1y8b h ARG 456 Cb 1.98 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 32.02 1y8b h ARG 456 CO -0.00 0.94 -0.56 1.79 -1.07 0.00 0.00 179.97 181.06 1y8b h THR 457 N 0.00 1.46 -0.67 2.04 1.35 0.30 -3.35 112.91 114.04 1y8b h THR 457 Ca -0.01 -2.34 0.14 0.00 -0.55 0.00 0.00 66.41 63.65 1y8b h THR 457 Cb 1.72 3.01 -0.10 0.00 -1.73 0.00 0.00 68.15 71.06 1y8b h THR 457 CO 0.12 0.56 0.15 1.23 -0.25 0.00 0.00 175.52 177.33 1y8b h GLY 458 N -0.80 0.90 0.53 5.82 0.00 -1.39 0.47 103.07 108.59 1y8b h GLY 458 Ca -0.14 -0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.16 1y8b h GLY 458 CO -0.03 -0.16 0.73 -0.55 0.00 0.00 0.00 176.54 176.54 1y8b h ASP 459 N 0.27 0.00 1.13 0.19 3.32 -1.67 1.58 116.42 121.23 1y8b h ASP 459 Ca 0.37 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.36 1y8b h ASP 459 Cb 0.59 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.13 1y8b h ASP 459 CO -0.46 0.00 -0.27 -0.33 -1.72 0.00 0.00 179.24 176.46 1y8b h GLU 460 N 0.00 0.00 0.00 3.56 5.08 -0.23 -2.91 114.58 120.08 1y8b h GLU 460 Ca 0.00 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 1y8b h GLU 460 Cb 1.46 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.70 1y8b h GLU 460 CO 0.00 0.27 -0.20 0.00 -1.00 0.00 0.00 179.01 178.08 1y8b h MET 461 N 0.00 0.00 0.00 2.33 -0.00 0.22 -2.64 114.93 114.84 1y8b h MET 461 Ca -0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 59.70 59.64 1y8b h MET 461 Cb 0.91 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.50 1y8b h MET 461 CO 0.04 0.20 -0.54 0.45 -0.00 0.00 0.00 176.91 177.05 1y8b h HIS 462 N 0.00 0.00 0.03 -0.10 3.86 -1.60 -3.22 115.15 114.12 1y8b h HIS 462 Ca -0.00 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1y8b h HIS 462 Cb 0.72 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.19 1y8b h HIS 462 CO 0.00 0.22 -0.01 1.03 0.86 0.00 0.00 177.93 180.03 1y8b h SER 463 N 0.00 -0.03 -0.01 2.45 0.87 -1.46 -1.94 113.55 113.42 1y8b h SER 463 Ca -0.02 -0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.47 1y8b h SER 463 Cb 1.19 0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.16 1y8b h SER 463 CO 0.03 0.05 0.00 1.33 -0.53 0.00 0.00 176.83 177.70 1y8b n VAL 464 N -5.07 0.01 1.45 2.23 0.24 -1.24 -3.31 118.33 112.63 1y8b n VAL 464 Ca -0.07 -0.04 0.15 0.00 -2.04 0.00 0.00 64.34 62.33 1y8b n VAL 464 Cb 0.08 -0.31 0.76 0.00 -1.47 0.00 0.00 33.84 32.90 1y8b n VAL 464 CO 0.00 0.00 0.00 0.80 -2.14 0.00 0.00 176.83 175.49 1y8b n MET 465 N -0.77 0.46 0.00 7.34 0.00 -0.73 -3.09 117.12 120.34 1y8b n MET 465 Ca 0.21 0.00 0.12 0.00 0.00 0.00 0.00 57.70 58.03 1y8b n MET 465 Cb 0.14 -1.50 0.69 0.00 0.00 0.00 0.00 33.22 32.55 1y8b n MET 465 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 175.97 174.06 1y8b n GLU 466 N -1.27 0.95 0.08 2.12 4.07 -1.21 -3.33 120.64 122.06 1y8b n GLU 466 Ca 0.15 0.00 -0.23 0.00 -0.06 0.00 0.00 57.16 57.02 1y8b n GLU 466 Cb 0.23 -1.38 -0.15 0.00 -0.06 0.00 0.00 31.44 30.08 1y8b n GLU 466 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1y8b h ALA 467 N 3.67 0.09 0.00 4.31 0.00 -1.84 -3.48 119.26 122.02 1y8b h ALA 467 Ca 0.00 -1.08 0.00 0.00 0.00 0.00 0.00 54.91 53.83 1y8b h ALA 467 Cb 0.00 0.41 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1y8b h ALA 467 CO 0.00 0.93 0.00 0.41 0.00 0.00 0.00 179.25 180.59 1y8b n GLY 468 N 1.83 0.07 3.44 0.00 0.00 -1.21 -5.06 105.19 104.25 1y8b n GLY 468 Ca -0.23 -0.73 -0.56 0.00 0.00 0.00 0.00 46.02 44.49 1y8b n GLY 468 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1y8b n PRO 469 N 0.00 0.64 -4.16 1.61 -0.02 -1.26 -4.93 135.00 126.88 1y8b n PRO 469 Ca 0.00 0.19 -0.32 0.00 -2.02 0.00 0.00 63.50 61.35 1y8b n PRO 469 Cb 0.00 -2.00 -0.08 0.00 -0.02 0.00 0.00 33.50 31.40 1y8b n PRO 469 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 1y8b s MET 470 N 5.52 2.93 0.00 -0.52 1.75 -1.26 -4.89 119.30 122.82 1y8b s MET 470 Ca 1.11 -0.56 0.00 0.00 -1.25 0.00 0.00 55.69 54.99 1y8b s MET 470 Cb -1.16 -2.77 0.00 0.00 2.84 0.00 0.00 34.83 33.74 1y8b s MET 470 CO 0.60 0.63 0.00 -0.11 -0.65 0.00 0.00 175.02 175.49 1y8b n LEU 471 N 1.18 0.00 -0.02 4.11 0.00 -1.26 -4.96 117.00 116.04 1y8b n LEU 471 Ca -0.13 0.00 0.07 0.00 0.00 0.00 0.00 56.01 55.95 1y8b n LEU 471 Cb 0.53 0.00 -0.14 0.00 0.00 0.00 0.00 43.42 43.80 1y8b n LEU 471 CO 0.37 0.00 -0.76 0.54 0.00 0.00 0.00 177.39 177.54 1y8b n ARG 472 N 0.00 0.64 -0.02 1.96 1.74 -1.26 -3.80 116.66 115.92 1y8b n ARG 472 Ca 0.00 -0.15 -0.12 0.00 -0.77 0.00 0.00 57.85 56.81 1y8b n ARG 472 Cb 0.00 -1.44 -0.08 0.00 -1.02 0.00 0.00 32.46 29.92 1y8b n ARG 472 CO 0.00 0.00 0.00 1.57 -1.52 0.00 0.00 177.63 177.68 1y8b h LYS 473 N 0.00 0.11 0.00 5.56 2.10 -1.95 -2.91 116.57 119.48 1y8b h LYS 473 Ca -0.06 -0.04 -0.01 0.00 -2.00 0.00 0.00 60.65 58.54 1y8b h LYS 473 Cb 1.00 -0.01 -0.00 0.00 -0.90 0.00 0.00 32.23 32.32 1y8b h LYS 473 CO 0.00 0.40 -0.06 -0.97 -2.00 0.00 0.00 179.45 176.83 1y8b h ASN 474 N -0.19 0.00 -0.05 7.07 -0.73 -1.95 -3.24 115.58 116.50 1y8b h ASN 474 Ca 0.02 -0.77 0.01 0.00 1.87 0.00 0.00 56.30 57.43 1y8b h ASN 474 Cb 0.35 0.00 -0.00 0.00 0.27 0.00 0.00 38.32 38.94 1y8b h ASN 474 CO 0.00 0.92 0.73 -0.61 -0.37 0.00 0.00 177.43 178.10 1y8b h GLN 475 N -1.00 0.00 0.03 6.67 -0.00 -1.68 1.81 115.11 120.94 1y8b h GLN 475 Ca -0.01 0.00 -0.21 0.00 -0.00 0.00 0.00 58.65 58.42 1y8b h GLN 475 Cb 0.81 0.00 -0.01 0.00 0.00 0.00 0.00 27.48 28.28 1y8b h GLN 475 CO -0.01 0.00 -0.98 1.98 0.00 0.00 0.00 178.83 179.82 1y8b h MET 476 N 0.00 0.13 0.00 1.69 4.05 -1.53 -3.11 114.93 116.17 1y8b h MET 476 Ca 0.02 -0.18 0.00 0.00 -0.28 0.00 0.00 59.70 59.26 1y8b h MET 476 Cb 1.48 0.06 0.00 0.00 -0.80 0.00 0.00 31.60 32.34 1y8b h MET 476 CO -0.00 1.01 0.00 -0.22 0.23 0.00 0.00 176.91 177.93 1y8b h LYS 477 N 0.06 0.00 -1.03 0.39 3.64 0.27 -3.18 116.57 116.71 1y8b h LYS 477 Ca -0.05 0.00 -0.64 0.00 -1.27 0.00 0.00 60.65 58.69 1y8b h LYS 477 Cb 1.67 0.00 -0.34 0.00 -0.41 0.00 0.00 32.23 33.16 1y8b h LYS 477 CO 0.14 0.00 0.30 0.43 -2.27 0.00 0.00 179.45 178.05 1y8b n SER 478 N -2.58 6.70 -3.66 4.20 7.64 -1.07 -4.94 113.62 119.91 1y8b n SER 478 Ca 0.03 -3.78 -0.10 0.00 1.01 0.00 0.00 58.87 56.03 1y8b n SER 478 Cb 0.37 -0.77 -0.08 0.00 -1.01 0.00 0.00 64.21 62.72 1y8b n SER 478 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1y8b s THR 479 N -4.81 -0.01 0.25 0.44 -4.23 -1.20 -5.00 115.64 101.08 1y8b s THR 479 Ca 0.59 0.02 0.01 0.00 -1.18 0.00 0.00 61.69 61.13 1y8b s THR 479 Cb 0.47 -0.86 0.01 0.00 1.34 0.00 0.00 72.50 73.46 1y8b s THR 479 CO -0.04 0.01 0.75 -2.65 -0.54 0.00 0.00 174.62 172.15 1y8b n PRO 480 N 3.67 0.02 0.32 3.99 -0.02 -1.26 -1.28 135.00 140.43 1y8b n PRO 480 Ca -0.18 0.41 0.20 0.00 -2.02 0.00 0.00 63.50 61.90 1y8b n PRO 480 Cb 0.57 -2.22 1.05 0.00 -0.02 0.00 0.00 33.50 32.87 1y8b n PRO 480 CO 0.00 0.00 0.00 -1.49 1.98 0.00 0.00 175.50 175.99 1y8b h TRP 481 N 0.00 0.00 -0.24 6.00 6.55 -1.95 -1.00 115.95 125.31 1y8b h TRP 481 Ca 0.00 0.00 -0.11 0.00 0.95 0.00 0.00 58.89 59.73 1y8b h TRP 481 Cb 1.35 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 29.64 1y8b h TRP 481 CO 0.00 0.00 -0.33 -0.84 -1.05 0.00 0.00 178.44 176.22 1y8b h ILE 482 N 0.00 1.29 0.00 1.49 -2.65 -1.36 -2.16 117.51 114.11 1y8b h ILE 482 Ca 0.01 -1.43 -0.01 0.00 1.03 0.00 0.00 64.86 64.47 1y8b h ILE 482 Cb 0.22 1.46 -0.00 0.00 -2.05 0.00 0.00 36.82 36.46 1y8b h ILE 482 CO -0.00 0.45 -0.03 0.11 0.03 0.00 0.00 178.15 178.72 1y8b h LYS 483 N 0.43 0.00 0.00 0.16 1.57 -1.43 -1.57 116.57 115.73 1y8b h LYS 483 Ca 0.05 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.80 1y8b h LYS 483 Cb 0.79 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.09 1y8b h LYS 483 CO 0.06 0.03 -0.34 0.00 -0.57 0.00 0.00 179.45 178.63 1y8b h ALA 484 N 1.97 0.04 -0.62 3.86 0.00 -1.51 -3.32 119.26 119.68 1y8b h ALA 484 Ca -0.00 -0.42 0.12 0.00 0.00 0.00 0.00 54.91 54.61 1y8b h ALA 484 Cb 0.06 0.26 -0.12 0.00 0.00 0.00 0.00 17.79 17.99 1y8b h ALA 484 CO 0.00 0.25 -0.19 -0.92 0.00 0.00 0.00 179.25 178.39 1y8b h TYR 485 N -1.00 -0.45 -0.89 0.00 5.03 -1.29 0.47 116.97 118.84 1y8b h TYR 485 Ca -0.05 0.06 0.24 0.00 2.58 0.00 0.00 58.73 61.56 1y8b h TYR 485 Cb 0.52 0.30 -0.15 0.00 1.55 0.00 0.00 36.73 38.95 1y8b h TYR 485 CO 0.00 -0.30 0.21 0.93 -1.32 0.00 0.00 178.16 177.69 1y8b h GLU 486 N -0.04 0.17 0.14 1.82 5.08 -1.44 -0.23 114.58 120.09 1y8b h GLU 486 Ca 0.29 -0.01 -0.32 0.00 -1.00 0.00 0.00 59.36 58.32 1y8b h GLU 486 Cb 0.49 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.70 1y8b h GLU 486 CO -0.66 0.11 -1.58 0.07 -1.00 0.00 0.00 179.01 175.96 1y8b h ARG 487 N 0.18 0.30 -0.01 2.33 0.11 -0.84 -3.37 114.38 113.08 1y8b h ARG 487 Ca 0.56 -0.51 0.03 0.00 0.10 0.00 0.00 59.98 60.16 1y8b h ARG 487 Cb 1.15 0.19 -0.05 0.00 1.11 0.00 0.00 29.97 32.36 1y8b h ARG 487 CO -0.69 1.18 -0.31 -0.91 0.10 0.00 0.00 179.97 179.34 1y8b h ASN 488 N 0.08 -0.94 -1.11 0.08 -0.26 0.15 0.66 115.58 114.24 1y8b h ASN 488 Ca -0.27 0.12 0.40 0.00 -0.56 0.00 0.00 56.30 56.00 1y8b h ASN 488 Cb 2.04 0.38 -0.16 0.00 -1.06 0.00 0.00 38.32 39.53 1y8b h ASN 488 CO 0.17 -0.37 0.65 0.78 -1.06 0.00 0.00 177.43 177.60 1y8b h ASN 489 