#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x8l s PHE 9 N 0.00 2.82 -0.93 0.54 5.36 -1.26 -4.93 117.98 119.58 1x8l s PHE 9 Ca 0.00 0.99 0.27 0.00 -0.96 0.00 0.00 56.93 57.23 1x8l s PHE 9 Cb 0.00 -3.64 0.90 0.00 -0.34 0.00 0.00 43.02 39.93 1x8l s PHE 9 CO 0.00 -1.62 1.71 -0.35 -1.46 0.00 0.00 175.22 173.51 1x8l n PRO 10 N 6.86 0.07 -3.89 10.12 -0.04 -1.26 -4.90 135.00 141.96 1x8l n PRO 10 Ca 0.14 0.04 -0.33 0.00 -0.04 0.00 0.00 63.50 63.31 1x8l n PRO 10 Cb 0.46 -1.56 -0.05 0.00 -0.04 0.00 0.00 33.50 32.31 1x8l n PRO 10 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1x8l s TYR 11 N -3.03 3.55 0.48 0.54 1.51 -1.26 -5.08 117.35 114.06 1x8l s TYR 11 Ca 0.12 0.36 0.03 0.00 -1.01 0.00 0.00 57.07 56.56 1x8l s TYR 11 Cb 0.17 -1.83 0.01 0.00 -0.11 0.00 0.00 41.96 40.20 1x8l s TYR 11 CO 0.60 0.63 0.68 -1.21 -1.11 0.00 0.00 175.55 175.15 1x8l s GLU 12 N -2.04 2.79 0.24 -0.62 0.41 -1.26 -4.90 118.70 113.32 1x8l s GLU 12 Ca 0.29 -0.79 0.10 0.00 -0.41 0.00 0.00 54.97 54.16 1x8l s GLU 12 Cb -0.13 -2.58 -0.05 0.00 -1.78 0.00 0.00 34.13 29.59 1x8l s GLU 12 CO 0.20 -0.44 -0.17 -0.59 -0.49 0.00 0.00 175.26 173.77 1x8l s PHE 13 N -2.58 1.99 0.06 1.61 -0.12 -1.26 -0.76 117.98 116.92 1x8l s PHE 13 Ca 0.53 -0.46 0.00 0.00 -0.05 0.00 0.00 56.93 56.96 1x8l s PHE 13 Cb -0.10 -0.89 -0.04 0.00 -0.63 0.00 0.00 43.02 41.36 1x8l s PHE 13 CO 0.37 0.53 -0.05 -0.98 -0.05 0.00 0.00 175.22 175.04 1x8l s ARG 14 N -3.55 0.63 0.55 1.99 1.70 -0.37 -4.99 118.95 114.92 1x8l s ARG 14 Ca 0.26 -1.12 -0.18 0.00 -0.47 0.00 0.00 55.73 54.22 1x8l s ARG 14 Cb -0.03 -0.00 -0.05 0.00 -0.57 0.00 0.00 34.95 34.29 1x8l s ARG 14 CO 0.11 -0.05 1.09 -1.21 -1.08 0.00 0.00 175.30 174.15 1x8l s GLU 15 N -3.27 3.39 0.41 3.89 0.41 -1.26 -1.90 118.70 120.37 1x8l s GLU 15 Ca 0.03 1.43 -0.26 0.00 -0.41 0.00 0.00 54.97 55.76 1x8l s GLU 15 Cb 0.02 -2.03 -0.09 0.00 -1.78 0.00 0.00 34.13 30.26 1x8l s GLU 15 CO -0.06 -0.78 1.37 -0.51 -0.49 0.00 0.00 175.26 174.79 1x8l s LEU 16 N -4.01 4.20 0.82 1.80 1.43 -1.26 -4.87 118.68 116.79 1x8l s LEU 16 Ca 0.69 2.81 -0.10 0.00 -1.03 0.00 0.00 54.13 56.49 1x8l s LEU 16 Cb -0.20 -3.87 0.12 0.00 0.03 0.00 0.00 46.19 42.28 1x8l s LEU 16 CO 0.29 -0.95 1.16 0.54 0.23 0.00 0.00 176.35 177.61 1x8l s ASN 17 N -0.56 4.09 0.16 2.29 2.20 -1.26 -4.79 114.94 117.07 1x8l s ASN 17 Ca 0.57 0.35 -0.16 0.00 -0.94 0.00 0.00 52.86 52.69 1x8l s ASN 17 Cb -0.41 -0.72 0.05 0.00 -2.00 0.00 0.00 41.25 38.17 1x8l s ASN 17 CO 0.54 -2.10 1.78 -0.65 -2.94 0.00 0.00 177.10 173.73 1x8l h PRO 18 N -1.05 0.38 -0.92 3.55 0.11 -1.99 -0.74 132.00 131.34 1x8l h PRO 18 Ca -0.44 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.64 1x8l h PRO 18 Cb 1.28 -0.09 -0.04 0.00 0.11 0.00 0.00 31.00 32.26 1x8l h PRO 18 CO 0.51 0.25 0.52 1.49 -0.21 0.00 0.00 178.00 180.56 1x8l h GLU 19 N 0.39 1.27 -0.33 1.05 4.81 -2.00 -1.83 114.58 117.94 1x8l h GLU 19 Ca 0.16 -0.14 -0.09 0.00 -0.13 0.00 0.00 59.36 59.16 1x8l h GLU 19 Cb 0.07 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 29.19 1x8l h GLU 19 CO -0.11 0.92 -0.14 0.93 -0.73 0.00 0.00 179.01 179.87 1x8l h GLU 20 N 1.28 0.69 -0.76 1.92 5.08 -1.91 -2.67 114.58 118.21 1x8l h GLU 20 Ca 0.33 -0.29 -0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1x8l h GLU 20 Cb 0.00 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.19 1x8l h GLU 20 CO -0.05 0.89 0.46 -0.44 -1.00 0.00 0.00 179.01 178.86 1x8l h ASP 21 N 0.46 0.90 -0.22 1.42 3.32 -0.76 -1.88 116.42 119.66 1x8l h ASP 21 Ca 0.08 -0.05 -0.09 0.00 0.02 0.00 0.00 57.03 56.99 1x8l h ASP 21 Cb 0.67 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 39.99 1x8l h ASP 21 CO 0.05 0.69 -0.22 0.50 -1.72 0.00 0.00 179.24 178.54 1x8l h LYS 22 N 1.04 0.53 -0.84 3.56 3.64 -1.25 0.11 116.57 123.37 1x8l h LYS 22 Ca 0.27 -0.28 -0.03 0.00 -1.27 0.00 0.00 60.65 59.34 1x8l h LYS 22 Cb -0.05 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 31.74 1x8l h LYS 22 CO -0.05 0.86 0.39 1.25 -2.27 0.00 0.00 179.45 179.63 1x8l h LEU 23 N 0.22 1.11 -0.15 5.20 5.85 -1.38 -2.35 115.31 123.81 1x8l h LEU 23 Ca 0.04 -0.14 -0.04 0.00 0.84 0.00 0.00 57.88 58.57 1x8l h LEU 23 Cb 0.77 -0.29 -0.00 0.00 0.37 0.00 0.00 40.66 41.50 1x8l h LEU 23 CO 0.05 0.95 -0.05 0.58 -0.34 0.00 0.00 178.44 179.63 1x8l h VAL 24 N 1.20 1.30 -0.84 1.05 2.07 -1.17 -3.14 116.25 116.72 1x8l h VAL 24 Ca 0.29 -1.04 0.05 0.00 0.82 0.00 0.00 66.70 66.82 1x8l h VAL 24 Cb 0.14 1.68 -0.05 0.00 -1.52 0.00 0.00 31.29 31.54 1x8l h VAL 24 CO -0.03 0.30 0.55 0.50 0.02 0.00 0.00 177.57 178.91 1x8l h LYS 25 N -0.02 0.96 0.00 1.57 3.11 -0.70 0.42 116.57 121.90 1x8l h LYS 25 Ca 0.04 -0.06 -0.03 0.00 -2.81 0.00 0.00 60.65 57.79 1x8l h LYS 25 Cb 