N -0.45 0.35 0.73 5.81 -0.26 -1.35 2.62 115.58 123.02 1y8b h ASN 489 Ca 0.07 0.20 -0.26 0.00 -0.56 0.00 0.00 56.30 55.75 1y8b h ASN 489 Cb 0.55 0.19 -0.01 0.00 -1.06 0.00 0.00 38.32 37.99 1y8b h ASN 489 CO -0.27 -0.28 -1.20 0.58 -1.06 0.00 0.00 177.43 175.20 1y8b h VAL 490 N 0.11 1.53 0.07 2.81 2.07 -1.23 -1.97 116.25 119.63 1y8b h VAL 490 Ca 0.81 -3.15 -0.26 0.00 0.82 0.00 0.00 66.70 64.92 1y8b h VAL 490 Cb 2.21 2.90 -0.02 0.00 -1.52 0.00 0.00 31.29 34.86 1y8b h VAL 490 CO -0.61 0.91 -1.26 0.25 0.02 0.00 0.00 177.57 176.88 1y8b h LEU 491 N 0.05 0.22 0.00 2.57 7.12 0.36 -2.04 115.31 123.59 1y8b h LEU 491 Ca -0.11 -0.26 -0.01 0.00 0.13 0.00 0.00 57.88 57.64 1y8b h LEU 491 Cb 1.92 -0.07 -0.00 0.00 -0.53 0.00 0.00 40.66 41.97 1y8b h LEU 491 CO 0.18 1.21 -0.34 0.77 -0.13 0.00 0.00 178.44 180.13 1y8b h SER 492 N 0.04 0.00 0.00 1.25 4.64 0.38 -3.30 113.55 116.56 1y8b h SER 492 Ca -0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.20 1y8b h SER 492 Cb 1.91 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.00 1y8b h SER 492 CO 0.16 0.02 0.00 0.61 -0.87 0.00 0.00 176.83 176.75 1y8b n GLY 493 N 1.13 -0.18 0.29 -0.77 0.00 -0.74 -4.31 105.19 100.61 1y8b n GLY 493 Ca 0.03 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.13 1y8b n GLY 493 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1y8b h LEU 494 N 0.00 0.17 -2.26 0.99 6.46 -1.50 0.03 115.31 119.20 1y8b h LEU 494 Ca 0.00 0.14 -0.00 0.00 -0.12 0.00 0.00 57.88 57.90 1y8b h LEU 494 Cb 0.00 0.16 -0.00 0.00 -0.73 0.00 0.00 40.66 40.09 1y8b h LEU 494 CO 0.00 0.00 0.00 0.49 -0.62 0.00 0.00 178.44 178.31 1y8b n PHE 495 N -5.09 1.03 -0.05 1.25 3.01 -1.03 -1.53 117.46 115.06 1y8b n PHE 495 Ca 0.17 -0.36 -0.02 0.00 1.01 0.00 0.00 57.45 58.25 1y8b n PHE 495 Cb 0.52 -0.31 -0.11 0.00 -0.01 0.00 0.00 39.48 39.58 1y8b n PHE 495 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1y8b n GLY 497 N 1.99 -0.09 0.13 0.00 0.00 -1.25 -4.12 105.19 101.85 1y8b n GLY 497 Ca -0.16 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.64 1y8b n GLY 497 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1y8b h LEU 498 N 0.00 0.44 -2.38 0.99 4.07 -1.88 -3.45 115.31 113.10 1y8b h LEU 498 Ca 0.00 -0.90 -0.32 0.00 0.08 0.00 0.00 57.88 56.75 1y8b h LEU 498 Cb 0.00 -0.14 0.16 0.00 1.08 0.00 0.00 40.66 41.75 1y8b h LEU 498 CO 0.00 1.75 -0.86 0.54 -1.08 0.00 0.00 178.44 178.80 1y8b n ARG 499 N -3.70 -3.10 0.00 1.13 1.74 -0.58 -4.81 116.66 107.35 1y8b n ARG 499 Ca -0.28 0.76 0.00 0.00 -0.77 0.00 0.00 57.85 57.56 1y8b n ARG 499 Cb 0.99 -5.44 0.00 0.00 -1.02 0.00 0.00 32.46 26.99 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 -1.34 -2.10 2.98 -0.13 0.00 -1.26 -4.86 105.19 98.48 1y8b n GLY 500 Ca -0.14 0.65 -0.23 0.00 0.00 0.00 0.00 46.02 46.30 1y8b n GLY 500 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1y8b s LYS 501 N -0.10 1.40 0.01 1.61 3.01 -1.26 -4.47 119.74 119.94 1y8b s LYS 501 Ca 0.00 -0.31 -0.29 0.00 -1.01 0.00 0.00 55.97 54.36 1y8b s LYS 501 Cb 0.00 -1.21 0.11 0.00 -1.01 0.00 0.00 37.83 35.71 1y8b s LYS 501 CO 0.00 -0.01 1.24 0.00 0.51 0.00 0.00 175.35 177.09 1y8b s ALA 502 N 0.76 -2.20 -0.49 5.17 0.00 -1.26 -4.86 121.76 118.88 1y8b s ALA 502 Ca -0.13 0.42 -0.19 0.00 0.00 0.00 0.00 51.96 52.06 1y8b s ALA 502 Cb -0.15 0.53 0.05 0.00 0.00 0.00 0.00 23.12 23.55 1y8b s ALA 502 CO 0.02 -1.08 0.61 -0.65 0.00 0.00 0.00 175.76 174.67 1y8b s GLN 503 N -2.38 3.13 -0.48 0.00 -0.21 -1.26 -4.97 119.66 113.50 1y8b s GLN 503 Ca 0.18 -0.84 -0.15 0.00 0.02 0.00 0.00 55.36 54.57 1y8b s GLN 503 Cb 0.03 -4.08 0.08 0.00 1.00 0.00 0.00 33.01 30.04 1y8b s GLN 503 CO -0.02 -1.18 0.41 0.42 -2.12 0.00 0.00 175.29 172.80 1y8b s ILE 504 N 2.61 5.22 -0.68 1.08 -1.09 -1.26 -3.47 121.20 123.60 1y8b s ILE 504 Ca 0.15 -1.12 -0.18 0.00 -2.23 0.00 0.00 60.65 57.27 1y8b s ILE 504 Cb -0.19 -4.14 0.12 0.00 -1.58 0.00 0.00 42.46 36.67 1y8b s ILE 504 CO 0.13 -0.61 0.79 -0.83 -1.23 0.00 0.00 174.94 173.18 1y8b s GLY 505 N 2.71 1.92 0.66 6.18 0.00 -1.25 -3.01 107.32 114.54 1y8b s GLY 505 Ca 0.04 -2.48 -0.05 0.00 0.00 0.00 0.00 44.72 42.24 1y8b s GLY 505 CO 0.06 1.61 0.95 -1.59 0.00 0.00 0.00 173.10 174.13 1y8b s LYS 506 N 2.33 2.31 0.00 2.90 0.00 -1.17 0.19 119.74 126.30 1y8b s LYS 506 Ca 0.16 -0.39 0.00 0.00 0.00 0.00 0.00 55.97 55.74 1y8b s LYS 506 Cb -0.19 -2.26 0.00 0.00 0.00 0.00 0.00 37.83 35.39 1y8b s LYS 506 CO 0.01 -1.09 0.00 0.41 0.00 0.00 0.00 175.35 174.69 1y8b n GLY 507 N -2.76 3.74 1.59 0.59 0.00 -1.26 -4.19 105.19 102.90 1y8b n GLY 507 Ca 0.08 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1y8b n GLY 507 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1y8b n MET 508 N -0.52 0.00 -3.66 1.61 0.00 -1.26 -4.28 117.12 109.00 1y8b n MET 508 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 57.70 57.63 1y8b n MET 508 Cb 0.00 -0.15 -0.08 0.00 0.00 0.00 0.00 33.22 32.98 1y8b n MET 508 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 175.97 174.39 1y8b s TRP 509 N -1.90 -0.90 -0.39 3.17 0.52 -1.26 -5.08 118.94 113.10 1y8b s TRP 509 Ca 0.00 1.73 0.08 0.00 0.02 0.00 0.00 56.10 57.93 1y8b s TRP 509 Cb 0.00 0.46 0.25 0.00 -1.15 0.00 0.00 33.47 33.02 1y8b s TRP 509 CO 0.00 -0.49 0.53 0.00 0.02 0.00 0.00 176.95 177.01 1y8b n ALA 510 N 4.85 2.31 0.03 0.98 0.00 -1.26 -4.94 120.51 122.48 1y8b n ALA 510 Ca -0.16 -3.33 -0.16 0.00 0.00 0.00 0.00 53.44 49.80 1y8b n ALA 510 Cb 0.53 -0.83 -0.05 0.00 0.00 0.00 0.00 19.45 19.10 1y8b n ALA 510 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 1y8b h MET 511 N 4.03 0.60 -0.03 0.00 4.05 -1.98 -3.31 114.93 118.30 1y8b h MET 511 Ca 0.07 -0.56 -0.00 0.00 -0.28 0.00 0.00 59.70 58.92 1y8b h MET 511 Cb 0.89 0.14 -0.00 0.00 -0.80 0.00 0.00 31.60 31.82 1y8b h MET 511 CO 0.45 1.18 0.02 -1.35 0.23 0.00 0.00 176.91 177.44 1y8b h PRO 512 N 0.38 0.05 -0.25 0.39 0.11 -1.98 -3.45 132.00 127.24 1y8b h PRO 512 Ca -0.07 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 66.00 1y8b h PRO 512 Cb 1.50 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.59 1y8b h PRO 512 CO 0.17 0.15 -0.03 -0.25 -0.21 0.00 0.00 178.00 177.83 1y8b n ASP 513 N -5.00 -2.60 -4.63 -2.05 8.00 -1.25 -4.78 116.55 104.24 1y8b n ASP 513 Ca -0.07 0.04 -0.43 0.00 0.71 0.00 0.00 54.79 55.04 1y8b n ASP 513 Cb 0.09 -1.92 -0.03 0.00 -0.02 0.00 0.00 41.12 39.24 1y8b n ASP 513 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1y8b s LEU 514 N -0.52 3.94 0.30 0.64 2.96 -1.26 -4.62 118.68 120.12 1y8b s LEU 514 Ca 0.00 2.13 0.03 0.00 -0.22 0.00 0.00 54.13 56.07 1y8b s LEU 514 Cb 0.00 -3.52 0.60 0.00 0.50 0.00 0.00 46.19 43.76 1y8b s LEU 514 CO 0.00 -1.44 1.87 0.24 -1.32 0.00 0.00 176.35 175.70 1y8b h MET 515 N 12.29 0.92 0.18 1.98 2.86 -1.89 0.41 114.93 131.68 1y8b h MET 515 Ca -0.43 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.15 1y8b h MET 515 Cb 1.22 -0.21 0.00 0.00 0.06 0.00 0.00 31.60 32.67 1y8b h MET 515 CO 0.96 0.61 -0.09 0.00 1.06 0.00 0.00 176.91 179.46 1y8b h ALA 516 N 1.54 -0.24 -0.55 6.32 0.00 -1.88 -2.91 119.26 121.53 1y8b h ALA 516 Ca 0.45 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 55.18 1y8b h ALA 516 Cb 0.43 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 1y8b h ALA 516 CO -0.21 -0.61 -0.07 0.22 0.00 0.00 0.00 179.25 178.58 1y8b h ASP 517 N -0.30 1.01 -1.18 0.00 1.82 -1.71 -2.75 116.42 113.30 1y8b h ASP 517 Ca -0.02 -0.33 0.35 0.00 -0.39 0.00 0.00 57.03 56.63 1y8b h ASP 517 Cb 0.23 -0.27 -0.10 0.00 0.68 0.00 0.00 39.33 39.86 1y8b h ASP 517 CO 0.04 1.10 0.77 0.24 -1.61 0.00 0.00 179.24 179.79 1y8b h MET 518 N 0.89 0.22 -0.56 0.28 2.86 -0.03 0.60 114.93 119.19 1y8b h MET 518 Ca 0.15 -0.01 0.03 0.00 -2.06 0.00 0.00 59.70 57.81 1y8b h MET 518 Cb 0.63 -0.05 -0.04 0.00 0.06 0.00 0.00 31.60 32.20 1y8b h MET 518 CO 0.04 0.14 0.33 -0.92 1.06 0.00 0.00 176.91 177.56 1y8b h TYR 519 N 0.22 0.61 0.00 -0.22 3.20 -1.33 0.39 116.97 119.84 1y8b h TYR 519 Ca 0.69 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.58 1y8b h TYR 519 Cb 2.05 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 40.13 1y8b h TYR 519 CO -0.00 0.33 -1.05 0.43 -1.64 0.00 0.00 178.16 176.22 1y8b n SER 520 N -4.79 0.77 -0.04 -2.11 7.64 0.13 -3.14 113.62 112.08 1y8b n SER 520 Ca 0.05 0.27 -0.21 0.00 1.01 0.00 0.00 58.87 59.98 1y8b n SER 520 Cb 0.10 0.56 -0.13 0.00 -1.01 0.00 0.00 64.21 63.73 1y8b n SER 520 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 1y8b h GLN 521 N 0.00 0.15 0.00 1.43 1.08 0.25 -3.37 115.11 114.65 1y8b h GLN 521 Ca 0.00 -0.25 0.00 0.00 -1.45 0.00 0.00 58.65 56.95 1y8b h GLN 521 Cb 0.97 0.09 0.00 0.00 -0.05 0.00 0.00 27.48 28.49 1y8b h GLN 521 CO 0.00 1.12 -0.07 -0.22 -0.95 0.00 0.00 178.83 178.71 1y8b h LYS 522 N -0.51 0.00 0.00 1.46 1.63 -0.42 -3.21 116.57 115.53 1y8b h LYS 522 Ca -0.34 0.00 -0.04 0.00 -0.85 0.00 0.00 60.65 59.42 1y8b h LYS 522 Cb 1.62 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 33.24 1y8b h LYS 522 CO -0.04 0.00 -0.19 0.78 -3.45 0.00 0.00 179.45 176.55 1y8b h GLY 523 N 4.35 0.00 1.14 5.01 0.00 -1.61 -2.94 103.07 109.03 1y8b h GLY 523 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 47.33 46.99 1y8b h GLY 523 CO 0.00 0.00 -1.59 -0.55 0.00 0.00 0.00 176.54 174.40 1y8b h ASP 524 N 0.00 0.68 -0.72 0.19 3.32 -1.72 -3.29 116.42 114.88 1y8b h ASP 524 Ca -0.00 -0.85 0.21 0.00 0.02 0.00 0.00 57.03 56.40 1y8b h ASP 524 Cb 0.50 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.80 1y8b h ASP 524 CO 0.02 1.70 0.99 1.56 -1.72 0.00 0.00 179.24 181.79 1y8b h GLN 525 N 0.12 0.00 -0.35 3.56 7.50 -1.62 1.22 115.11 125.53 1y8b h GLN 525 Ca -0.29 0.00 -0.11 0.00 0.50 0.00 0.00 58.65 58.75 1y8b h GLN 525 Cb 2.12 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 29.63 1y8b h GLN 525 CO 0.22 0.00 -0.24 -0.07 -1.50 0.00 0.00 178.83 177.24 1y8b h LEU 526 N 0.00 0.72 -1.27 1.46 3.38 -1.68 -2.70 115.31 115.21 1y8b h LEU 526 Ca 0.34 -0.26 0.12 0.00 0.09 0.00 0.00 57.88 58.17 1y8b h LEU 526 Cb 2.32 -0.20 -0.07 0.00 0.09 0.00 0.00 40.66 42.81 1y8b h LEU 526 CO -0.00 0.94 0.57 0.03 0.09 0.00 0.00 178.44 180.06 1y8b h ARG 527 N 0.62 0.73 0.00 1.13 -0.00 0.13 0.73 114.38 117.72 1y8b h ARG 527 Ca 0.08 -0.04 0.00 0.00 -0.50 0.00 0.00 59.98 59.52 1y8b h ARG 527 Cb 0.74 -0.16 0.00 0.00 0.00 0.00 0.00 29.97 30.54 1y8b h ARG 527 CO 0.06 0.48 0.00 0.00 0.00 0.00 0.00 179.97 180.51 1y8b n ALA 528 N -2.43 2.30 -1.17 0.04 0.00 -1.02 -4.87 120.51 113.36 1y8b n ALA 528 Ca 0.16 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1y8b n ALA 528 Cb 0.40 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.49 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 0.45 0.28 3.33 0.00 0.00 0.26 -4.70 105.19 104.81 1y8b n GLY 529 Ca 0.16 -0.35 -0.28 0.00 0.00 0.00 0.00 46.02 45.54 1y8b n GLY 529 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y8b s ALA 530 N -2.78 2.15 0.00 4.61 0.00 -1.22 -4.83 121.76 119.69 1y8b s ALA 530 Ca 0.00 -1.27 0.00 0.00 0.00 0.00 0.00 51.96 50.69 1y8b s ALA 530 Cb 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 23.12 22.71 1y8b s ALA 530 CO 0.00 0.49 0.59 0.27 0.00 0.00 0.00 175.76 177.12 1y8b n ASN 531 N 1.55 0.00 -3.63 0.00 0.23 -1.26 -4.73 115.26 107.41 1y8b n ASN 531 Ca -0.17 -1.23 -0.11 0.00 -0.53 0.00 0.00 54.58 52.53 1y8b n ASN 531 Cb 0.53 -0.05 -0.07 0.00 -2.08 0.00 0.00 39.78 38.11 1y8b n ASN 531 CO 0.00 0.00 0.00 -0.89 -0.93 0.00 0.00 177.26 175.44 1y8b s THR 532 N 0.00 0.00 -0.03 5.53 2.01 -1.16 -4.31 115.64 117.68 1y8b s THR 532 Ca 0.00 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.00 1y8b s THR 532 Cb 0.00 -1.00 0.03 0.00 0.01 0.00 0.00 72.50 71.54 1y8b s THR 532 CO 0.00 0.00 0.01 0.00 -0.69 0.00 0.00 174.62 173.94 1y8b s ALA 533 N 0.84 0.25 0.25 7.40 0.00 -1.26 -3.02 121.76 126.22 1y8b s ALA 533 Ca -0.04 0.20 -0.30 0.00 0.00 0.00 0.00 51.96 51.83 1y8b s ALA 533 Cb -0.05 -0.33 -0.09 0.00 0.00 0.00 0.00 23.12 22.65 1y8b s ALA 533 CO -0.07 -0.12 1.17 -1.58 0.00 0.00 0.00 175.76 175.17 1y8b s TRP 534 N 1.12 3.43 -0.01 0.00 0.52 -1.26 -2.75 118.94 120.00 1y8b s TRP 534 Ca -0.08 1.55 -0.08 0.00 0.02 0.00 0.00 56.10 57.51 1y8b s TRP 534 Cb -0.13 -3.41 0.01 0.00 -1.15 0.00 0.00 33.47 28.79 1y8b s TRP 534 CO -0.02 -1.01 0.16 0.14 0.02 0.00 0.00 176.95 176.23 1y8b s VAL 535 N -0.76 0.07 -0.72 4.03 -7.23 -0.61 -4.97 120.40 110.21 1y8b s VAL 535 Ca 0.48 -0.57 0.26 0.00 -1.81 0.00 0.00 61.98 60.34 1y8b s VAL 535 Cb -0.34 -0.42 0.29 0.00 0.56 0.00 0.00 36.38 36.47 1y8b s VAL 535 CO 0.41 -0.32 1.78 -0.81 -0.31 0.00 0.00 175.10 175.85 1y8b n PRO 536 N 1.66 0.26 -4.12 4.82 -0.04 -1.26 -2.32 135.00 134.00 1y8b n PRO 536 Ca -0.21 0.22 -0.12 0.00 -0.04 0.00 0.00 63.50 63.35 1y8b n PRO 536 Cb 0.56 -1.81 -0.11 0.00 -0.04 0.00 0.00 33.50 32.10 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 -4.53 1.08 0.19 3.54 1.04 -1.26 -4.61 113.70 109.15 1y8b s SER 537 Ca 0.10 -0.77 -0.06 0.00 0.48 0.00 0.00 55.95 55.70 1y8b s SER 537 Cb 0.12 0.05 0.09 0.00 0.10 0.00 0.00 66.02 66.39 1y8b s SER 537 CO 0.59 -0.31 1.55 1.55 0.98 0.00 0.00 173.24 177.59 1y8b h PRO 538 N 3.74 0.78 -1.13 4.02 0.13 -1.92 -3.15 132.00 134.46 1y8b h PRO 538 Ca -0.36 -0.38 0.37 0.00 -0.87 0.00 0.00 66.00 64.75 1y8b h PRO 538 Cb 1.18 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.18 1y8b h PRO 538 CO 0.52 1.01 0.69 1.15 -0.23 0.00 0.00 178.00 181.14 1y8b h THR 539 N 0.64 0.24 0.17 1.56 2.02 -1.96 0.61 112.91 116.19 1y8b h THR 539 Ca 0.06 -0.07 -0.31 0.00 0.77 0.00 0.00 66.41 66.86 1y8b h THR 539 Cb 0.90 0.01 0.01 0.00 -1.74 0.00 0.00 68.15 67.33 1y8b h THR 539 CO 0.08 0.04 -1.42 0.00 0.37 0.00 0.00 175.52 174.59 1y8b h ALA 540 N 1.73 0.07 0.40 6.16 0.00 -1.96 -3.12 119.26 122.54 1y8b h ALA 540 Ca 0.76 -0.95 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 1y8b h ALA 540 Cb 2.05 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 19.98 1y8b h ALA 540 CO -0.50 0.94 -0.35 0.00 0.00 0.00 0.00 179.25 179.34 1y8b h ALA 541 N 0.40 -0.78 -0.76 0.00 0.00 0.18 0.38 119.26 118.68 1y8b h ALA 541 Ca -0.21 -0.13 0.07 0.00 0.00 0.00 0.00 54.91 54.64 1y8b h ALA 541 Cb 2.05 0.48 -0.06 0.00 0.00 0.00 0.00 17.79 20.26 1y8b h ALA 541 CO 0.21 -0.97 0.44 1.15 0.00 0.00 0.00 179.25 180.08 1y8b h THR 542 N -0.76 0.96 0.34 0.00 2.02 -1.27 -2.11 112.91 112.09 1y8b h THR 542 Ca -0.03 -0.27 -0.02 0.00 0.77 0.00 0.00 66.41 66.86 1y8b h THR 542 Cb 0.66 0.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.19 1y8b h THR 542 CO -0.03 0.14 -0.16 -0.07 0.37 0.00 0.00 175.52 175.77 1y8b h LEU 543 N 0.78 -0.38 -1.82 2.58 -0.00 -1.36 -1.57 115.31 113.55 1y8b h LEU 543 Ca 0.35 -0.05 0.09 0.00 -0.00 0.00 0.00 57.88 58.27 1y8b h LEU 543 Cb 0.24 0.10 -0.01 0.00 -0.00 0.00 0.00 40.66 40.99 1y8b h LEU 543 CO -0.20 -0.19 0.50 -0.74 -0.00 0.00 0.00 178.44 177.80 1y8b h HIS 544 N -0.55 0.00 -0.13 1.13 2.76 0.20 0.44 115.15 118.99 1y8b h HIS 544 Ca -0.05 0.00 -0.20 0.00 -2.20 0.00 0.00 60.37 57.92 1y8b h HIS 544 Cb 0.41 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.37 1y8b h HIS 544 CO -0.03 0.00 -0.73 0.00 -1.30 0.00 0.00 177.93 175.87 1y8b h ALA 545 N 1.30 0.46 0.00 5.26 0.00 -0.63 -3.14 119.26 122.50 1y8b h ALA 545 Ca 0.15 -0.59 -0.15 0.00 0.00 0.00 0.00 54.91 54.32 1y8b h ALA 545 Cb 1.14 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 1y8b h ALA 545 CO -0.00 0.71 -0.70 -0.07 0.00 0.00 0.00 179.25 179.19 1y8b h LEU 546 N 0.44 0.00 -1.40 0.00 3.38 -0.00 -3.26 115.31 114.47 1y8b h LEU 546 Ca -0.04 0.00 0.35 0.00 0.09 0.00 0.00 57.88 58.28 1y8b h LEU 546 Cb 1.33 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 41.97 1y8b h LEU 546 CO 0.14 0.70 0.76 0.45 0.09 0.00 0.00 178.44 180.58 1y8b h HIS 547 N 0.00 0.58 -0.07 1.13 3.86 -1.09 1.20 115.15 120.76 1y8b h HIS 547 Ca -0.01 0.02 0.02 0.00 -1.16 0.00 0.00 60.37 59.25 1y8b h HIS 547 Cb 1.54 -0.16 -0.00 0.00 1.06 0.00 0.00 27.41 29.85 1y8b h HIS 547 CO 0.00 -0.07 0.30 0.10 0.86 0.00 0.00 177.93 179.13 1y8b h TYR 548 N 0.24 0.00 -0.85 2.45 -0.00 -1.69 -2.48 116.97 114.63 1y8b h TYR 548 Ca 0.70 0.00 0.22 0.00 -0.00 0.00 0.00 58.73 59.65 1y8b h TYR 548 Cb 2.02 0.00 -0.14 0.00 -0.00 0.00 0.00 36.73 38.60 1y8b h TYR 548 CO -0.00 0.00 0.16 1.12 -0.00 0.00 0.00 178.16 179.44 1y8b h HIS 549 N 0.00 0.22 -0.57 0.10 2.07 0.12 0.30 115.15 117.39 1y8b h HIS 549 Ca 0.03 0.05 0.12 0.00 -2.85 0.00 0.00 60.37 57.72 1y8b h HIS 549 Cb 0.64 0.04 -0.10 0.00 2.57 0.00 0.00 27.41 30.56 1y8b h HIS 549 CO 0.00 -0.23 -0.04 1.96 -3.07 0.00 0.00 177.93 176.54 1y8b h GLN 550 N 0.17 0.08 -3.08 5.12 1.08 -1.66 -3.41 115.11 113.41 1y8b h GLN 550 Ca 0.52 -0.00 -0.18 0.00 -1.45 0.00 0.00 58.65 57.53 1y8b h GLN 550 Cb 1.02 -0.02 -0.28 0.00 -0.05 0.00 0.00 27.48 28.15 1y8b h GLN 550 CO -0.68 0.05 -0.47 0.99 -0.95 0.00 0.00 178.83 177.78 1y8b s THR 551 N -6.18 -0.02 -0.49 -0.54 2.01 0.10 -5.08 115.64 105.44 1y8b s THR 551 Ca -0.14 0.09 -0.26 0.00 0.31 0.00 0.00 61.69 61.69 1y8b s THR 551 Cb 0.18 -0.36 -0.07 0.00 0.01 0.00 0.00 72.50 72.25 1y8b s THR 551 CO 0.73 0.04 2.42 0.59 -0.69 0.00 0.00 174.62 177.71 1y8b n ASN 552 N 3.72 2.31 0.02 3.53 5.03 -1.21 -4.66 115.26 124.00 1y8b n ASN 552 Ca -0.20 -0.53 0.09 0.00 0.87 0.00 0.00 54.58 54.81 1y8b n ASN 552 Cb 0.55 -1.59 0.51 0.00 -1.02 0.00 0.00 39.78 38.24 1y8b n ASN 552 CO 0.00 0.00 0.00 -0.37 -1.83 0.00 0.00 177.26 175.06 1y8b h VAL 553 N 7.71 0.99 -0.62 2.41 -1.51 -1.90 -0.16 116.25 123.17 1y8b h VAL 553 Ca -0.24 -0.12 0.12 0.00 -1.23 0.00 0.00 66.70 65.23 1y8b h VAL 553 Cb 1.27 0.60 -0.04 0.00 -2.13 0.00 0.00 31.29 30.99 1y8b h VAL 553 CO 1.16 0.06 0.42 0.06 -1.23 0.00 0.00 177.57 178.04 1y8b h GLN 554 N 0.35 0.34 0.00 5.19 3.07 -1.94 -0.37 115.11 121.75 1y8b h GLN 554 Ca 0.17 -0.02 -0.25 0.00 0.09 0.00 0.00 58.65 58.64 1y8b h GLN 554 Cb 0.24 -0.08 -0.04 0.00 0.08 0.00 0.00 27.48 27.68 1y8b h GLN 554 CO -0.04 0.22 -1.43 0.66 0.09 0.00 0.00 178.83 178.33 1y8b h SER 555 N 0.35 0.00 -0.13 0.06 4.64 -1.43 -3.30 113.55 113.75 1y8b h SER 555 Ca 0.29 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.61 1y8b h SER 555 Cb 0.68 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.76 1y8b h SER 555 CO -0.08 0.93 0.06 0.58 -0.87 0.00 0.00 176.83 177.46 1y8b h VAL 556 N 0.00 1.11 -0.61 0.95 2.07 -0.41 0.73 116.25 120.10 1y8b h VAL 556 Ca -0.19 -0.32 0.04 0.00 0.82 0.00 0.00 66.70 67.06 1y8b h