0.49 -0.22 -0.00 0.00 -1.00 0.00 0.00 32.23 31.50 1x8l h LYS 25 CO 0.02 0.63 -0.15 0.00 -2.81 0.00 0.00 179.45 177.14 1x8l h ALA 26 N 1.53 1.24 0.01 5.00 0.00 -1.37 0.77 119.26 126.42 1x8l h ALA 26 Ca 0.35 -0.13 -0.37 0.00 0.00 0.00 0.00 54.91 54.76 1x8l h ALA 26 Cb 0.13 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.84 1x8l h ALA 26 CO -0.11 0.19 -2.02 0.09 0.00 0.00 0.00 179.25 177.39 1x8l n ASN 27 N -3.61 1.94 -2.22 0.00 3.02 -0.68 -4.60 115.26 109.12 1x8l n ASN 27 Ca -0.01 0.32 -0.19 0.00 -0.03 0.00 0.00 54.58 54.66 1x8l n ASN 27 Cb 0.28 -0.84 0.03 0.00 -0.61 0.00 0.00 39.78 38.63 1x8l n ASN 27 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1x8l n LEU 28 N -4.17 4.18 0.09 3.41 4.77 0.14 -1.71 117.00 123.71 1x8l n LEU 28 Ca -0.44 -4.39 -0.08 0.00 -0.03 0.00 0.00 56.01 51.06 1x8l n LEU 28 Cb 0.83 -0.16 -0.01 0.00 -2.33 0.00 0.00 43.42 41.75 1x8l n LEU 28 CO 0.14 1.88 0.25 1.23 -1.33 0.00 0.00 177.39 179.56 1x8l h GLY 29 N 2.29 0.20 0.71 -0.72 0.00 -0.98 -3.23 103.07 101.34 1x8l h GLY 29 Ca 0.26 -0.36 -0.10 0.00 0.00 0.00 0.00 47.33 47.13 1x8l h GLY 29 CO 0.64 0.32 -0.33 0.00 0.00 0.00 0.00 176.54 177.16 1x8l h ALA 30 N 0.98 0.15 -1.68 3.60 0.00 -1.89 -3.46 119.26 116.96 1x8l h ALA 30 Ca -0.04 -0.44 -0.69 0.00 0.00 0.00 0.00 54.91 53.73 1x8l h ALA 30 Cb 1.51 -0.01 0.04 0.00 0.00 0.00 0.00 17.79 19.33 1x8l h ALA 30 CO 0.13 0.21 0.71 0.34 0.00 0.00 0.00 179.25 180.64 1x8l n PHE 31 N -4.41 1.84 -0.08 0.00 7.35 -1.22 -4.88 117.46 116.06 1x8l n PHE 31 Ca -0.08 0.53 -0.00 0.00 -0.76 0.00 0.00 57.45 57.13 1x8l n PHE 31 Cb 0.51 -2.42 0.27 0.00 0.35 0.00 0.00 39.48 38.18 1x8l n PHE 31 CO 0.00 0.00 0.00 -1.35 -0.76 0.00 0.00 176.76 174.65 1x8l h PRO 32 N 6.07 0.71 -6.31 -7.13 0.11 -1.89 -3.42 132.00 120.14 1x8l h PRO 32 Ca -0.47 -0.11 -0.57 0.00 0.11 0.00 0.00 66.00 64.96 1x8l h PRO 32 Cb 1.32 -0.12 -0.04 0.00 0.11 0.00 0.00 31.00 32.26 1x8l h PRO 32 CO 0.87 0.61 0.98 0.99 -0.21 0.00 0.00 178.00 181.24 1x8l s THR 33 N -5.27 4.11 0.60 -1.15 2.01 -1.26 -5.03 115.64 109.65 1x8l s THR 33 Ca -0.09 1.27 0.01 0.00 0.31 0.00 0.00 61.69 63.19 1x8l s THR 33 Cb 0.16 -4.07 0.06 0.00 0.01 0.00 0.00 72.50 68.66 1x8l s THR 33 CO 0.78 -0.39 0.83 0.42 -0.69 0.00 0.00 174.62 175.57 1x8l s THR 34 N 4.32 2.50 0.18 -0.82 -4.23 -1.26 -4.92 115.64 111.41 1x8l s THR 34 Ca 0.58 -0.66 0.07 0.00 -1.18 0.00 0.00 61.69 60.50 1x8l s THR 34 Cb -0.19 -2.84 -0.04 0.00 1.34 0.00 0.00 72.50 70.78 1x8l s THR 34 CO 0.22 0.00 0.04 -0.31 -0.54 0.00 0.00 174.62 174.03 1x8l s TYR 35 N -2.86 2.91 0.22 3.99 1.51 -1.26 -0.97 117.35 120.89 1x8l s TYR 35 Ca 0.60 -0.12 0.04 0.00 -1.01 0.00 0.00 57.07 56.58 1x8l s TYR 35 Cb -0.09 -1.39 -0.05 0.00 -0.11 0.00 0.00 41.96 40.32 1x8l s TYR 35 CO 0.40 0.53 -0.03 0.14 -1.11 0.00 0.00 175.55 175.47 1x8l s VAL 36 N -1.79 1.13 -0.22 0.71 -7.23 -0.33 -4.63 120.40 108.03 1x8l s VAL 36 Ca 0.29 -2.05 -0.10 0.00 -1.81 0.00 0.00 61.98 58.30 1x8l s VAL 36 Cb -0.09 -2.25 -0.05 0.00 0.56 0.00 0.00 36.38 34.55 1x8l s VAL 36 CO 0.20 -0.41 0.15 -0.54 -0.31 0.00 0.00 175.10 174.19 1x8l s LYS 37 N -3.82 4.13 -0.22 4.82 1.02 -0.80 -1.44 119.74 123.42 1x8l s LYS 37 Ca 0.26 -0.23 0.01 0.00 0.02 0.00 0.00 55.97 56.02 1x8l s LYS 37 Cb 0.05 -3.48 0.03 0.00 -0.52 0.00 0.00 37.83 33.90 1x8l s LYS 37 CO 0.07 0.17 -0.13 -1.17 -0.92 0.00 0.00 175.35 173.37 1x8l s LEU 38 N 0.73 2.76 0.00 3.17 2.96 0.06 -1.23 118.68 127.14 1x8l s LEU 38 Ca 0.08 -0.88 0.00 0.00 -0.22 0.00 0.00 54.13 53.11 1x8l s LEU 38 Cb -0.12 -1.56 0.00 0.00 0.50 0.00 0.00 46.19 45.01 1x8l s LEU 38 CO 0.02 -0.08 0.00 0.61 -1.32 0.00 0.00 176.35 175.58 1x8l n GLY 39 N 4.59 -2.87 0.24 7.98 0.00 0.06 -2.52 105.19 112.66 1x8l n GLY 39 Ca -0.18 -1.71 0.09 0.00 0.00 0.00 0.00 46.02 44.22 1x8l n GLY 39 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x8l h PRO 40 N 0.00 0.00 0.00 1.61 0.13 -1.96 -1.50 132.00 130.28 1x8l h PRO 40 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1x8l h PRO 40 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1x8l h PRO 40 CO 0.00 0.20 0.00 1.63 -0.23 0.00 0.00 178.00 179.60 1x8l n LYS 41 N -3.74 0.19 -3.65 0.86 5.02 -1.26 -4.96 118.16 110.61 1x8l n LYS 41 Ca -0.02 0.03 -0.24 0.00 -2.02 0.00 0.00 58.31 56.06 1x8l n LYS 41 Cb 0.31 -1.50 0.06 0.00 -0.02 0.00 0.00 35.03 33.88 1x8l n LYS 41 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1x8l n GLY 42 N 1.22 -0.47 3.66 0.72 0.00 -0.57 -4.57 105.19 105.19 1x8l n GLY 42 Ca 0.10 0.20 -0.46 0.00 0.00 0.00 0.00 46.02 45.85 1x8l n GLY 42 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1x8l n TYR 43 N -4.67 2.19 -2.52 1.61 4.02 -1.05 -4.41 117.16 112.33 1x8l n TYR 43 Ca -0.08 0.33 -0.43 0.00 -0.01 0.00 0.00 57.90 57.71 1x8l n TYR 43 Cb 0.59 -2.51 -0.02 0.00 -0.02 0.00 0.00 39.34 37.38 1x8l n TYR 43 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 176.86 174.21 1x8l s MET 44 N 0.61 3.70 0.07 -0.72 -1.94 -0.38 -0.76 119.30 119.89 1x8l s MET 44 Ca 0.77 0.72 0.09 0.00 -1.71 0.00 0.00 55.69 55.56 1x8l s MET 44 Cb -0.69 -3.93 -0.03 0.00 2.01 0.00 0.00 34.83 32.18 1x8l s MET 44 CO 0.41 -1.41 -0.24 0.14 -0.01 0.00 0.00 175.02 173.91 1x8l s VAL 45 N 4.70 2.37 0.41 -6.03 -7.23 -0.52 -0.06 120.40 114.04 1x8l s VAL 45 Ca 0.52 -1.43 -0.25 0.00 -1.81 0.00 0.00 61.98 59.01 1x8l s VAL 45 Cb -0.10 -1.98 -0.08 0.00 0.56 0.00 0.00 36.38 34.78 1x8l s VAL 45 CO 0.31 0.28 1.22 -0.31 -0.31 0.00 0.00 175.10 176.29 1x8l s TYR 46 N -0.91 2.94 0.26 2.82 1.51 -1.26 -1.19 117.35 121.52 1x8l s TYR 46 Ca 0.13 1.50 -0.03 0.00 -1.01 0.00 0.00 57.07 57.66 1x8l s TYR 46 Cb -0.10 -3.51 0.53 0.00 -0.11 0.00 0.00 41.96 38.77 1x8l s TYR 46 CO 0.04 -1.66 1.68 -0.09 -1.11 0.00 0.00 175.55 174.41 1x8l h ARG 47 N 2.58 0.27 0.00 -0.62 2.43 -1.30 -0.00 114.38 117.75 1x8l h ARG 47 Ca -0.49 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.66 1x8l h ARG 47 Cb 1.24 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.73 1x8l h ARG 47 CO 0.62 0.18 0.19 -1.35 -1.51 0.00 0.00 179.97 178.10 1x8l h PRO 48 N 0.28 0.00 -0.28 0.20 0.11 -1.87 -1.58 132.00 128.87 1x8l h PRO 48 Ca 0.45 0.00 0.08 0.00 0.11 0.00 0.00 66.00 66.64 1x8l h PRO 48 Cb 0.80 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.90 1x8l h PRO 48 CO -0.53 0.00 0.20 -0.92 -0.21 0.00 0.00 178.00 176.54 1x8l h TYR 49 N 0.00 0.01 -0.11 0.65 3.20 -1.20 -3.11 116.97 116.41 1x8l h TYR 49 Ca 0.00 0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.81 1x8l h TYR 49 Cb 0.37 -0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.63 1x8l h TYR 49 CO 0.00 0.00 -0.19 -0.07 -1.64 0.00 0.00 178.16 176.26 1x8l h LEU 50 N 0.01 0.16 -2.02 2.82 3.38 -1.49 -1.99 115.31 116.18 1x8l h LEU 50 Ca 0.13 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 1x8l h LEU 50 Cb 0.52 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.22 1x8l h LEU 50 CO -0.00 0.37 -0.10 0.07 0.09 0.00 0.00 178.44 178.87 1x8l h LYS 51 N 0.16 0.00 -0.07 1.13 2.10 -1.77 -3.08 116.57 115.04 1x8l h LYS 51 Ca 0.03 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.68 1x8l h LYS 51 Cb 0.44 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.77 1x8l h LYS 51 CO 0.03 0.10 0.00 -3.47 -2.00 0.00 0.00 179.45 174.11 1x8l n ASP 52 N -3.80 1.86 -0.13 7.07 2.03 -0.96 -4.81 116.55 117.80 1x8l n ASP 52 Ca -0.02 -1.51 -0.10 0.00 0.52 0.00 0.00 54.79 53.68 1x8l n ASP 52 Cb 0.20 -0.04 -0.01 0.00 -0.72 0.00 0.00 41.12 40.54 1x8l n ASP 52 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1x8l h ALA 53 N 1.18 0.52 -0.33 -1.67 0.00 -1.28 -1.70 119.26 115.97 1x8l h ALA 53 Ca 0.00 -0.20 -0.11 0.00 0.00 0.00 0.00 54.91 54.59 1x8l h ALA 53 Cb 0.39 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1x8l h ALA 53 CO 0.00 0.21 -0.27 0.00 0.00 0.00 0.00 179.25 179.20 1x8l h ALA 54 N 0.93 0.92 -0.65 0.00 0.00 -1.87 -1.42 119.26 117.17 1x8l h ALA 54 Ca 0.12 -0.38 -0.04 0.00 0.00 0.00 0.00 54.91 54.61 1x8l h ALA 54 Cb 0.34 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 1x8l h ALA 54 CO 0.00 0.62 0.22 -0.91 0.00 0.00 0.00 179.25 179.19 1x8l h ASN 55 N 0.58 0.89 -0.22 0.00 2.35 -1.79 -2.26 115.58 115.13 1x8l h ASN 55 Ca 0.08 -0.14 -0.14 0.00 -0.55 0.00 0.00 56.30 55.55 1x8l h ASN 55 Cb 0.75 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.89 1x8l h ASN 55 CO 0.06 0.82 -0.40 0.40 -1.65 0.00 0.00 177.43 176.67 1x8l h ILE 56 N 0.94 1.32 -0.44 2.81 2.04 -1.14 -0.36 117.51 122.69 1x8l h ILE 56 Ca 0.21 -1.61 0.10 0.00 1.00 0.00 0.00 64.86 64.56 1x8l h ILE 56 Cb 0.23 1.80 -0.02 0.00 -0.74 0.00 0.00 36.82 38.10 1x8l h ILE 56 CO -0.01 0.50 0.31 0.22 0.00 0.00 0.00 178.15 179.17 1x8l h TYR 57 N 0.36 0.14 -0.28 1.37 3.20 -1.11 -2.69 116.97 117.95 1x8l h TYR 57 Ca 0.01 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.89 1x8l h TYR 57 Cb 0.99 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 39.22 1x8l h TYR 57 CO 0.09 0.07 0.00 0.09 -1.64 0.00 0.00 178.16 176.76 1x8l n ASN 58 N -4.44 3.51 -4.70 -2.11 3.02 -0.86 -3.27 115.26 106.41 1x8l n ASN 58 Ca 0.07 -2.67 -0.43 0.00 -0.03 0.00 0.00 54.58 51.52 1x8l n ASN 58 Cb 0.42 -0.43 -0.03 0.00 -0.61 0.00 0.00 39.78 39.12 1x8l n ASN 58 CO 0.00 0.00 0.00 1.15 -2.62 0.00 0.00 177.26 175.79 1x8l n MET 59 N -0.20 2.70 -1.71 3.52 0.00 -0.16 -4.92 117.12 116.35 1x8l n MET 59 Ca 0.18 0.98 -0.42 0.00 0.00 0.00 0.00 57.70 58.43 1x8l n MET 59 Cb 0.73 -2.84 -0.03 0.00 0.00 0.00 0.00 33.22 31.07 1x8l n MET 59 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 175.97 173.67 1x8l n PRO 60 N 4.84 2.78 -4.09 3.17 -0.02 -1.26 -4.92 135.00 135.50 1x8l n PRO 60 Ca 0.17 1.01 -0.23 0.00 -2.02 0.00 0.00 63.50 62.43 1x8l n PRO 60 Cb 0.35 -2.87 -0.06 0.00 -0.02 0.00 0.00 33.50 30.90 1x8l n PRO 60 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1x8l s LEU 61 N 1.71 3.24 0.02 2.45 1.43 -1.26 -4.99 118.68 121.28 1x8l s LEU 61 Ca 0.77 -0.81 0.01 0.00 -1.03 0.00 0.00 54.13 53.07 1x8l s LEU 61 Cb -0.50 -1.71 -0.02 0.00 0.03 0.00 0.00 46.19 44.00 1x8l s LEU 61 CO 0.34 -0.34 -0.04 -0.13 0.23 0.00 0.00 176.35 176.42 1x8l s ARG 62 N -3.86 0.31 0.57 1.70 0.52 -1.26 -5.07 118.95 111.86 1x8l s ARG 62 Ca 0.38 -0.50 0.26 0.00 -0.52 0.00 0.00 55.73 55.36 1x8l s ARG 62 Cb -0.02 -0.03 1.67 0.00 0.52 0.00 0.00 34.95 37.09 1x8l s ARG 62 CO 0.23 -0.01 2.22 -1.00 0.02 0.00 0.00 175.30 176.75 1x8l h PRO 63 N 4.99 0.00 -0.00 3.54 0.13 -1.99 -1.42 132.00 137.26 1x8l h PRO 63 Ca -0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 1x8l h PRO 63 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1x8l h PRO 63 CO 0.43 0.00 -0.28 0.25 -0.23 0.00 0.00 178.00 178.18 1x8l n THR 64 N -4.03 0.00 -1.64 1.56 -2.24 -1.26 -4.72 114.28 101.96 1x8l n THR 64 Ca -0.02 -0.02 -0.46 0.00 -2.27 0.00 0.00 64.05 61.27 1x8l n THR 64 Cb 0.11 -0.01 -0.03 0.00 -2.10 0.00 0.00 70.33 68.30 1x8l n THR 64 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1x8l n ASP 65 N -1.35 2.32 -4.17 3.42 8.00 -0.53 -4.53 116.55 119.70 1x8l n ASP 65 Ca 0.08 1.13 -0.28 0.00 0.71 0.00 0.00 54.79 56.43 1x8l n ASP 65 Cb 0.33 -1.35 -0.16 0.00 -0.02 0.00 0.00 41.12 39.91 1x8l n ASP 65 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1x8l s VAL 66 N 0.05 1.65 -0.05 2.53 0.11 -0.72 -2.77 120.40 121.20 1x8l s VAL 66 Ca 0.72 -0.83 0.04 0.00 -2.93 0.00 0.00 61.98 58.98 1x8l s VAL 66 Cb -0.73 -1.41 -0.03 0.00 -1.53 0.00 0.00 36.38 32.68 1x8l s VAL 66 CO 0.49 0.47 -0.15 -0.36 -3.33 0.00 0.00 175.10 172.21 1x8l s PHE 67 N 0.06 2.68 -0.24 1.54 0.40 0.07 -0.42 117.98 122.07 1x8l s PHE 67 Ca -0.06 -0.17 0.00 0.00 -0.60 0.00 0.00 56.93 56.09 1x8l s PHE 67 Cb -0.13 -1.62 0.04 0.00 0.51 0.00 0.00 43.02 41.81 1x8l s PHE 67 CO 0.03 0.17 -0.10 0.08 0.70 0.00 0.00 175.22 176.11 1x8l s VAL 68 N -0.73 2.55 0.15 -0.44 1.01 -0.01 -1.06 120.40 121.86 1x8l s VAL 68 Ca 0.11 -1.19 0.10 0.00 0.00 0.00 0.00 61.98 61.00 1x8l s VAL 68 Cb -0.11 -2.32 -0.04 0.00 0.00 0.00 0.00 36.38 33.92 1x8l s VAL 68 CO 0.00 0.18 -0.22 0.00 0.00 0.00 0.00 175.10 175.07 1x8l s ALA 69 N 1.26 2.16 -0.23 5.51 0.00 -0.33 -2.23 121.76 127.90 1x8l s ALA 69 Ca -0.02 -1.47 -0.32 0.00 0.00 0.00 0.00 51.96 50.15 1x8l s ALA 69 Cb -0.17 -0.27 0.16 0.00 0.00 0.00 0.00 23.12 22.84 1x8l s ALA 69 CO -0.06 0.37 1.24 -1.54 0.00 0.00 0.00 175.76 175.77 1x8l s SER 70 N -2.38 -0.13 0.26 0.00 1.04 -1.14 -1.64 113.70 109.70 1x8l s SER 70 Ca 0.15 0.09 -0.30 0.00 0.48 0.00 0.00 55.95 56.36 1x8l s SER 70 Cb -0.08 0.12 -0.10 0.00 0.10 0.00 0.00 66.02 66.06 1x8l s SER 70 CO 0.07 -0.16 1.41 -0.47 0.98 0.00 0.00 173.24 175.07 1x8l s TYR 71 N -1.63 3.03 0.76 5.02 5.04 -1.26 -4.10 117.35 124.21 1x8l s TYR 71 Ca 0.07 1.09 -0.15 0.00 -2.44 0.00 0.00 57.07 55.65 1x8l s TYR 71 Cb -0.01 -3.79 0.01 0.00 0.35 0.00 0.00 41.96 38.52 1x8l s TYR 71 CO -0.05 -2.51 0.86 0.00 -1.34 0.00 0.00 175.55 172.51 1x8l n GLN 72 N 2.10 0.31 -2.63 4.97 10.64 -1.26 -3.56 117.38 127.96 1x8l n GLN 72 Ca 0.06 0.16 -0.15 0.00 -1.83 0.00 0.00 57.00 55.24 1x8l n GLN 72 Cb 0.41 -2.14 0.02 0.00 -0.86 0.00 0.00 30.24 27.66 1x8l n GLN 72 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.06 175.77 1x8l n ARG 73 N -1.88 -2.73 -0.01 2.61 5.12 -1.26 -4.91 116.66 113.60 1x8l n ARG 73 Ca 0.12 0.65 0.01 0.00 -1.93 0.00 0.00 57.85 56.70 1x8l n ARG 73 Cb 0.50 -4.94 0.01 0.00 -1.16 0.00 0.00 32.46 26.88 1x8l n ARG 73 CO 0.00 0.00 0.00 0.43 -1.93 0.00 0.00 177.63 176.13 1x8l n SER 74 N -1.06 1.94 0.00 0.55 7.64 -1.23 -4.66 113.62 116.79 1x8l n SER 74 Ca -0.11 -2.06 0.00 0.00 1.01 0.00 0.00 58.87 57.71 1x8l n SER 74 Cb 0.60 -0.04 0.00 0.00 -1.01 0.00 0.00 64.21 63.76 1x8l n SER 74 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x8l n GLY 75 N -0.57 1.29 0.10 0.23 0.00 -1.26 -4.22 105.19 100.76 1x8l n GLY 75 Ca 0.02 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.94 1x8l n GLY 75 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1x8l h THR 76 N 0.00 0.82 -0.55 2.61 2.02 -1.93 -2.69 112.91 113.18 1x8l h THR 76 Ca 0.00 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.14 1x8l h THR 76 Cb 0.00 0.82 -0.02 0.00 -1.74 0.00 0.00 68.15 67.20 1x8l h THR 76 CO 0.00 0.00 0.20 0.74 0.37 0.00 0.00 175.52 