VAL 556 Cb 1.87 1.10 -0.05 0.00 -1.52 0.00 0.00 31.29 32.69 1y8b h VAL 556 CO 0.09 0.10 0.34 0.06 0.02 0.00 0.00 177.57 178.18 1y8b h GLN 557 N 0.09 0.63 -0.17 1.57 3.07 -1.47 -1.88 115.11 116.95 1y8b h GLN 557 Ca 0.04 -0.04 -0.04 0.00 0.09 0.00 0.00 58.65 58.70 1y8b h GLN 557 Cb 0.11 -0.14 -0.00 0.00 0.08 0.00 0.00 27.48 27.52 1y8b h GLN 557 CO -0.01 0.42 -0.06 0.00 0.09 0.00 0.00 178.83 179.28 1y8b h ALA 558 N 1.30 0.24 -0.64 0.06 0.00 -1.56 -1.14 119.26 117.52 1y8b h ALA 558 Ca 0.26 -0.26 0.09 0.00 0.00 0.00 0.00 54.91 55.00 1y8b h ALA 558 Cb 0.12 -0.06 -0.11 0.00 0.00 0.00 0.00 17.79 17.74 1y8b h ALA 558 CO -0.15 0.02 -0.46 -0.97 0.00 0.00 0.00 179.25 177.69 1y8b h ASN 559 N 0.04 -1.62 0.41 0.00 -0.73 0.11 0.67 115.58 114.46 1y8b h ASN 559 Ca 0.04 0.26 -0.07 0.00 1.87 0.00 0.00 56.30 58.40 1y8b h ASN 559 Cb 0.51 0.73 -0.01 0.00 0.27 0.00 0.00 38.32 39.82 1y8b h ASN 559 CO 0.02 -0.33 -0.35 0.16 -0.37 0.00 0.00 177.43 176.56 1y8b h ILE 560 N -0.20 1.17 -0.04 2.57 3.07 -1.34 -2.41 117.51 120.33 1y8b h ILE 560 Ca 0.18 -1.22 -0.02 0.00 1.55 0.00 0.00 64.86 65.35 1y8b h ILE 560 Cb 0.55 1.67 -0.00 0.00 -0.27 0.00 0.00 36.82 38.77 1y8b h ILE 560 CO -0.73 0.34 -0.06 0.00 -1.05 0.00 0.00 178.15 176.65 1y8b h ALA 561 N 1.65 1.83 -0.51 0.16 0.00 0.16 -0.68 119.26 121.87 1y8b h ALA 561 Ca -0.00 -0.08 -0.12 0.00 0.00 0.00 0.00 54.91 54.71 1y8b h ALA 561 Cb 0.65 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.33 1y8b h ALA 561 CO 0.05 0.13 0.15 0.94 0.00 0.00 0.00 179.25 180.52 1y8b n GLN 562 N -4.43 3.15 -4.62 0.00 7.27 -0.10 -4.90 117.38 113.73 1y8b n GLN 562 Ca -0.02 -2.19 -0.28 0.00 0.07 0.00 0.00 57.00 54.57 1y8b n GLN 562 Cb 0.16 -1.98 -0.10 0.00 2.41 0.00 0.00 30.24 30.73 1y8b n GLN 562 CO 0.00 0.00 0.00 0.95 0.07 0.00 0.00 177.06 178.08 1y8b s THR 563 N -2.27 1.70 -0.63 1.69 -4.23 -0.26 -5.04 115.64 106.60 1y8b s THR 563 Ca 0.39 -2.00 -0.02 0.00 -1.18 0.00 0.00 61.69 58.88 1y8b s THR 563 Cb 0.31 -2.79 0.39 0.00 1.34 0.00 0.00 72.50 71.75 1y8b s THR 563 CO 0.10 0.00 2.06 -1.84 -0.54 0.00 0.00 174.62 174.40 1y8b n GLU 564 N -0.99 2.55 0.19 3.99 0.00 -1.26 -4.57 120.64 120.55 1y8b n GLU 564 Ca -0.07 -3.02 0.14 0.00 0.00 0.00 0.00 57.16 54.21 1y8b n GLU 564 Cb 0.67 -2.18 0.66 0.00 0.00 0.00 0.00 31.44 30.59 1y8b n GLU 564 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.13 177.87 1y8b h PHE 565 N 2.05 0.00 0.00 -1.84 -1.00 -1.96 -2.60 116.94 111.60 1y8b h PHE 565 Ca 0.55 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.33 1y8b h PHE 565 Cb 0.74 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.30 1y8b h PHE 565 CO 1.31 0.00 0.18 -1.71 -1.61 0.00 0.00 178.31 176.49 1y8b n ASN 566 N -2.46 0.00 0.16 2.17 2.85 -1.26 0.16 115.26 116.88 1y8b n ASN 566 Ca -0.00 0.28 0.13 0.00 -0.11 0.00 0.00 54.58 54.88 1y8b n ASN 566 Cb 0.13 -0.28 0.51 0.00 1.24 0.00 0.00 39.78 41.38 1y8b n ASN 566 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1y8b h ALA 567 N 1.20 1.00 -0.00 5.20 0.00 -1.87 -2.49 119.26 122.30 1y8b h ALA 567 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1y8b h ALA 567 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1y8b h ALA 567 CO 0.00 0.00 -0.08 0.39 0.00 0.00 0.00 179.25 179.56 1y8b n GLU 568 N -2.47 0.25 0.32 0.00 1.02 0.12 -3.73 120.64 116.15 1y8b n GLU 568 Ca 0.02 -0.04 0.12 0.00 -0.02 0.00 0.00 57.16 57.25 1y8b n GLU 568 Cb 0.28 -1.50 0.67 0.00 -0.02 0.00 0.00 31.44 30.87 1y8b n GLU 568 CO 0.00 0.00 0.00 0.74 1.18 0.00 0.00 177.13 179.05 1y8b h PHE 569 N 0.10 0.00 0.00 -0.32 0.04 -1.63 -0.72 116.94 114.41 1y8b h PHE 569 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1y8b h PHE 569 Cb 0.41 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.56 1y8b h PHE 569 CO 0.00 0.00 -0.04 0.93 -0.60 0.00 0.00 178.31 178.60 1y8b h GLU 570 N 0.00 0.00 0.00 1.51 5.08 -1.83 -3.34 114.58 116.00 1y8b h GLU 570 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1y8b h GLU 570 Cb 0.82 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.07 1y8b h GLU 570 CO 0.00 0.00 0.01 -0.35 -1.00 0.00 0.00 179.01 177.67 1y8b n PRO 571 N -3.39 0.10 0.40 2.33 -0.04 -0.96 -2.97 135.00 130.45 1y8b n PRO 571 Ca -0.01 0.59 -0.15 0.00 -0.04 0.00 0.00 63.50 63.89 1y8b n PRO 571 Cb 0.02 -1.83 -0.07 0.00 -0.04 0.00 0.00 33.50 31.58 1y8b n PRO 571 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1y8b h LEU 572 N 0.00 -0.85 -2.49 1.53 3.38 -1.27 0.94 115.31 116.56 1y8b h LEU 572 Ca 0.00 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 1y8b h LEU 572 Cb 0.02 0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 1y8b h LEU 572 CO 0.00 -0.60 -0.02 0.25 0.09 0.00 0.00 178.44 178.16 1y8b h LEU 573 N -1.03 0.00 0.20 1.67 6.46 -1.71 0.14 115.31 121.04 1y8b h LEU 573 Ca -0.10 0.00 -0.30 0.00 -0.12 0.00 0.00 57.88 57.36 1y8b h LEU 573 Cb 0.77 0.00 0.02 0.00 -0.73 0.00 0.00 40.66 40.73 1y8b h LEU 573 CO 0.17 0.02 -1.37 -0.78 -0.62 0.00 0.00 178.44 175.87 1y8b h ASP 574 N 0.00 0.66 1.36 1.25 1.82 -1.48 -2.50 116.42 117.53 1y8b h ASP 574 Ca -0.00 -0.92 -0.07 0.00 -0.39 0.00 0.00 57.03 55.65 1y8b h ASP 574 Cb 0.10 -0.22 -0.01 0.00 0.68 0.00 0.00 39.33 39.88 1y8b h ASP 574 CO 0.00 1.64 -0.32 0.44 -1.61 0.00 0.00 179.24 179.39 1y8b h ASP 575 N -0.04 0.00 0.38 2.28 3.32 0.15 -2.89 116.42 119.62 1y8b h ASP 575 Ca -0.25 0.00 -0.32 0.00 0.02 0.00 0.00 57.03 56.48 1y8b h ASP 575 Cb 1.98 0.00 0.01 0.00 0.22 0.00 0.00 39.33 41.54 1y8b h ASP 575 CO 0.20 0.32 -1.52 0.25 -1.72 0.00 0.00 179.24 176.77 1y8b h LEU 576 N 0.00 0.56 -0.03 1.55 7.12 -0.83 -3.26 115.31 120.43 1y8b h LEU 576 Ca -0.00 -0.71 0.00 0.00 0.13 0.00 0.00 57.88 57.30 1y8b h LEU 576 Cb 1.09 -0.18 0.00 0.00 -0.53 0.00 0.00 40.66 41.03 1y8b h LEU 576 CO 0.04 1.58 -0.01 0.18 -0.13 0.00 0.00 178.44 180.09 1y8b n LEU 577 N -3.56 0.05 -4.69 2.25 4.77 -0.94 -4.82 117.00 110.06 1y8b n LEU 577 Ca -0.17 0.22 -0.42 0.00 -0.03 0.00 0.00 56.01 55.61 1y8b n LEU 577 Cb 1.06 -0.24 -0.03 0.00 -2.33 0.00 0.00 43.42 41.88 1y8b n LEU 577 CO 0.54 0.01 1.42 0.28 -1.33 0.00 0.00 177.39 178.31 1y8b s THR 578 N -2.49 2.64 -0.31 -5.08 -1.32 -1.09 -4.96 115.64 103.03 1y8b s THR 578 Ca 0.31 0.17 0.02 0.00 -1.21 0.00 0.00 61.69 60.99 1y8b s THR 578 Cb 0.20 -3.11 0.08 0.00 -1.51 0.00 0.00 72.50 68.16 1y8b s THR 578 CO 0.45 0.00 -0.01 0.27 -2.21 0.00 0.00 174.62 173.12 1y8b s ILE 579 N 2.59 2.39 -1.17 5.08 -4.36 -1.26 -5.03 121.20 119.44 1y8b s ILE 579 Ca 0.78 -1.93 -0.19 0.00 -0.26 0.00 0.00 60.65 59.05 1y8b s ILE 579 Cb -0.44 -2.57 -0.04 0.00 1.25 0.00 0.00 42.46 40.66 1y8b s ILE 579 CO 0.35 -0.32 1.98 -0.81 0.24 0.00 0.00 174.94 176.38 1y8b n PRO 580 N 4.39 2.28 -3.27 0.37 -0.04 -1.26 -4.59 135.00 132.89 1y8b n PRO 580 Ca -0.06 -2.49 -0.39 0.00 -0.04 0.00 0.00 63.50 60.52 1y8b n PRO 580 Cb 0.42 -3.30 -0.07 0.00 -0.04 0.00 0.00 33.50 30.51 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 5.42 5.10 -0.30 0.52 0.11 -1.26 -4.08 120.40 125.92 1y8b s VAL 581 Ca 0.56 0.87 -0.10 0.00 -2.93 0.00 0.00 61.98 60.38 1y8b s VAL 581 Cb 0.09 -3.81 0.18 0.00 -1.53 0.00 0.00 36.38 31.31 1y8b s VAL 581 CO 0.05 0.14 0.97 0.00 -3.33 0.00 0.00 175.10 172.93 1y8b s ALA 582 N 1.92 -3.42 0.00 1.54 0.00 -1.26 -4.64 121.76 115.90 1y8b s ALA 582 Ca 0.22 1.42 0.00 0.00 0.00 0.00 0.00 51.96 53.59 1y8b s ALA 582 Cb -0.15 -2.57 0.00 0.00 0.00 0.00 0.00 23.12 20.39 1y8b s ALA 582 CO 0.09 -1.67 0.77 -0.85 0.00 0.00 0.00 175.76 174.10 1y8b n GLU 583 N 5.36 0.47 -0.23 0.00 0.00 -1.26 -4.30 120.64 120.68 1y8b n GLU 583 Ca -0.01 0.00 0.04 0.00 0.00 0.00 0.00 57.16 57.19 1y8b n GLU 583 Cb 0.55 -1.27 0.15 0.00 0.00 0.00 0.00 31.44 30.87 1y8b n GLU 583 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.13 176.16 1y8b h ASN 584 N 2.03 -0.08 0.00 -1.84 -0.00 -1.94 -3.42 115.58 110.33 1y8b h ASN 584 Ca 0.00 0.15 0.00 0.00 -0.00 0.00 0.00 56.30 56.45 1y8b h ASN 584 Cb 0.47 0.22 0.00 0.00 -0.00 0.00 0.00 38.32 39.01 1y8b h ASN 584 CO 0.00 -0.06 0.00 0.00 -0.00 0.00 0.00 177.43 177.37 1y8b n ALA 585 N -2.70 0.00 -3.58 1.57 0.00 -1.26 -4.76 120.51 109.77 1y8b n ALA 585 Ca 0.12 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.36 1y8b n ALA 585 Cb 0.42 0.00 0.06 0.00 0.00 0.00 0.00 19.45 19.93 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 5.65 -2.53 -4.80 0.00 5.03 -1.26 -4.98 115.26 112.36 1y8b n ASN 586 Ca 0.00 -0.69 -0.32 0.00 0.87 0.00 0.00 54.58 54.44 1y8b n ASN 586 Cb 0.00 -4.66 -0.06 0.00 -1.02 0.00 0.00 39.78 34.04 1y8b n ASN 586 CO 0.00 0.00 0.00 0.26 -1.83 0.00 0.00 177.26 175.69 1y8b s TRP 587 N -3.45 3.30 0.50 3.10 0.52 -1.26 -5.09 118.94 116.56 1y8b s TRP 587 Ca 0.13 0.19 -0.20 0.00 0.02 0.00 0.00 56.10 56.24 1y8b s TRP 587 Cb -0.06 -1.72 -0.07 0.00 -1.15 0.00 0.00 33.47 30.47 1y8b s TRP 587 CO 0.77 0.55 1.08 -1.12 0.02 0.00 0.00 176.95 178.25 1y8b s SER 588 N -1.99 6.12 0.53 2.95 0.01 -1.26 -4.86 113.70 115.20 1y8b s SER 588 Ca 0.26 2.05 0.25 0.00 1.31 0.00 0.00 55.95 59.82 1y8b s SER 588 Cb -0.12 -2.57 1.40 0.00 0.21 0.00 0.00 66.02 64.93 1y8b s SER 588 CO 0.18 -0.94 2.01 0.00 0.41 0.00 0.00 173.24 174.90 1y8b h ALA 589 N 1.51 2.42 -0.20 1.44 0.00 -2.00 -0.15 119.26 122.29 1y8b