176.83 1x8l h THR 77 N -0.02 1.23 -0.35 3.16 2.02 -1.98 0.12 112.91 117.09 1x8l h THR 77 Ca 0.08 -0.74 0.05 0.00 0.77 0.00 0.00 66.41 66.57 1x8l h THR 77 Cb 0.14 0.67 -0.04 0.00 -1.74 0.00 0.00 68.15 67.18 1x8l h THR 77 CO -0.17 0.28 0.09 0.24 0.37 0.00 0.00 175.52 176.32 1x8l h MET 78 N 0.76 0.21 -0.16 6.66 2.86 -1.99 -2.50 114.93 120.77 1x8l h MET 78 Ca 0.18 -0.01 -0.03 0.00 -2.06 0.00 0.00 59.70 57.78 1x8l h MET 78 Cb 0.23 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.84 1x8l h MET 78 CO -0.01 0.14 -0.01 1.15 1.06 0.00 0.00 176.91 179.24 1x8l h THR 79 N 0.22 1.27 -0.69 2.22 2.02 -1.05 -2.22 112.91 114.67 1x8l h THR 79 Ca 0.16 -0.90 0.13 0.00 0.77 0.00 0.00 66.41 66.58 1x8l h THR 79 Cb 0.17 1.55 -0.13 0.00 -1.74 0.00 0.00 68.15 68.00 1x8l h THR 79 CO -0.20 0.27 -0.26 1.56 0.37 0.00 0.00 175.52 177.26 1x8l h GLN 80 N 0.01 -0.06 -0.37 6.66 4.20 -0.71 0.11 115.11 124.95 1x8l h GLN 80 Ca 0.04 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.75 1x8l h GLN 80 Cb 0.41 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.19 1x8l h GLN 80 CO 0.01 -0.04 0.20 1.49 -0.67 0.00 0.00 178.83 179.82 1x8l h GLU 81 N -0.07 0.52 0.07 1.46 4.57 -1.28 -0.23 114.58 119.62 1x8l h GLU 81 Ca 0.31 -0.06 -0.00 0.00 -1.18 0.00 0.00 59.36 58.42 1x8l h GLU 81 Cb 0.55 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.04 1x8l h GLU 81 CO -0.74 0.43 -0.03 -0.07 -1.18 0.00 0.00 179.01 177.41 1x8l h LEU 82 N 0.47 -0.08 -0.60 1.64 3.38 -0.73 -1.23 115.31 118.16 1x8l h LEU 82 Ca 0.13 -0.05 -0.05 0.00 0.09 0.00 0.00 57.88 58.00 1x8l h LEU 82 Cb 0.07 0.02 -0.03 0.00 0.09 0.00 0.00 40.66 40.81 1x8l h LEU 82 CO -0.02 -0.01 0.18 0.58 0.09 0.00 0.00 178.44 179.26 1x8l h VAL 83 N -0.15 1.25 0.05 1.22 2.07 -0.76 -0.68 116.25 119.24 1x8l h VAL 83 Ca -0.01 -0.85 -0.00 0.00 0.82 0.00 0.00 66.70 66.65 1x8l h VAL 83 Cb 0.12 0.65 0.00 0.00 -1.52 0.00 0.00 31.29 30.55 1x8l h VAL 83 CO 0.02 0.32 -0.02 -0.25 0.02 0.00 0.00 177.57 177.65 1x8l h TRP 84 N 0.87 -0.06 -0.40 1.57 7.01 -0.85 -1.24 115.95 122.84 1x8l h TRP 84 Ca 0.19 -0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.20 1x8l h TRP 84 Cb 0.31 0.02 -0.02 0.00 -2.10 0.00 0.00 29.16 27.37 1x8l h TRP 84 CO 0.02 0.07 0.27 -0.07 -2.79 0.00 0.00 178.44 175.93 1x8l h LEU 85 N -0.18 0.46 -0.39 0.65 3.38 -1.15 -1.10 115.31 116.98 1x8l h LEU 85 Ca -0.01 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1x8l h LEU 85 Cb 0.16 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 1x8l h LEU 85 CO 0.01 0.33 0.22 0.40 0.09 0.00 0.00 178.44 179.49 1x8l h ILE 86 N 0.54 1.15 0.00 1.22 2.04 -1.03 -0.23 117.51 121.20 1x8l h ILE 86 Ca 0.15 -0.37 -0.04 0.00 1.00 0.00 0.00 64.86 65.59 1x8l h ILE 86 Cb -0.06 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 36.70 1x8l h ILE 86 CO -0.03 0.15 -0.21 -0.33 0.00 0.00 0.00 178.15 177.73 1x8l h GLU 87 N 0.50 0.00 -0.89 2.37 4.39 -1.13 -3.18 114.58 116.64 1x8l h GLU 87 Ca 0.14 0.00 -0.54 0.00 0.34 0.00 0.00 59.36 59.30 1x8l h GLU 87 Cb 0.05 0.00 -0.28 0.00 -0.10 0.00 0.00 28.75 28.42 1x8l h GLU 87 CO -0.02 0.21 0.53 0.09 -1.16 0.00 0.00 179.01 178.65 1x8l n ASN 88 N -4.00 5.18 -3.84 1.42 3.02 -0.42 -4.94 115.26 111.68 1x8l n ASN 88 Ca -0.02 -3.72 -0.25 0.00 -0.03 0.00 0.00 54.58 50.56 1x8l n ASN 88 Cb 0.29 -0.83 0.02 0.00 -0.61 0.00 0.00 39.78 38.64 1x8l n ASN 88 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1x8l n ASP 89 N -1.03 -2.06 -4.04 6.41 10.43 -1.04 -1.67 116.55 123.55 1x8l n ASP 89 Ca 0.56 -0.86 -0.33 0.00 2.57 0.00 0.00 54.79 56.73 1x8l n ASP 89 Cb 1.15 -3.73 -0.03 0.00 1.84 0.00 0.00 41.12 40.35 1x8l n ASP 89 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 1x8l n LEU 90 N -4.42 -1.49 -4.57 0.64 4.77 -0.15 -4.87 117.00 106.92 1x8l n LEU 90 Ca -0.19 -0.86 -0.41 0.00 -0.03 0.00 0.00 56.01 54.52 1x8l n LEU 90 Cb 0.63 -1.98 -0.02 0.00 -2.33 0.00 0.00 43.42 39.72 1x8l n LEU 90 CO 0.73 0.23 1.73 0.21 -1.33 0.00 0.00 177.39 178.96 1x8l s ASN 91 N -3.12 6.53 0.40 -1.43 3.84 -0.67 -4.81 114.94 115.68 1x8l s ASN 91 Ca 0.67 -1.95 0.12 0.00 0.21 0.00 0.00 52.86 51.91 1x8l s ASN 91 Cb -0.37 -2.58 0.84 0.00 -0.55 0.00 0.00 41.25 38.59 1x8l s ASN 91 CO 0.82 -1.48 1.91 -0.26 -2.79 0.00 0.00 177.10 175.30 1x8l h PHE 92 N 8.70 0.09 0.59 0.43 -1.00 -1.90 -2.72 116.94 121.15 1x8l h PHE 92 Ca 0.33 -0.01 -0.03 0.00 2.81 0.00 0.00 57.97 61.06 1x8l h PHE 92 Cb 0.93 -0.03 0.01 0.00 3.61 0.00 0.00 35.95 40.47 1x8l h PHE 92 CO 1.35 0.31 -0.28 1.49 -1.61 0.00 0.00 178.31 179.56 1x8l h GLU 93 N 0.08 -0.77 -0.64 1.51 4.57 -2.01 -2.76 114.58 114.57 1x8l h GLU 93 Ca 0.01 0.05 0.19 0.00 -1.18 0.00 0.00 59.36 58.43 1x8l h GLU 93 Cb 0.44 0.17 -0.03 0.00 -0.16 0.00 0.00 28.75 