h ALA 589 Ca -0.50 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.22 1y8b h ALA 589 Cb 1.24 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1y8b h ALA 589 CO 0.58 -0.58 -0.55 -0.56 0.00 0.00 0.00 179.25 178.14 1y8b h GLN 590 N 0.00 0.72 0.44 0.00 3.07 -1.97 -1.39 115.11 115.98 1y8b h GLN 590 Ca 0.22 -0.51 -0.02 0.00 0.09 0.00 0.00 58.65 58.43 1y8b h GLN 590 Cb 0.90 0.08 -0.01 0.00 0.08 0.00 0.00 27.48 28.53 1y8b h GLN 590 CO -0.00 1.14 -0.31 0.93 0.09 0.00 0.00 178.83 180.68 1y8b h GLU 591 N 0.44 -0.68 -0.52 0.06 4.39 -1.39 1.25 114.58 118.13 1y8b h GLU 591 Ca -0.01 0.05 0.10 0.00 0.34 0.00 0.00 59.36 59.83 1y8b h GLU 591 Cb 1.17 0.15 -0.08 0.00 -0.10 0.00 0.00 28.75 29.90 1y8b h GLU 591 CO 0.12 -0.45 0.04 0.82 -1.16 0.00 0.00 179.01 178.38 1y8b h ILE 592 N -0.71 0.63 -0.91 3.13 2.04 -1.55 0.76 117.51 120.91 1y8b h ILE 592 Ca -0.06 -0.06 -0.00 0.00 1.00 0.00 0.00 64.86 65.75 1y8b h ILE 592 Cb 0.58 0.46 -0.04 0.00 -0.74 0.00 0.00 36.82 37.07 1y8b h ILE 592 CO 0.03 0.03 0.56 -0.61 0.00 0.00 0.00 178.15 178.17 1y8b h GLN 593 N 0.16 1.23 0.38 2.37 4.15 -0.96 0.38 115.11 122.81 1y8b h GLN 593 Ca 0.26 -0.10 -0.02 0.00 0.77 0.00 0.00 58.65 59.56 1y8b h GLN 593 Cb 0.39 -0.26 0.00 0.00 0.21 0.00 0.00 27.48 27.82 1y8b h GLN 593 CO -0.40 0.85 -0.18 1.96 -1.93 0.00 0.00 178.83 179.12 1y8b h GLN 594 N 1.25 -0.49 -0.09 1.69 7.50 0.38 -0.91 115.11 124.44 1y8b h GLN 594 Ca 0.33 0.03 0.04 0.00 0.50 0.00 0.00 58.65 59.55 1y8b h GLN 594 Cb -0.08 0.11 -0.05 0.00 0.05 0.00 0.00 27.48 27.51 1y8b h GLN 594 CO -0.06 -0.33 -0.26 1.49 -1.50 0.00 0.00 178.83 178.17 1y8b h GLU 595 N -1.07 -0.34 -0.04 1.46 4.81 0.46 -0.82 114.58 119.04 1y8b h GLU 595 Ca -0.05 0.02 0.04 0.00 -0.13 0.00 0.00 59.36 59.24 1y8b h GLU 595 Cb 0.39 0.08 -0.05 0.00 0.63 0.00 0.00 28.75 29.80 1y8b h GLU 595 CO 0.09 -0.23 -0.30 1.25 -0.73 0.00 0.00 179.01 179.09 1y8b h LEU 596 N -0.35 -0.90 -1.66 1.64 5.85 -0.35 0.48 115.31 120.01 1y8b h LEU 596 Ca 0.09 0.12 0.31 0.00 0.84 0.00 0.00 57.88 59.24 1y8b h LEU 596 Cb 0.48 0.37 -0.07 0.00 0.37 0.00 0.00 40.66 41.81 1y8b h LEU 596 CO -0.29 -0.36 0.77 0.44 -0.34 0.00 0.00 178.44 178.66 1y8b h ASP 597 N -0.42 0.23 0.42 1.25 3.32 -0.48 0.35 116.42 121.07 1y8b h ASP 597 Ca 0.07 0.05 -0.31 0.00 0.02 0.00 0.00 57.03 56.86 1y8b h ASP 597 Cb 0.53 0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.09 1y8b h ASP 597 CO -0.28 0.03 -1.53 0.78 -1.72 0.00 0.00 179.24 176.52 1y8b h ASN 598 N 0.19 0.47 -0.20 6.45 4.21 0.68 -3.09 115.58 124.30 1y8b h ASN 598 Ca 0.60 -0.62 -0.07 0.00 1.21 0.00 0.00 56.30 57.42 1y8b h ASN 598 Cb 1.93 -0.15 -0.00 0.00 -1.12 0.00 0.00 38.32 38.97 1y8b h ASN 598 CO -0.17 1.51 -0.13 0.78 -1.29 0.00 0.00 177.43 178.13 1y8b h ASN 599 N 0.08 0.46 0.78 5.81 -0.26 0.32 -3.02 115.58 119.75 1y8b h ASN 599 Ca -0.25 -0.44 -0.04 0.00 -0.56 0.00 0.00 56.30 55.01 1y8b h ASN 599 Cb 2.04 -0.13 0.01 0.00 -1.06 0.00 0.00 38.32 39.18 1y8b h ASN 599 CO 0.18 0.80 -0.38 -0.37 -1.06 0.00 0.00 177.43 176.60 1y8b h VAL 600 N 0.12 0.18 -0.99 2.81 -1.51 -0.64 -2.60 116.25 113.61 1y8b h VAL 600 Ca 0.04 -0.08 0.37 0.00 -1.23 0.00 0.00 66.70 65.79 1y8b h VAL 600 Cb 0.65 0.20 -0.17 0.00 -2.13 0.00 0.00 31.29 29.84 1y8b h VAL 600 CO 0.04 0.01 0.47 -0.61 -1.23 0.00 0.00 177.57 176.24 1y8b h GLN 601 N -1.12 0.09 -0.65 5.19 -0.00 -1.61 0.90 115.11 117.91 1y8b h GLN 601 Ca -0.11 -0.01 0.06 0.00 -0.00 0.00 0.00 58.65 58.59 1y8b h GLN 601 Cb 0.82 -0.02 -0.05 0.00 0.00 0.00 0.00 27.48 28.22 1y8b h GLN 601 CO 0.18 0.06 0.36 0.78 0.00 0.00 0.00 178.83 180.21 1y8b h GLY 602 N 0.10 0.95 0.70 2.39 0.00 -1.33 0.01 103.07 105.89 1y8b h GLY 602 Ca 0.77 -0.25 -0.01 0.00 0.00 0.00 0.00 47.33 47.84 1y8b h GLY 602 CO -0.74 0.15 -0.01 1.19 0.00 0.00 0.00 176.54 177.13 1y8b h ILE 603 N 0.66 1.27 -0.54 2.60 2.10 0.91 -2.30 117.51 122.22 1y8b h ILE 603 Ca 0.29 -0.84 0.04 0.00 1.08 0.00 0.00 64.86 65.42 1y8b h ILE 603 Cb 0.19 1.73 -0.03 0.00 -1.09 0.00 0.00 36.82 37.62 1y8b h ILE 603 CO -0.18 0.23 0.36 -0.07 -1.08 0.00 0.00 178.15 177.41 1y8b h LEU 604 N -0.22 0.52 -0.13 2.19 3.38 -1.05 0.79 115.31 120.79 1y8b h LEU 604 Ca 0.01 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1y8b h LEU 604 Cb 0.37 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 1y8b h LEU 604 CO 0.00 0.36 -0.05 1.23 0.09 0.00 0.00 178.44 180.07 1y8b h GLY 605 N 0.60 0.29 2.00 0.83 0.00 -0.83 0.64 103.07 106.60 1y8b h GLY 605 Ca 0.22 -0.25 -0.13 0.00 0.00 0.00 0.00 47.33 47.17 1y8b h GLY 605 CO -0.06 0.23 -0.62 -1.82 0.00 0.00 0.00 176.54 174.28 1y8b h TYR 606 N -0.07 0.00 0.06 5.60 5.03 -0.95 -1.27 116.97 125.37 1y8b h TYR 606 Ca 0.03 0.00 -0.27 0.00 2.58 0.00 0.00 58.73 61.07 1y8b h TYR 606 Cb 0.51 0.00 -0.02 0.00 1.55 0.00 0.00 36.73 38.77 1y8b h TYR 606 CO 0.06 0.62 -1.33 0.28 -1.32 0.00 0.00 178.16 176.47 1y8b h VAL 607 N 0.00 1.36 0.09 1.81 2.07 0.67 -1.91 116.25 120.33 1y8b h VAL 607 Ca -0.01 -3.04 -0.28 0.00 0.82 0.00 0.00 66.70 64.19 1y8b h VAL 607 Cb 1.28 2.77 -0.01 0.00 -1.52 0.00 0.00 31.29 33.80 1y8b h VAL 607 CO 0.08 0.83 -1.41 1.62 0.02 0.00 0.00 177.57 178.71 1y8b h VAL 608 N 0.03 1.27 0.20 2.57 3.04 0.28 -2.96 116.25 120.69 1y8b h VAL 608 Ca -0.15 -2.93 -0.35 0.00 -1.01 0.00 0.00 66.70 62.26 1y8b h VAL 608 Cb 1.92 2.77 0.02 0.00 -2.01 0.00 0.00 31.29 33.99 1y8b h VAL 608 CO 0.14 0.82 -1.69 -0.09 -1.01 0.00 0.00 177.57 175.75 1y8b h ARG 609 N 0.05 0.43 0.14 4.17 9.65 -1.35 -3.09 114.38 124.38 1y8b h ARG 609 Ca -0.19 -0.73 -0.01 0.00 -1.10 0.00 0.00 59.98 57.95 1y8b h ARG 609 Cb 1.97 0.27 0.00 0.00 -1.39 0.00 0.00 29.97 30.82 1y8b h ARG 609 CO 0.16 1.34 -0.07 2.35 2.80 0.00 0.00 179.97 186.55 1y8b h TRP 610 N 0.12 -0.18 -0.88 2.20 2.91 -1.45 0.60 115.95 119.26 1y8b h TRP 610 Ca -0.32 -0.00 0.13 0.00 1.13 0.00 0.00 58.89 59.83 1y8b h TRP 610 Cb 2.12 0.06 -0.07 0.00 -0.51 0.00 0.00 29.16 30.76 1y8b h TRP 610 CO 0.11 -0.11 0.57 0.28 -1.03 0.00 0.00 178.44 178.26 1y8b h VAL 611 N -0.63 0.86 0.00 2.65 2.07 -1.65 2.53 116.25 122.08 1y8b h VAL 611 Ca -0.02 -0.25 -0.20 0.00 0.82 0.00 0.00 66.70 67.05 1y8b h VAL 611 Cb 0.15 0.07 -0.03 0.00 -1.52 0.00 0.00 31.29 29.96 1y8b h VAL 611 CO 0.03 0.13 -1.10 -0.08 0.02 0.00 0.00 177.57 176.57 1y8b h GLU 612 N 0.73 0.00 0.00 1.57 4.81 -1.65 -3.39 114.58 116.65 1y8b h GLU 612 Ca 0.44 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.67 1y8b h GLU 612 Cb 0.65 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.03 1y8b h GLU 612 CO -0.20 0.94 -0.69 0.37 -0.73 0.00 0.00 179.01 178.70 1y8b h GLN 613 N -1.00 0.00 -1.18 1.92 5.75 0.24 -3.48 115.11 117.36 1y8b h GLN 613 Ca -0.30 0.00 -0.32 0.00 -0.15 0.00 0.00 58.65 57.88 1y8b h GLN 613 Cb 1.23 0.00 -0.10 0.00 1.07 0.00 0.00 27.48 29.68 1y8b h GLN 613 CO -0.18 0.00 -0.33 0.41 -2.65 0.00 0.00 178.83 176.08 1y8b n GLY 614 N 1.24 1.06 3.36 2.39 0.00 0.85 -4.93 105.19 109.15 1y8b n GLY 614 Ca 0.02 -0.26 -0.13 0.00 0.00 0.00 0.00 46.02 45.65 1y8b n GLY 614 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1y8b s ILE 615 N -2.64 0.04 -0.02 -0.61 -4.36 -1.23 -4.98 121.20 107.40 1y8b s ILE 615 Ca 0.00 -0.35 0.22 0.00 -0.26 0.00 0.00 60.65 60.26 1y8b s ILE 615 Cb 0.00 -0.99 0.38 0.00 1.25 0.00 0.00 42.46 43.10 1y8b s ILE 615 CO 0.00 -0.19 1.16 0.61 0.24 0.00 0.00 174.94 176.76 1y8b n GLY 616 N 0.33 1.35 3.84 6.27 0.00 -1.26 -3.86 105.19 111.85 1y8b n GLY 616 Ca -0.18 -0.81 -0.32 0.00 0.00 0.00 0.00 46.02 44.71 1y8b n GLY 616 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y8b n SER 618 N -2.01 -0.32 -4.89 0.00 7.64 -1.26 -4.98 113.62 107.80 1y8b n SER 618 Ca 0.07 0.00 -0.29 0.00 1.01 0.00 0.00 58.87 59.66 1y8b n SER 618 Cb 0.54 0.99 0.03 0.00 -1.01 0.00 0.00 64.21 64.76 1y8b n SER 618 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1y8b s LYS 619 N -4.63 3.11 0.06 1.43 1.02 -1.26 -5.03 119.74 114.44 1y8b s LYS 619 Ca 0.00 0.37 0.06 0.00 0.02 0.00 0.00 55.97 56.42 1y8b s LYS 619 Cb 0.00 -2.14 -0.04 0.00 -0.52 0.00 0.00 37.83 35.13 1y8b s LYS 619 CO 0.00 -0.75 -0.11 0.14 -0.92 0.00 0.00 175.35 173.71 1y8b s VAL 620 N -3.15 3.28 0.37 3.17 -7.23 -1.25 -4.95 120.40 110.63 1y8b s VAL 620 Ca 0.55 -1.12 -0.26 0.00 -1.81 0.00 0.00 61.98 59.34 1y8b s VAL 620 Cb -0.11 -2.47 -0.09 0.00 0.56 0.00 0.00 36.38 34.28 1y8b s VAL 620 CO 0.50 0.24 1.07 -2.16 -0.31 0.00 0.00 175.10 174.44 1y8b s PRO 621 N -1.80 4.29 0.00 4.82 0.04 -1.26 -2.24 135.00 138.85 1y8b s PRO 621 Ca 0.18 1.62 0.00 0.00 0.04 0.00 0.00 61.00 62.84 1y8b s PRO 621 Cb -0.11 -2.73 0.00 0.00 0.04 0.00 0.00 34.50 31.70 1y8b s PRO 621 CO 0.10 -0.06 0.00 -3.47 0.04 0.00 0.00 177.00 173.61 1y8b n ASP 622 N 0.29 0.00 0.00 6.66 2.03 0.22 -4.84 116.55 120.91 1y8b n ASP 622 Ca 0.03 -0.59 0.08 0.00 0.52 0.00 0.00 54.79 54.84 1y8b n ASP 622 Cb 0.48 0.00 0.42 0.00 -0.72 0.00 0.00 41.12 41.30 1y8b n ASP 622 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 1y8b n ILE 623 N -0.68 0.54 -1.35 5.18 2.08 -1.26 -2.13 119.36 121.73 1y8b n ILE 623 Ca 0.00 0.13 0.07 0.00 0.56 0.00 0.00 62.75 63.52 1y8b n ILE 623 Cb 0.00 -0.85 0.10 0.00 -0.75 0.00 0.00 39.64 38.14 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 -1.31 0.00 -0.96 1.39 8.25 -1.26 -4.94 115.22 116.39 1y8b n HIS 624 Ca 0.08 -0.72 0.00 0.00 -0.26 0.00 0.00 57.72 56.81 1y8b n HIS 624 Cb 0.14 -0.12 0.00 0.00 1.12 0.00 0.00 29.99 31.13 1y8b n HIS 624 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1y8b n ASN 625 N -1.01 -2.85 -4.80 0.41 5.03 -0.91 -4.99 115.26 106.14 1y8b n ASN 625 Ca 0.11 0.00 -0.33 0.00 0.87 0.00 0.00 54.58 55.23 1y8b n ASN 625 Cb 0.66 -1.21 -0.00 0.00 -1.02 0.00 0.00 39.78 38.21 1y8b n ASN 625 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1y8b s VAL 626 N -2.08 3.68 -0.22 2.41 1.01 -1.26 -4.42 120.40 119.51 1y8b s VAL 626 Ca 0.00 0.89 -0.15 0.00 0.00 0.00 0.00 61.98 62.73 1y8b s VAL 626 Cb 0.00 -3.37 -0.04 0.00 0.00 0.00 0.00 36.38 32.97 1y8b s VAL 626 CO 0.00 -0.38 0.36 0.00 0.00 0.00 0.00 175.10 175.09 1y8b s ALA 627 N -2.23 3.57 0.12 5.51 0.00 -1.26 0.73 121.76 128.19 1y8b s ALA 627 Ca 0.66 -0.65 0.06 0.00 0.00 0.00 0.00 51.96 52.03 1y8b s ALA 627 Cb -0.17 -2.62 -0.04 0.00 0.00 0.00 0.00 23.12 20.29 1y8b s ALA 627 CO 0.31 -0.38 -0.03 -0.51 0.00 0.00 0.00 175.76 175.15 1y8b s LEU 628 N 1.49 3.29 -0.41 0.00 1.43 -0.95 -4.87 118.68 118.66 1y8b s LEU 628 Ca 0.16 -0.30 -0.12 0.00 -1.03 0.00 0.00 54.13 52.84 1y8b s LEU 628 Cb -0.15 -2.02 0.05 0.00 0.03 0.00 0.00 46.19 44.10 1y8b s LEU 628 CO 0.08 0.15 0.27 -0.32 0.23 0.00 0.00 176.35 176.77 1y8b s MET 629 N -2.44 2.82 -0.10 1.70 -2.45 -1.26 -3.80 119.30 113.76 1y8b s MET 629 Ca 0.25 -1.23 0.00 0.00 -1.25 0.00 0.00 55.69 53.46 1y8b s MET 629 Cb -0.11 -3.87 0.02 0.00 1.25 0.00 0.00 34.83 32.13 1y8b s MET 629 CO 0.17 -0.85 -0.08 -1.83 1.05 0.00 0.00 175.02 173.48 1y8b s GLU 630 N 1.56 1.53 0.00 4.11 -1.05 -1.26 -4.94 118.70 118.65 1y8b s GLU 630 Ca 0.03 -0.28 0.00 0.00 -0.15 0.00 0.00 54.97 54.57 1y8b s GLU 630 Cb -0.21 -1.52 0.00 0.00 -0.44 0.00 0.00 34.13 31.96 1y8b s GLU 630 CO 0.06 -0.20 0.00 -0.25 0.95 0.00 0.00 175.26 175.82 1y8b n ASP 631 N 4.67 0.01 0.00 0.83 8.00 -1.26 -4.91 116.55 123.89 1y8b n ASP 631 Ca -0.15 -0.06 0.00 0.00 0.71 0.00 0.00 54.79 55.29 1y8b n ASP 631 Cb 0.50 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.60 1y8b n ASP 631 CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 1y8b n ARG 632 N 0.00 0.00 0.24 -1.24 0.00 -1.26 -0.70 116.66 113.70 1y8b n ARG 632 Ca 0.00 0.07 0.15 0.00 -0.00 0.00 0.00 57.85 58.07 1y8b n ARG 632 Cb 0.00 -1.51 0.50 0.00 -0.00 0.00 0.00 32.46 31.44 1y8b n ARG 632 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1y8b h ALA 633 N 1.68 1.00 0.00 2.89 0.00 -1.94 -3.14 119.26 119.75 1y8b h ALA 633 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 1y8b h ALA 633 Cb 0.03 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1y8b h ALA 633 CO 0.00 0.00 -0.43 1.79 0.00 0.00 0.00 179.25 180.61 1y8b h THR 634 N 0.00 1.18 -1.13 0.00 1.35 -1.09 -1.40 112.91 111.82 1y8b h THR 634 Ca 0.00 -2.04 0.32 0.00 -0.55 0.00 0.00 66.41 64.14 1y8b h THR 634 Cb 0.66 2.37 -0.07 0.00 -1.73 0.00 0.00 68.15 69.39 1y8b h THR 634 CO 0.00 0.40 0.78 -0.07 -0.25 0.00 0.00 175.52 176.38 1y8b h LEU 635 N -1.00 0.16 0.00 3.87 -0.00 -1.71 0.49 115.31 117.12 1y8b h LEU 635 Ca -0.11 0.03 -0.08 0.00 -0.00 0.00 0.00 57.88 57.73 1y8b h LEU 635 Cb 0.94 0.01 -0.01 0.00 -0.00 0.00 0.00 40.66 41.59 1y8b h LEU 635 CO -0.07 0.02 -1.50 -2.11 -0.00 0.00 0.00 178.44 174.78 1y8b n ARG 636 N -4.36 0.63 -3.45 1.13 1.85 -1.19 -4.57 116.66 106.71 1y8b n ARG 636 Ca 0.26 0.05 -0.28 0.00 -1.00 0.00 0.00 57.85 56.88 1y8b n ARG 636 Cb 1.11 -1.71 -0.11 0.00 -1.05 0.00 0.00 32.46 30.69 1y8b n ARG 636 CO 0.00 0.00 0.00 0.42 -0.01 0.00 0.00 177.63 178.04 1y8b s ILE 637 N -3.21 0.08 0.00 8.89 1.01 0.17 -4.84 121.20 123.30 1y8b s ILE 637 Ca -0.04 -1.62 0.00 0.00 0.00 0.00 0.00 60.65 58.99 1y8b s ILE 637 Cb 0.10 -1.06 0.00 0.00 0.01 0.00 0.00 42.46 41.51 1y8b s ILE 637 CO 0.83 -0.94 0.00 -0.24 0.00 0.00 0.00 174.94 174.59 1y8b n SER 638 N 4.06 0.00 0.01 3.58 2.88 -0.88 -4.27 113.62 119.01 1y8b n SER 638 Ca 0.12 0.00 -0.02 0.00 -1.33 0.00 0.00 58.87 57.64 1y8b n SER 638 Cb 0.38 0.00 0.24 0.00 -0.75 0.00 0.00 64.21 64.08 1y8b n SER 638 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1y8b h SER 639 N 0.00 0.48 0.86 -3.46 0.02 -1.80 -1.82 113.55 107.83 1y8b h SER 639 Ca 0.00 -0.13 -0.04 0.00 -0.84 0.00 0.00 61.79 60.78 1y8b h SER 639 Cb 0.00 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.41 1y8b h SER 639 CO 0.00 0.66 -0.19 1.56 -1.14 0.00 0.00 176.83 177.71 1y8b h GLN 640 N 0.45 0.00 -0.50 3.45 7.50 -1.86 -2.96 115.11 121.20 1y8b h GLN 640 Ca 0.08 0.00 -0.04 0.00 0.50 0.00 0.00 58.65 59.19 1y8b h GLN 640 Cb 0.52 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 28.03 1y8b h GLN 640 CO 0.03 0.19 0.15 0.45 -1.50 0.00 0.00 178.83 178.15 1y8b h HIS 641 N 0.00 0.82 0.44 2.96 3.86 -1.71 0.17 115.15 121.69 1y8b h HIS 641 Ca -0.00 -0.09 -0.02 0.00 -1.16 0.00 0.00 60.37 59.11 1y8b h HIS 641 Cb 0.67 -0.23 -0.01 0.00 1.06 0.00 0.00 27.41 28.90 1y8b h HIS 641 CO 0.00 0.71 -0.27 0.82 0.86 0.00 0.00 177.93 180.05 1y8b h ILE 642 N 0.68 0.43 0.29 2.45 2.04 -1.52 -0.98 117.51 120.91 1y8b h ILE 642 Ca 0.16 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 66.02 1y8b h ILE 642 Cb 0.29 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 36.79 1y8b h ILE 642 CO -0.00 0.00 -0.22 0.00 0.00 0.00 0.00 178.15 177.93 1y8b h ALA 643 N -0.17 -0.49 -0.67 1.87 0.00 -1.56 0.44 119.26 118.68 1y8b h ALA 643 Ca -0.05 -0.09 0.13 0.00 0.00 0.00 0.00 54.91 54.91 1y8b h ALA 643 Cb 0.56 0.29 -0.13 0.00 0.00 0.00 0.00 17.79 18.51 1y8b h ALA 643 CO 0.05 -0.80 -0.18 -0.91 0.00 0.00 0.00 179.25 177.42 1y8b h ASN 644 N -0.51 -0.65 -0.23 0.00 -0.26 -0.84 0.20 115.58 113.30 1y8b h ASN 644 Ca -0.02 0.20 -0.15 0.00 -0.56 0.00 0.00 56.30 55.77 1y8b h ASN 644 Cb 0.44 0.42 -0.01 0.00 -1.06 0.00 0.00 38.32 38.12 1y8b h ASN 644 CO -0.00 -0.23 -0.41 -0.25 -1.06 0.00 0.00 177.43 175.48 1y8b h TRP 645 N -0.01 0.93 -0.02 1.19 2.91 -0.80 -2.73 115.95 117.42 1y8b h TRP 645 Ca 0.32 -0.28 0.01 0.00 1.13 0.00 0.00 58.89 60.06 1y8b h TRP 645 Cb 0.49 -0.20 -0.00 0.00 -0.51 0.00 0.00 29.16 28.95 1y8b h TRP 645 CO -0.55 1.06 0.01 1.25 -1.03 0.00 0.00 178.44 179.18 1y8b h LEU 646 N 0.63 0.00 -0.25 0.65 5.85 0.27 -0.17 115.31 122.29 1y8b h LEU 646 Ca 0.05 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.71 1y8b h LEU 646 Cb 0.97 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.99 1y8b h LEU 646 CO 0.09 0.00 -0.26 0.03 -0.34 0.00 0.00 178.44 177.97 1y8b h ARG 647 N 0.00 0.00 0.00 1.25 2.47 -0.47 -3.13 114.38 114.51 1y8b h ARG 647 Ca 0.01 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.73 1y8b h ARG 647 Cb 0.04 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.36 1y8b h ARG 647 CO -0.00 0.26 0.00 0.72 0.56 0.00 0.00 179.97 181.50 1y8b n HIS 648 N -3.20 0.00 -1.85 3.04 8.25 -0.07 -4.81 115.22 116.57 1y8b n HIS 648 Ca 0.02 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.40 1y8b n HIS 648 Cb 0.59 -0.04 -0.01 0.00 1.12 0.00 0.00 29.99 31.65 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 -0.03 0.35 0.07 -1.41 0.00 -1.18 -4.94 105.19 98.06 1y8b n GLY 649 Ca 0.11 -0.60 -0.11 0.00 0.00 0.00 0.00 46.02 45.42 1y8b n GLY 649 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1y8b h ILE 650 N 0.00 0.78 -3.44 -0.61 1.08 -1.78 -3.47 117.51 110.07 1y8b h ILE 650 Ca -0.18 -1.72 -0.31 0.00 -0.39 0.00 0.00 64.86 62.26 1y8b h ILE 650 Cb 0.93 1.61 -0.35 0.00 -3.07 0.00 0.00 36.82 35.95 1y8b h ILE 650 CO 0.23 0.26 -0.72 -1.48 -0.69 0.00 0.00 178.15 175.76 1y8b s LEU 651 N -8.20 0.83 1.13 1.44 2.34 -1.26 -5.13 118.68 109.82 1y8b s LEU 651 Ca -0.16 0.08 -0.16 0.00 0.06 0.00 0.00 54.13 53.95 1y8b s LEU 651 Cb 0.01 -0.03 0.25 0.00 -0.56 0.00 0.00 46.19 45.87 1y8b s LEU 651 CO 0.41 -0.16 1.09 0.42 -1.06 0.00 0.00 176.35 177.05 1y8b s THR 652 N 1.32 1.78 -0.55 5.48 -4.23 -1.26 -4.71 115.64 113.46 1y8b s THR 652 Ca -0.06 0.00 0.12 0.00 -1.18 0.00 0.00 61.69 60.56 1y8b s THR 652 Cb -0.13 -2.45 0.12 0.00 1.34 0.00 0.00 72.50 71.38 1y8b s THR 652 CO -0.03 0.00 1.35 0.29 -0.54 0.00 0.00 174.62 175.68 1y8b n LYS 653 N -4.58 0.07 0.16 3.99 4.76 -1.26 -1.66 118.16 119.65 1y8b n LYS 653 Ca 0.09 0.57 0.06 0.00 -2.87 0.00 0.00 58.31 56.16 1y8b n LYS 653 Cb 0.58 -1.76 0.52 0.00 -1.84 0.00 0.00 35.03 32.54 1y8b n LYS 653 CO 0.00 0.00 0.00 1.49 -1.37 0.00 0.00 177.40 177.52 1y8b h GLU 654 N 0.00 0.18 0.14 1.97 4.81 -1.99 0.19 114.58 119.88 1y8b h GLU 654 Ca 0.00 -0.02 -0.32 0.00 -0.13 0.00 0.00 59.36 58.89 1y8b h GLU 654 Cb 0.02 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.36 1y8b h GLU 654 CO 0.00 0.18 -1.63 0.37 -0.73 0.00 0.00 179.01 177.20 1y8b h GLN 655 N 0.19 0.30 -0.09 1.92 5.75 -1.64 -3.16 115.11 118.38 1y8b h GLN 655 Ca 0.05 -0.51 -0.03 0.00 -0.15 0.00 0.00 58.65 58.00 1y8b h GLN 655 Cb 0.09 0.19 -0.00 0.00 1.07 0.00 0.00 27.48 28.83 1y8b h GLN 655 CO -0.00 1.18 -0.06 0.28 -2.65 0.00 0.00 178.83 177.57 1y8b h VAL 656 N 0.08 1.34 -0.79 2.39 2.07 -1.53 0.68 116.25 120.49 1y8b h VAL 656 Ca -0.29 -1.15 0.06 0.00 0.82 0.00 0.00 66.70 66.15 1y8b h VAL 656 Cb 2.05 1.91 -0.05 0.00 -1.52 0.00 0.00 31.29 33.68 1y8b