29.18 1x8l h GLU 93 CO 0.03 -0.48 0.48 0.00 -1.18 0.00 0.00 179.01 177.86 1x8l h ALA 94 N -0.54 2.59 -0.00 2.92 0.00 -1.93 -1.82 119.26 120.48 1x8l h ALA 94 Ca -0.08 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1x8l h ALA 94 Cb 0.65 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1x8l h ALA 94 CO 0.13 -0.81 -0.03 0.00 0.00 0.00 0.00 179.25 178.55 1x8l n ALA 95 N -2.64 2.56 0.35 0.00 0.00 -1.04 -3.42 120.51 116.32 1x8l n ALA 95 Ca 0.13 -0.17 0.11 0.00 0.00 0.00 0.00 53.44 53.51 1x8l n ALA 95 Cb 0.73 -1.46 0.50 0.00 0.00 0.00 0.00 19.45 19.22 1x8l n ALA 95 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1x8l n LYS 96 N -1.21 0.18 -2.19 0.00 5.02 -0.68 -4.75 118.16 114.52 1x8l n LYS 96 Ca 0.15 0.46 -0.37 0.00 -2.02 0.00 0.00 58.31 56.53 1x8l n LYS 96 Cb 0.24 -1.88 0.00 0.00 -0.02 0.00 0.00 35.03 33.38 1x8l n LYS 96 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1x8l s THR 97 N -3.35 2.98 0.23 -0.18 -4.23 -1.22 -4.59 115.64 105.28 1x8l s THR 97 Ca 0.03 0.70 -0.30 0.00 -1.18 0.00 0.00 61.69 60.94 1x8l s THR 97 Cb 0.09 -3.34 -0.15 0.00 1.34 0.00 0.00 72.50 70.44 1x8l s THR 97 CO 0.35 -0.04 1.13 -1.22 -0.54 0.00 0.00 174.62 174.29 1x8l n TYR 98 N -0.76 1.40 -0.25 3.99 0.53 -1.26 -4.85 117.16 115.97 1x8l n TYR 98 Ca 0.09 0.66 0.15 0.00 -1.02 0.00 0.00 57.90 57.77 1x8l n TYR 98 Cb 0.48 -2.29 0.44 0.00 -1.03 0.00 0.00 39.34 36.94 1x8l n TYR 98 CO 0.00 0.00 0.00 1.98 -1.02 0.00 0.00 176.86 177.82 1x8l h MET 99 N 2.87 0.55 0.00 -0.72 1.85 -1.36 -1.66 114.93 116.47 1x8l h MET 99 Ca -0.42 -0.03 0.00 0.00 -0.61 0.00 0.00 59.70 58.64 1x8l h MET 99 Cb 1.33 -0.12 0.00 0.00 0.43 0.00 0.00 31.60 33.24 1x8l h MET 99 CO 0.67 0.36 0.00 -1.13 -0.40 0.00 0.00 176.91 176.41 1x8l n SER 100 N -4.55 0.11 0.01 1.39 3.41 -1.26 -1.16 113.62 111.57 1x8l n SER 100 Ca 0.18 0.52 0.11 0.00 -0.26 0.00 0.00 58.87 59.42 1x8l n SER 100 Cb 0.55 -0.55 -0.06 0.00 -0.26 0.00 0.00 64.21 63.90 1x8l n SER 100 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1x8l n LEU 101 N -1.62 0.66 -0.00 1.04 4.77 -0.64 -4.47 117.00 116.74 1x8l n LEU 101 Ca 0.05 -0.23 0.05 0.00 -0.03 0.00 0.00 56.01 55.85 1x8l n LEU 101 Cb 0.24 -0.05 -0.13 0.00 -2.33 0.00 0.00 43.42 41.16 1x8l n LEU 101 CO 0.19 0.13 -0.63 0.54 -1.33 0.00 0.00 177.39 176.29 1x8l n ARG 102 N -1.78 0.65 -4.45 3.23 1.74 -0.31 -4.91 116.66 110.83 1x8l n ARG 102 Ca 0.02 -0.04 -0.25 0.00 -0.77 0.00 0.00 57.85 56.81 1x8l n ARG 102 Cb 0.41 -1.62 -0.13 0.00 -1.02 0.00 0.00 32.46 30.10 1x8l n ARG 102 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1x8l s TYR 103 N -3.20 1.85 -0.12 -1.55 1.51 -0.35 -4.46 117.35 111.03 1x8l s TYR 103 Ca -0.06 -0.40 -0.18 0.00 -1.01 0.00 0.00 57.07 55.42 1x8l s TYR 103 Cb 0.11 -1.05 -0.04 0.00 -0.11 0.00 0.00 41.96 40.87 1x8l s TYR 103 CO 0.86 0.17 0.48 0.42 -1.11 0.00 0.00 175.55 176.36 1x8l s ILE 104 N -1.00 5.19 -0.74 2.71 -1.09 -0.46 -4.68 121.20 121.13 1x8l s ILE 104 Ca 0.08 0.95 -0.18 0.00 -2.23 0.00 0.00 60.65 59.26 1x8l s ILE 104 Cb -0.10 -3.82 0.13 0.00 -1.58 0.00 0.00 42.46 37.10 1x8l s ILE 104 CO 0.03 0.32 0.85 -0.47 -1.23 0.00 0.00 174.94 174.44 1x8l s TYR 105 N 0.68 3.17 0.25 3.97 6.04 -1.26 -0.20 117.35 130.00 1x8l s TYR 105 Ca 0.26 -1.26 -0.04 0.00 0.04 0.00 0.00 57.07 56.06 1x8l s TYR 105 Cb -0.15 -4.07 0.40 0.00 -1.04 0.00 0.00 41.96 37.10 1x8l s TYR 105 CO 0.10 -1.31 1.81 1.25 -1.54 0.00 0.00 175.55 175.86 1x8l h LEU 106 N 9.74 0.68 -3.11 6.97 5.85 -1.02 -2.83 115.31 131.60 1x8l h LEU 106 Ca -0.09 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.68 1x8l h LEU 106 Cb 1.06 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.01 1x8l h LEU 106 CO 1.04 0.39 0.00 -0.90 -0.34 0.00 0.00 178.44 178.62 1x8l n ASP 107 N -4.74 3.50 0.08 1.25 5.75 -1.26 -3.82 116.55 117.32 1x8l n ASP 107 Ca 0.14 -2.60 0.01 0.00 -0.01 0.00 0.00 54.79 52.33 1x8l n ASP 107 Cb 0.28 -0.42 0.33 0.00 -1.03 0.00 0.00 41.12 40.28 1x8l n ASP 107 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 1x8l h GLY 108 N 1.91 0.34 0.91 6.12 0.00 -1.85 -3.16 103.07 107.34 1x8l h GLY 108 Ca 0.00 -0.23 0.06 0.00 0.00 0.00 0.00 47.33 47.16 1x8l h GLY 108 CO 0.13 0.21 0.58 0.27 0.00 0.00 0.00 176.54 177.73 1x8l h PHE 109 N 0.30 1.03 -0.01 5.60 -5.15 -1.81 -3.30 116.94 113.60 1x8l h PHE 109 Ca 0.06 0.03 0.00 0.00 -0.20 0.00 0.00 57.97 57.85 1x8l h PHE 109 Cb 0.46 -0.34 -0.00 0.00 0.22 0.00 0.00 35.95 36.29 1x8l h PHE 109 CO 0.01 0.56 0.01 0.00 -2.00 0.00 0.00 178.31 176.89 1x8l h MET 110 N 1.03 0.00 0.00 6.09 -0.00 -1.84 -2.16 114.93 118.04 1x8l h MET 110 Ca 0.37 0.00 -0.02 0.00 -0.00 0.00 0.00 59.70 60.05 1x8l h MET 110 Cb 0.15 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 