h VAL 656 CO 0.17 0.32 0.52 0.06 0.02 0.00 0.00 177.57 178.65 1y8b h GLN 657 N -0.19 0.85 -0.01 1.57 -0.00 -0.79 -2.38 115.11 114.16 1y8b h GLN 657 Ca 0.02 -0.05 -0.02 0.00 -0.00 0.00 0.00 58.65 58.59 1y8b h GLN 657 Cb 0.54 -0.19 0.00 0.00 -0.00 0.00 0.00 27.48 27.83 1y8b h GLN 657 CO 0.02 0.56 -0.09 0.00 -0.00 0.00 0.00 178.83 179.32 1y8b h ALA 658 N 1.57 0.02 -0.45 0.06 0.00 -1.49 -2.94 119.26 116.03 1y8b h ALA 658 Ca 0.34 -0.39 0.07 0.00 0.00 0.00 0.00 54.91 54.93 1y8b h ALA 658 Cb 0.20 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 17.90 1y8b h ALA 658 CO -0.11 -0.05 -0.45 1.03 0.00 0.00 0.00 179.25 179.66 1y8b h SER 659 N -0.60 -1.51 -0.68 0.00 0.87 -0.48 0.40 113.55 111.56 1y8b h SER 659 Ca -0.01 0.23 0.09 0.00 -1.23 0.00 0.00 61.79 60.87 1y8b h SER 659 Cb 0.80 0.66 -0.04 0.00 -0.44 0.00 0.00 62.40 63.38 1y8b h SER 659 CO 0.02 -0.37 0.45 -0.07 -0.53 0.00 0.00 176.83 176.34 1y8b h LEU 660 N -0.31 0.51 -0.34 2.23 4.07 -1.54 -0.88 115.31 119.05 1y8b h LEU 660 Ca 0.14 0.01 0.08 0.00 0.08 0.00 0.00 57.88 58.18 1y8b h LEU 660 Cb 0.58 -0.10 -0.08 0.00 1.08 0.00 0.00 40.66 42.14 1y8b h LEU 660 CO -0.61 0.31 -0.23 -0.08 -1.08 0.00 0.00 178.44 176.75 1y8b h GLU 661 N 0.57 -0.18 0.05 1.13 4.81 -0.01 1.60 114.58 122.55 1y8b h GLU 661 Ca 0.31 0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.55 1y8b h GLU 661 Cb 0.47 0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.89 1y8b h GLU 661 CO -0.10 -0.12 -0.03 -0.91 -0.73 0.00 0.00 179.01 177.12 1y8b h ASN 662 N -0.19 -0.06 -0.64 1.04 2.35 -1.08 -3.31 115.58 113.69 1y8b h ASN 662 Ca 0.17 -0.58 0.09 0.00 -0.55 0.00 0.00 56.30 55.42 1y8b h ASN 662 Cb 0.45 0.02 -0.07 0.00 0.05 0.00 0.00 38.32 38.77 1y8b h ASN 662 CO -0.45 0.65 0.29 0.24 -1.65 0.00 0.00 177.43 176.51 1y8b h MET 663 N -0.87 0.50 -1.40 0.81 2.86 -1.01 -0.27 114.93 115.55 1y8b h MET 663 Ca -0.01 -0.03 0.45 0.00 -2.06 0.00 0.00 59.70 58.05 1y8b h MET 663 Cb 0.64 -0.11 -0.12 0.00 0.06 0.00 0.00 31.60 32.07 1y8b h MET 663 CO 0.01 0.33 0.92 0.00 1.06 0.00 0.00 176.91 179.24 1y8b h ALA 664 N 1.40 2.89 0.01 6.32 0.00 0.23 0.25 119.26 130.35 1y8b h ALA 664 Ca 0.31 0.09 -0.06 0.00 0.00 0.00 0.00 54.91 55.25 1y8b h ALA 664 Cb 0.33 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1y8b h ALA 664 CO -0.26 -1.50 -0.30 0.87 0.00 0.00 0.00 179.25 178.05 1y8b h LYS 665 N 0.07 0.01 -0.74 0.00 1.57 -1.17 -3.22 116.57 113.10 1y8b h LYS 665 Ca 0.83 -0.03 0.22 0.00 -1.87 0.00 0.00 60.65 59.80 1y8b h LYS 665 Cb 2.71 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 35.00 1y8b h LYS 665 CO -0.35 1.01 0.70 0.28 -0.57 0.00 0.00 179.45 180.52 1y8b h VAL 666 N -0.97 0.33 0.00 0.50 2.07 -0.21 1.15 116.25 119.12 1y8b h VAL 666 Ca -0.08 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.38 1y8b h VAL 666 Cb 1.10 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 31.32 1y8b h VAL 666 CO -0.04 0.00 -0.44 0.58 0.02 0.00 0.00 177.57 177.70 1y8b h VAL 667 N 0.00 0.42 -0.93 2.57 2.07 -1.18 -3.26 116.25 115.94 1y8b h VAL 667 Ca 0.35 -1.61 0.27 0.00 0.82 0.00 0.00 66.70 66.53 1y8b h VAL 667 Cb 1.74 2.14 -0.04 0.00 -1.52 0.00 0.00 31.29 33.61 1y8b h VAL 667 CO -0.00 0.24 0.76 0.44 0.02 0.00 0.00 177.57 179.02 1y8b h ASP 668 N 0.00 0.00 0.03 0.57 3.32 0.14 0.90 116.42 121.37 1y8b h ASP 668 Ca -0.02 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.92 1y8b h ASP 668 Cb 1.22 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.75 1y8b h ASP 668 CO 0.03 0.00 -0.35 1.56 -1.72 0.00 0.00 179.24 178.76 1y8b h GLN 669 N 0.00 0.45 -0.39 3.56 1.08 -1.67 -1.81 115.11 116.32 1y8b h GLN 669 Ca 0.44 -0.20 -0.06 0.00 -1.45 0.00 0.00 58.65 57.38 1y8b h GLN 669 Cb 1.95 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 29.36 1y8b h GLN 669 CO -0.00 0.74 0.01 0.37 -0.95 0.00 0.00 178.83 179.00 1y8b h GLN 670 N 0.38 0.69 -0.33 1.46 -0.00 0.61 -2.06 115.11 115.86 1y8b h GLN 670 Ca 0.04 -0.21 0.00 0.00 -0.00 0.00 0.00 58.65 58.48 1y8b h GLN 670 Cb 0.80 -0.07 0.00 0.00 0.00 0.00 0.00 27.48 28.22 1y8b h GLN 670 CO 0.06 0.77 0.00 -1.71 0.00 0.00 0.00 178.83 177.96 1y8b n ASN 671 N -4.47 1.28 -0.13 -0.69 4.05 -1.09 -3.86 115.26 110.36 1y8b n ASN 671 Ca -0.01 -2.05 -0.27 0.00 0.45 0.00 0.00 54.58 52.71 1y8b n ASN 671 Cb 0.28 -0.21 -0.11 0.00 1.23 0.00 0.00 39.78 40.97 1y8b n ASN 671 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1y8b n ALA 672 N 0.10 1.19 -0.30 5.20 0.00 -0.70 -4.40 120.51 121.60 1y8b n ALA 672 Ca 0.07 -1.04 0.14 0.00 0.00 0.00 0.00 53.44 52.61 1y8b n ALA 672 Cb 0.23 0.01 0.31 0.00 0.00 0.00 0.00 19.45 19.99 1y8b n ALA 672 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1y8b h GLY 673 N -0.43 1.48 -1.78 0.00 0.00 -1.63 -3.40 103.07 97.31 1y8b h GLY 673 Ca -0.64 -0.11 -0.53 0.00 0.00 0.00 0.00 47.33 46.04 1y8b h GLY 673 CO -0.34 -0.32 0.40 0.51 0.00 0.00 0.00 176.54 176.79 1y8b s ASP 674 N -5.12 4.34 0.51 0.19 1.47 -1.26 -5.00 116.67 111.79 1y8b s ASP 674 Ca -0.12 2.33 0.00 0.00 1.18 0.00 0.00 52.55 55.94 1y8b s ASP 674 Cb 0.26 -2.59 0.00 0.00 -0.34 0.00 0.00 42.92 40.25 1y8b s ASP 674 CO 0.78 -2.16 0.00 -0.81 0.68 0.00 0.00 175.17 173.65 1y8b n PRO 675 N -2.62 -0.53 -3.45 2.11 -0.04 -1.26 -4.54 135.00 124.67 1y8b n PRO 675 Ca 0.13 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.43 1y8b n PRO 675 Cb 0.50 0.00 0.02 0.00 -0.04 0.00 0.00 33.50 33.98 1y8b n PRO 675 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1y8b n ALA 676 N -2.99 -2.61 -1.36 0.55 0.00 -1.26 -4.80 120.51 108.04 1y8b n ALA 676 Ca 0.00 -0.14 -0.39 0.00 0.00 0.00 0.00 53.44 52.91 1y8b n ALA 676 Cb 0.00 -2.18 0.02 0.00 0.00 0.00 0.00 19.45 17.29 1y8b n ALA 676 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 1y8b n TYR 677 N -2.73 -1.69 -3.34 0.00 4.11 -1.26 -4.98 117.16 107.27 1y8b n TYR 677 Ca -0.12 0.49 -0.11 0.00 -0.00 0.00 0.00 57.90 58.15 1y8b n TYR 677 Cb 0.59 -1.83 -0.07 0.00 -0.00 0.00 0.00 39.34 38.02 1y8b n TYR 677 CO 0.00 0.00 0.00 0.50 -0.00 0.00 0.00 176.86 177.36 1y8b s ARG 678 N -1.47 0.37 -0.14 -3.48 3.00 -1.26 -5.13 118.95 110.84 1y8b s ARG 678 Ca 0.62 0.14 -0.29 0.00 -1.00 0.00 0.00 55.73 55.21 1y8b s ARG 678 Cb -0.51 -0.45 -0.01 0.00 0.00 0.00 0.00 34.95 33.99 1y8b s ARG 678 CO 0.60 -0.95 0.99 -1.25 0.00 0.00 0.00 175.30 174.69 1y8b s PRO 679 N 2.49 4.37 0.03 5.12 0.04 -1.26 -4.96 135.00 140.84 1y8b s PRO 679 Ca 0.10 1.33 -0.27 0.00 0.04 0.00 0.00 61.00 62.21 1y8b s PRO 679 Cb -0.13 -3.57 -0.17 0.00 0.04 0.00 0.00 34.50 30.67 1y8b s PRO 679 CO -0.28 -0.39 1.41 1.98 0.04 0.00 0.00 177.00 179.76 1y8b h MET 680 N 7.22 -0.42 -2.06 4.56 4.05 -2.00 -2.81 114.93 123.48 1y8b h MET 680 Ca -0.28 0.03 -0.01 0.00 -0.28 0.00 0.00 59.70 59.16 1y8b h MET 680 Cb 1.12 0.09 -0.00 0.00 -0.80 0.00 0.00 31.60 32.01 1y8b h MET 680 CO 0.88 -0.15 0.01 0.00 0.23 0.00 0.00 176.91 177.88 1y8b n ALA 681 N -2.40 2.87 -1.27 0.39 0.00 -1.26 -2.87 120.51 115.97 1y8b n ALA 681 Ca -0.10 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.24 1y8b n ALA 681 Cb 0.25 -1.58 0.00 0.00 0.00 0.00 0.00 19.45 18.11 1y8b n ALA 681 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1y8b n GLY 682 N 1.86 0.32 1.01 0.00 0.00 -1.06 -4.91 105.19 102.40 1y8b n GLY 682 Ca 0.02 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.13 1y8b n GLY 682 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1y8b n ASN 683 N -0.65 3.54 0.17 1.61 4.13 -1.26 -4.49 115.26 118.31 1y8b n ASN 683 Ca 0.00 -2.10 0.08 0.00 1.68 0.00 0.00 54.58 54.24 1y8b n ASN 683 Cb 0.00 -0.38 0.43 0.00 -1.54 0.00 0.00 39.78 38.30 1y8b n ASN 683 CO 0.00 0.00 0.00 0.15 0.28 0.00 0.00 177.26 177.69 1y8b h PHE 684 N 3.04 0.00 0.00 3.10 3.57 -1.77 0.57 116.94 125.45 1y8b h PHE 684 Ca 0.00 0.00 -0.13 0.00 3.53 0.00 0.00 57.97 61.37 1y8b h PHE 684 Cb 0.94 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.66 1y8b h PHE 684 CO 0.39 0.00 -0.61 0.00 -2.23 0.00 0.00 178.31 175.86 1y8b h ALA 685 N 1.40 0.69 0.00 2.41 0.00 -1.85 -3.33 119.26 118.58 1y8b h ALA 685 Ca 0.00 -0.56 -0.30 0.00 0.00 0.00 0.00 54.91 54.05 1y8b h ALA 685 Cb 0.45 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.09 1y8b h ALA 685 CO 0.00 0.76 -2.15 0.09 0.00 0.00 0.00 179.25 177.96 1y8b n ASN 686 N -3.38 1.45 -4.56 0.00 4.13 0.18 -4.80 115.26 108.28 1y8b n ASN 686 Ca 0.01 -0.04 -0.30 0.00 1.68 0.00 0.00 54.58 55.93 1y8b n ASN 686 Cb 0.72 0.48 -0.05 0.00 -1.54 0.00 0.00 39.78 39.39 1y8b n ASN 686 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 1y8b s SER 687 N -5.36 5.39 0.00 6.41 0.01 0.03 -4.72 113.70 115.46 1y8b s SER 687 Ca -0.15 -0.76 0.29 0.00 1.31 0.00 0.00 55.95 56.63 1y8b s SER 687 Cb 0.06 -2.56 1.23 0.00 0.21 0.00 0.00 66.02 64.96 1y8b s SER 687 CO 0.61 -2.51 1.86 0.00 0.41 0.00 0.00 173.24 173.61 1y8b h ALA 689 N 3.68 1.19 0.00 0.00 0.00 -1.97 -2.09 119.26 120.07 1y8b h ALA 689 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1y8b h ALA 689 Cb 0.35 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1y8b h ALA 689 CO 0.00 0.55 -0.21 0.35 0.00 0.00 0.00 179.25 179.94 1y8b h PHE 690 N 0.81 0.00 0.00 0.00 3.57 -1.92 -3.20 116.94 116.20 1y8b h PHE 690 Ca 0.18 