31.75 1x8l h MET 110 CO -0.13 0.00 -0.09 0.97 -0.00 0.00 0.00 176.91 177.65 1x8l h ILE 111 N 0.00 0.28 -3.40 -0.10 2.10 -1.82 -3.37 117.51 111.20 1x8l h ILE 111 Ca 0.00 -0.68 -0.63 0.00 1.08 0.00 0.00 64.86 64.63 1x8l h ILE 111 Cb 0.03 1.53 -0.20 0.00 -1.09 0.00 0.00 36.82 37.08 1x8l h ILE 111 CO -0.00 0.09 -0.62 -0.47 -1.08 0.00 0.00 178.15 176.07 1x8l s TYR 112 N -3.79 3.11 -0.34 2.19 5.04 -0.81 -4.67 117.35 118.08 1x8l s TYR 112 Ca -0.00 -0.24 -0.10 0.00 -2.44 0.00 0.00 57.07 54.29 1x8l s TYR 112 Cb 0.10 -2.08 0.02 0.00 0.35 0.00 0.00 41.96 40.35 1x8l s TYR 112 CO 0.57 -0.09 0.16 0.34 -1.34 0.00 0.00 175.55 175.20 1x8l s ASP 113 N 0.76 5.55 0.60 4.32 3.68 -1.26 -4.85 116.67 125.48 1x8l s ASP 113 Ca 0.01 -0.83 0.37 0.00 2.13 0.00 0.00 52.55 54.24 1x8l s ASP 113 Cb -0.14 -1.98 1.94 0.00 -1.45 0.00 0.00 42.92 41.29 1x8l s ASP 113 CO 0.02 -0.30 2.22 -0.65 0.13 0.00 0.00 175.17 176.60 1x8l h PRO 114 N 8.36 0.00 0.00 4.34 0.11 -1.97 -1.07 132.00 141.77 1x8l h PRO 114 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1x8l h PRO 114 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1x8l h PRO 114 CO 0.64 0.03 0.00 0.93 -0.21 0.00 0.00 178.00 179.38 1x8l h GLU 115 N 0.00 0.00 -0.11 1.05 5.08 -2.05 -3.11 114.58 115.45 1x8l h GLU 115 Ca -0.00 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.32 1x8l h GLU 115 Cb 0.17 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 1x8l h GLU 115 CO 0.00 0.00 -0.17 1.63 -1.00 0.00 0.00 179.01 179.47 1x8l n LYS 116 N -2.81 1.73 -0.30 2.33 5.02 -0.41 -4.84 118.16 118.88 1x8l n LYS 116 Ca -0.01 -2.97 0.14 0.00 -2.02 0.00 0.00 58.31 53.45 1x8l n LYS 116 Cb 0.16 -1.65 0.30 0.00 -0.02 0.00 0.00 35.03 33.82 1x8l n LYS 116 CO 0.00 0.00 0.00 0.37 -0.52 0.00 0.00 177.40 177.25 1x8l h GLN 117 N 0.77 0.23 -0.64 1.97 4.15 -1.64 -0.01 115.11 119.95 1x8l h GLN 117 Ca 0.04 -0.01 -0.07 0.00 0.77 0.00 0.00 58.65 59.37 1x8l h GLN 117 Cb 1.19 -0.05 -0.03 0.00 0.21 0.00 0.00 27.48 28.80 1x8l h GLN 117 CO 0.11 0.15 0.10 0.93 -1.93 0.00 0.00 178.83 178.20 1x8l h GLU 118 N 0.24 1.04 -0.06 1.69 3.07 -1.89 -2.85 114.58 115.81 1x8l h GLU 118 Ca 0.56 -0.27 -0.07 0.00 -0.50 0.00 0.00 59.36 59.09 1x8l h GLU 118 Cb 1.14 -0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 28.91 1x8l h GLU 118 CO -0.63 0.96 -0.28 0.93 -1.40 0.00 0.00 179.01 178.59 1x8l h GLU 119 N 0.98 0.11 -0.72 2.33 5.08 -1.38 -3.30 114.58 117.69 1x8l h GLU 119 Ca 0.20 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.50 1x8l h GLU 119 Cb 0.42 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.63 1x8l h GLU 119 CO 0.01 0.39 0.36 1.88 -1.00 0.00 0.00 179.01 180.65 1x8l h TYR 120 N 0.10 1.01 -0.01 4.33 -1.99 -1.45 -2.73 116.97 116.23 1x8l h TYR 120 Ca 0.02 -0.04 0.00 0.00 2.00 0.00 0.00 58.73 60.71 1x8l h TYR 120 Cb 0.55 -0.32 0.00 0.00 2.00 0.00 0.00 36.73 38.96 1x8l h TYR 120 CO 0.00 0.74 -0.04 0.27 -0.00 0.00 0.00 178.16 179.13 1x8l n ASN 121 N -4.45 1.08 0.26 3.88 6.94 -1.24 -2.61 115.26 119.12 1x8l n ASN 121 Ca 0.06 -1.25 0.14 0.00 -0.02 0.00 0.00 54.58 53.51 1x8l n ASN 121 Cb 0.11 0.01 0.67 0.00 -2.36 0.00 0.00 39.78 38.21 1x8l n ASN 121 CO 0.00 0.00 0.00 0.44 -1.03 0.00 0.00 177.26 176.67 1x8l h ASP 122 N 1.63 0.00 1.08 0.53 5.19 -1.59 -3.04 116.42 120.21 1x8l h ASP 122 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1x8l h ASP 122 Cb 0.40 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.91 1x8l h ASP 122 CO 0.00 0.11 0.00 0.40 -3.12 0.00 0.00 179.24 176.63 1x8l h ILE 123 N 0.00 0.00 -3.45 0.35 1.08 -1.56 -3.45 117.51 110.48 1x8l h ILE 123 Ca -0.00 -0.54 -0.54 0.00 -0.39 0.00 0.00 64.86 63.40 1x8l h ILE 123 Cb 0.49 1.52 -0.03 0.00 -3.07 0.00 0.00 36.82 35.73 1x8l h ILE 123 CO 0.01 0.00 0.02 -0.76 -0.69 0.00 0.00 178.15 176.73 1x8l s LEU 124 N -6.10 4.33 0.45 1.44 1.43 -1.15 -4.98 118.68 114.10 1x8l s LEU 124 Ca 0.02 1.25 0.25 0.00 -1.03 0.00 0.00 54.13 54.62 1x8l s LEU 124 Cb 0.09 -3.44 0.66 0.00 0.03 0.00 0.00 46.19 43.52 1x8l s LEU 124 CO 0.55 0.06 1.72 1.55 0.23 0.00 0.00 176.35 180.46 1x8l h PRO 125 N 3.46 0.00 -2.02 1.29 0.13 -1.89 -3.37 132.00 129.61 1x8l h PRO 125 Ca -0.48 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.12 1x8l h PRO 125 Cb 1.19 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.93 1x8l h PRO 125 CO 0.65 0.09 -1.10 0.09 -0.23 0.00 0.00 178.00 177.50 1x8l n ASN 126 N -3.15 0.78 -0.22 1.44 4.13 -1.26 -4.98 115.26 112.01 1x8l n ASN 126 Ca 0.02 -2.90 0.12 0.00 1.68 0.00 0.00 54.58 53.51 1x8l n ASN 126 Cb 0.48 -0.63 0.41 0.00 -1.54 0.00 0.00 39.78 38.50 1x8l n ASN 126 CO 0.00 0.00 0.00 -0.65 0.28 0.00 0.00 177.26 176.89 1x8l h PRO 127 N 3.56 0.60 0.00 3.52 0.11 -1.83 -2.33 132.00 135.64 