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.64 1y8b h PHE 690 Cb 0.31 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.05 1y8b h PHE 690 CO 0.02 0.00 -0.19 0.87 -2.23 0.00 0.00 178.31 176.78 1y8b h LYS 691 N 0.00 0.00 -0.25 1.11 1.57 -1.54 -2.72 116.57 114.74 1y8b h LYS 691 Ca 0.00 0.00 0.07 0.00 -1.87 0.00 0.00 60.65 58.85 1y8b h LYS 691 Cb 0.90 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.20 1y8b h LYS 691 CO 0.00 0.19 0.52 0.00 -0.57 0.00 0.00 179.45 179.58 1y8b h ALA 692 N 1.81 1.85 -0.64 3.86 0.00 -1.53 0.28 119.26 124.88 1y8b h ALA 692 Ca -0.00 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.93 1y8b h ALA 692 Cb 0.61 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 1y8b h ALA 692 CO 0.02 -0.64 0.42 0.00 0.00 0.00 0.00 179.25 179.05 1y8b h ALA 693 N 1.20 1.64 0.00 0.00 0.00 -1.74 0.28 119.26 120.65 1y8b h ALA 693 Ca 0.12 -0.03 -0.19 0.00 0.00 0.00 0.00 54.91 54.81 1y8b h ALA 693 Cb 1.15 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.69 1y8b h ALA 693 CO -0.00 0.29 -1.02 1.03 0.00 0.00 0.00 179.25 179.56 1y8b h SER 694 N 0.77 0.00 -0.02 0.00 0.87 -0.69 -3.33 113.55 111.14 1y8b h SER 694 Ca 0.26 0.00 -0.20 0.00 -1.23 0.00 0.00 61.79 60.62 1y8b h SER 694 Cb 0.06 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.04 1y8b h SER 694 CO -0.07 0.81 -0.76 0.44 -0.53 0.00 0.00 176.83 176.72 1y8b h ASP 695 N 0.00 0.71 -1.15 6.23 3.32 -1.18 -2.77 116.42 121.58 1y8b h ASP 695 Ca -0.07 -0.73 0.40 0.00 0.02 0.00 0.00 57.03 56.66 1y8b h ASP 695 Cb 1.67 -0.21 -0.15 0.00 0.22 0.00 0.00 39.33 40.86 1y8b h ASP 695 CO 0.09 1.34 0.69 -0.07 -1.72 0.00 0.00 179.24 179.58 1y8b h LEU 696 N 0.14 0.33 0.02 1.55 3.38 -0.60 3.00 115.31 123.13 1y8b h LEU 696 Ca -0.09 0.19 -0.12 0.00 0.09 0.00 0.00 57.88 57.95 1y8b h LEU 696 Cb 1.43 0.17 -0.01 0.00 0.09 0.00 0.00 40.66 42.34 1y8b h LEU 696 CO 0.15 -0.25 -0.61 0.40 0.09 0.00 0.00 178.44 178.22 1y8b h ILE 697 N 0.12 1.40 -0.38 1.22 1.08 -1.72 -2.99 117.51 116.24 1y8b h ILE 697 Ca 0.81 -2.30 -0.14 0.00 -0.39 0.00 0.00 64.86 62.84 1y8b h ILE 697 Cb 2.27 2.90 -0.01 0.00 -3.07 0.00 0.00 36.82 38.91 1y8b h ILE 697 CO -0.57 0.51 -0.29 0.15 -0.69 0.00 0.00 178.15 177.26 1y8b h PHE 698 N -0.92 1.03 -0.21 1.37 3.57 -0.64 -2.66 116.94 118.47 1y8b h PHE 698 Ca -0.16 -0.29 0.00 0.00 3.53 0.00 0.00 57.97 61.06 1y8b h PHE 698 Cb 1.20 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 39.72 1y8b h PHE 698 CO 0.20 1.08 0.00 1.28 -2.23 0.00 0.00 178.31 178.64 1y8b n LEU 699 N -4.16 2.42 -0.03 0.59 4.32 0.98 -3.54 117.00 117.57 1y8b n LEU 699 Ca -0.02 -1.22 0.03 0.00 -0.02 0.00 0.00 56.01 54.78 1y8b n LEU 699 Cb 0.49 -0.49 0.04 0.00 -1.62 0.00 0.00 43.42 41.84 1y8b n LEU 699 CO 0.47 0.37 0.50 0.61 -1.22 0.00 0.00 177.39 178.12 1y8b n GLY 700 N 0.34 3.22 0.09 -0.72 0.00 -1.00 -4.33 105.19 102.79 1y8b n GLY 700 Ca 0.09 -0.35 0.02 0.00 0.00 0.00 0.00 46.02 45.79 1y8b n GLY 700 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1y8b n VAL 701 N -0.75 1.01 0.09 1.61 0.24 -1.23 -4.32 118.33 114.98 1y8b n VAL 701 Ca 0.05 -0.66 0.01 0.00 -2.04 0.00 0.00 64.34 61.71 1y8b n VAL 701 Cb 0.39 -0.60 -0.02 0.00 -1.47 0.00 0.00 33.84 32.15 1y8b n VAL 701 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1y8b n LYS 702 N -2.80 3.97 -1.68 7.34 4.01 -1.26 -5.00 118.16 122.74 1y8b n LYS 702 Ca -0.09 -0.01 -0.49 0.00 -0.51 0.00 0.00 58.31 57.21 1y8b n LYS 702 Cb 0.78 -0.79 -0.05 0.00 -0.51 0.00 0.00 35.03 34.46 1y8b n LYS 702 CO 0.00 0.00 0.00 1.04 -1.11 0.00 0.00 177.40 177.33 1y8b n GLN 703 N -1.26 2.07 -1.30 1.97 1.13 -1.26 -4.85 117.38 113.89 1y8b n GLN 703 Ca 0.00 0.76 -0.41 0.00 -1.94 0.00 0.00 57.00 55.41 1y8b n GLN 703 Cb 0.06 -2.58 0.00 0.00 0.11 0.00 0.00 30.24 27.83 1y8b n GLN 703 CO 0.00 0.00 0.00 -2.30 -1.44 0.00 0.00 177.06 173.32 1y8b n PRO 704 N 6.29 0.05 0.00 -1.09 -0.02 -1.26 -4.64 135.00 134.33 1y8b n PRO 704 Ca 0.23 0.02 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 1y8b n PRO 704 Cb 0.28 -1.06 0.00 0.00 -0.02 0.00 0.00 33.50 32.70 1y8b n PRO 704 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1y8b n ASN 705 N 2.26 0.00 -0.40 2.55 4.05 -1.26 0.48 115.26 122.94 1y8b n ASN 705 Ca 0.10 0.36 0.04 0.00 0.45 0.00 0.00 54.58 55.53 1y8b n ASN 705 Cb 0.43 -0.36 0.09 0.00 1.23 0.00 0.00 39.78 41.16 1y8b n ASN 705 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1y8b n GLY 706 N -1.36 2.06 2.51 8.20 0.00 -1.26 -4.60 105.19 110.74 1y8b n GLY 706 Ca 0.00 -0.24 -0.10 0.00 0.00 0.00 0.00 46.02 45.68 1y8b n GLY 706 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1y8b n TYR 707 N 0.23 1.86 -0.09 1.61 4.02 0.18 -4.85 117.16 120.12 1y8b n TYR 707 Ca 0.07 -2.19 -0.23 0.00 -0.01 0.00 0.00 57.90 55.55 1y8b n TYR 707 Cb 0.33 -0.27 -0.12 0.00 -0.02 0.00 0.00 39.34 39.25 1y8b n TYR 707 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 176.86 178.26 1y8b n THR 708 N -0.64 1.59 -0.07 -0.72 -1.04 -1.22 -4.25 114.28 107.93 1y8b n THR 708 Ca 0.22 -0.44 -0.14 0.00 -2.04 0.00 0.00 64.05 61.65 1y8b n THR 708 Cb 0.87 -1.74 -0.06 0.00 -1.82 0.00 0.00 70.33 67.58 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 -0.42 0.58 0.00 -2.82 4.22 -1.92 -3.06 114.58 111.17 1y8b h GLU 709 Ca -0.52 -0.33 0.00 0.00 0.08 0.00 0.00 59.36 58.59 1y8b h GLU 709 Cb 1.75 0.02 0.00 0.00 0.50 0.00 0.00 28.75 31.02 1y8b h GLU 709 CO -0.15 0.93 0.21 -1.35 -2.18 0.00 0.00 179.01 176.47 1y8b h PRO 710 N 0.27 0.00 -0.80 0.92 0.11 -1.90 -2.95 132.00 127.66 1y8b h PRO 710 Ca 0.03 0.00 0.16 0.00 0.11 0.00 0.00 66.00 66.30 1y8b h PRO 710 Cb 0.85 0.00 -0.15 0.00 0.11 0.00 0.00 31.00 31.81 1y8b h PRO 710 CO 0.07 0.00 -0.21 1.25 -0.21 0.00 0.00 178.00 178.90 1y8b h LEU 711 N 0.00 -0.77 -1.22 2.35 7.12 -1.71 1.25 115.31 122.33 1y8b h LEU 711 Ca 0.00 0.24 0.19 0.00 0.13 0.00 0.00 57.88 58.44 1y8b h LEU 711 Cb 0.42 0.50 -0.09 0.00 -0.53 0.00 0.00 40.66 40.96 1y8b h LEU 711 CO 0.00 -0.27 0.61 -0.07 -0.13 0.00 0.00 178.44 178.59 1y8b h LEU 712 N -0.01 0.63 -0.45 2.25 3.38 -1.78 0.84 115.31 120.18 1y8b h LEU 712 Ca 0.38 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.41 1y8b h LEU 712 Cb 0.58 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 1y8b h LEU 712 CO -0.82 0.24 0.25 1.12 0.09 0.00 0.00 178.44 179.32 1y8b h HIS 713 N 0.63 0.62 -0.86 1.13 2.07 0.15 0.22 115.15 119.10 1y8b h HIS 713 Ca 0.53 -0.02 0.22 0.00 -2.85 0.00 0.00 60.37 58.26 1y8b h HIS 713 Cb 1.00 -0.20 -0.15 0.00 2.57 0.00 0.00 27.41 30.64 1y8b h HIS 713 CO -0.00 0.47 0.12 0.00 -3.07 0.00 0.00 177.93 175.44 1y8b h ALA 714 N 1.10 1.10 0.00 6.11 0.00 -0.29 0.91 119.26 128.19 1y8b h ALA 714 Ca 0.16 0.26 -0.04 0.00 0.00 0.00 0.00 54.91 55.28 1y8b h ALA 714 Cb 0.05 0.41 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1y8b h ALA 714 CO -0.03 -0.48 -0.38 2.35 0.00 0.00 0.00 179.25 180.71 1y8b h TRP 715 N 0.13 0.00 -1.15 0.00 2.91 -1.42 -3.33 115.95 113.08 1y8b h TRP 715 Ca 0.52 0.00 0.32 0.00 1.13 0.00 0.00 58.89 60.86 1y8b h TRP 715 Cb 1.02 0.00 -0.08 0.00 -0.51 0.00 0.00 29.16 29.59 1y8b h TRP 715 CO -0.36 0.50 0.78 -0.09 -1.03 0.00 0.00 178.44 178.23 1y8b h ARG 716 N -1.00 0.20 -0.63 2.65 9.65 -0.22 0.50 114.38 125.52 1y8b h ARG 716 Ca -0.07 -0.01 0.03 0.00 -1.10 0.00 0.00 59.98 58.83 1y8b h ARG 716 Cb 0.61 -0.04 -0.04 0.00 -1.39 0.00 0.00 29.97 29.10 1y8b h ARG 716 CO -0.04 0.13 0.39 1.25 2.80 0.00 0.00 179.97 184.50 1y8b h LEU 717 N 0.20 0.63 0.00 3.80 5.85 0.73 -1.44 115.31 125.08 1y8b h LEU 717 Ca 0.62 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 59.31 1y8b h LEU 717 Cb 1.97 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 42.86 1y8b h LEU 717 CO -0.20 0.44 -0.23 0.03 -0.34 0.00 0.00 178.44 178.14 1y8b h ARG 718 N 0.76 0.00 -0.27 1.25 -0.00 -0.23 -3.25 114.38 112.65 1y8b h ARG 718 Ca 0.26 0.00 -0.01 0.00 -0.50 0.00 0.00 59.98 59.73 1y8b h ARG 718 Cb 0.03 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 29.99 1y8b h ARG 718 CO -0.11 0.13 0.14 1.49 0.00 0.00 0.00 179.97 181.62 1y8b h GLU 719 N 0.00 0.38 -0.35 0.04 4.57 0.15 0.41 114.58 119.77 1y8b h GLU 719 Ca -0.00 -0.05 -0.06 0.00 -1.18 0.00 0.00 59.36 58.07 1y8b h GLU 719 Cb 1.11 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 29.61 1y8b h GLU 719 CO 0.02 0.34 -0.01 -0.22 -1.18 0.00 0.00 179.01 177.96 1y8b h LYS 720 N 0.31 0.64 0.00 1.92 3.64 -1.55 -2.30 116.57 119.23 1y8b h LYS 720 Ca 0.09 -0.21 0.00 0.00 -1.27 0.00 0.00 60.65 59.26 1y8b h LYS 720 Cb 0.08 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.85 1y8b h LYS 720 CO -0.01 0.76 0.00 1.49 -2.27 0.00 0.00 179.45 179.41 1y8b h GLU 721 N 0.44 0.00 0.00 1.90 4.22 -1.55 -2.48 114.58 117.12 1y8b h GLU 721 Ca 0.10 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.54 1y8b h GLU 721 Cb 0.48 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.73 1y8b h GLU 721 CO 0.02 0.00 0.00 1.03 -2.18 0.00 0.00 179.01 177.88 1y8b h SER 722 N 0.00 0.00 0.00 1.04 0.87 0.43 -3.51 113.55 112.39 1y8b h SER 722 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1y8b h SER 722 Cb 0.42 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.38 1y8b h SER 722 CO 0.00 0.00 0.00 1.57 -0.53 0.00 0.00 176.83 177.87