1x8l h PRO 127 Ca 0.09 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.16 1x8l h PRO 127 Cb 0.89 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 31.86 1x8l h PRO 127 CO 0.51 0.40 -0.01 1.05 -0.21 0.00 0.00 178.00 179.74 1x8l h GLU 128 N 0.62 0.00 -0.51 1.05 9.09 -1.95 -2.80 114.58 120.08 1x8l h GLU 128 Ca 0.40 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.81 1x8l h GLU 128 Cb 0.67 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.77 1x8l h GLU 128 CO -0.16 0.01 0.00 0.09 0.05 0.00 0.00 179.01 179.00 1x8l n ASN 129 N -3.24 2.75 -4.75 3.06 3.02 -0.88 -4.93 115.26 110.28 1x8l n ASN 129 Ca -0.02 -2.07 -0.40 0.00 -0.03 0.00 0.00 54.58 52.05 1x8l n ASN 129 Cb 0.12 -0.36 -0.04 0.00 -0.61 0.00 0.00 39.78 38.89 1x8l n ASN 129 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1x8l s LEU 130 N -1.09 4.53 -0.55 3.41 1.43 -1.06 -4.75 118.68 120.60 1x8l s LEU 130 Ca 0.33 2.26 -0.27 0.00 -1.03 0.00 0.00 54.13 55.41 1x8l s LEU 130 Cb 0.18 -3.62 0.00 0.00 0.03 0.00 0.00 46.19 42.78 1x8l s LEU 130 CO 0.21 -0.19 1.57 -0.62 0.23 0.00 0.00 176.35 177.55 1x8l s ASP 131 N -0.67 5.87 0.15 2.29 -1.08 -0.91 -4.89 116.67 117.44 1x8l s ASP 131 Ca 0.46 0.39 -0.02 0.00 -0.52 0.00 0.00 52.55 52.86 1x8l s ASP 131 Cb -0.32 -2.54 -0.02 0.00 -1.46 0.00 0.00 42.92 38.58 1x8l s ASP 131 CO 0.40 -1.89 1.37 0.24 0.52 0.00 0.00 175.17 175.81 1x8l h MET 132 N 12.26 0.37 -0.62 4.34 2.86 -1.93 -1.54 114.93 130.67 1x8l h MET 132 Ca -0.28 -0.35 0.02 0.00 -2.06 0.00 0.00 59.70 57.03 1x8l h MET 132 Cb 1.12 0.09 -0.04 0.00 0.06 0.00 0.00 31.60 32.83 1x8l h MET 132 CO 1.18 1.02 0.38 1.49 1.06 0.00 0.00 176.91 182.04 1x8l h GLU 133 N 0.22 0.74 0.01 1.72 4.81 -1.99 0.88 114.58 120.96 1x8l h GLU 133 Ca -0.05 -0.04 -0.20 0.00 -0.13 0.00 0.00 59.36 58.94 1x8l h GLU 133 Cb 1.46 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 30.66 1x8l h GLU 133 CO 0.14 0.49 -0.88 0.00 -0.73 0.00 0.00 179.01 178.03 1x8l h ARG 134 N 0.76 0.17 0.06 1.92 3.08 -1.94 -1.68 114.38 116.74 1x8l h ARG 134 Ca 0.24 -0.19 -0.00 0.00 0.07 0.00 0.00 59.98 60.10 1x8l h ARG 134 Cb 0.00 0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.11 1x8l h ARG 134 CO -0.09 0.94 -0.03 -0.92 -1.07 0.00 0.00 179.97 178.80 1x8l h TYR 135 N 0.09 -0.07 -0.53 3.04 3.20 -0.99 0.14 116.97 121.85 1x8l h TYR 135 Ca -0.04 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.81 1x8l h TYR 135 Cb 1.51 0.02 -0.03 0.00 1.54 0.00 0.00 36.73 39.78 1x8l h TYR 135 CO 0.03 0.28 0.26 -0.07 -1.64 0.00 0.00 178.16 177.01 1x8l h LEU 136 N -0.43 0.66 -0.72 2.82 3.38 -0.88 0.05 115.31 120.19 1x8l h LEU 136 Ca -0.01 -0.06 -0.07 0.00 0.09 0.00 0.00 57.88 57.83 1x8l h LEU 136 Cb 0.38 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 1x8l h LEU 136 CO 0.01 0.56 0.16 1.23 0.09 0.00 0.00 178.44 180.49 1x8l h GLY 137 N 0.84 1.22 0.90 0.83 0.00 -1.12 -1.12 103.07 104.62 1x8l h GLY 137 Ca 0.19 -0.77 -0.06 0.00 0.00 0.00 0.00 47.33 46.68 1x8l h GLY 137 CO -0.03 0.72 -0.04 -2.00 0.00 0.00 0.00 176.54 175.19 1x8l h LEU 138 N 1.07 0.60 -0.48 3.11 5.85 0.15 -2.19 115.31 123.43 1x8l h LEU 138 Ca 0.22 -0.34 0.01 0.00 0.84 0.00 0.00 57.88 58.61 1x8l h LEU 138 Cb 0.39 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.23 1x8l h LEU 138 CO 0.00 0.79 0.31 -0.07 -0.34 0.00 0.00 178.44 179.14 1x8l h LEU 139 N 0.39 0.53 -0.38 2.25 3.38 -0.83 -1.86 115.31 118.79 1x8l h LEU 139 Ca 0.09 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 1x8l h LEU 139 Cb 0.51 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 1x8l h LEU 139 CO 0.02 0.39 0.20 -0.08 0.09 0.00 0.00 178.44 179.06 1x8l h GLU 140 N 0.63 0.54 -1.00 1.13 4.81 -1.20 -1.95 114.58 117.54 1x8l h GLU 140 Ca 0.18 -0.07 0.10 0.00 -0.13 0.00 0.00 59.36 59.44 1x8l h GLU 140 Cb -0.06 -0.10 -0.08 0.00 0.63 0.00 0.00 28.75 29.14 1x8l h GLU 140 CO -0.05 0.45 0.64 -0.92 -0.73 0.00 0.00 179.01 178.40 1x8l h TYR 141 N 0.49 1.16 0.00 0.92 3.20 -1.24 -2.42 116.97 119.08 1x8l h TYR 141 Ca 0.13 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.04 1x8l h TYR 141 Cb 0.08 -0.37 0.00 0.00 1.54 0.00 0.00 36.73 37.97 1x8l h TYR 141 CO -0.02 0.52 0.00 0.43 -1.64 0.00 0.00 178.16 177.45 1x8l n SER 142 N -4.57 0.31 0.21 -2.11 7.64 -0.71 -2.25 113.62 112.15 1x8l n SER 142 Ca 0.17 0.54 0.13 0.00 1.01 0.00 0.00 58.87 60.73 1x8l n SER 142 Cb 0.29 -0.62 0.33 0.00 -1.01 0.00 0.00 64.21 63.20 1x8l n SER 142 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1x8l h SER 143 N 0.00 0.00 -3.25 6.43 0.02 -0.84 -3.42 113.55 112.49 1x8l h SER 143 Ca 0.00 0.00 -0.59 0.00 -0.84 0.00 0.00 61.79 60.36 1x8l h SER 143 Cb 0.52 0.00 -0.08 0.00 0.14 0.00 0.00 62.40 62.98 1x8l h SER 143 CO 0.00 0.00 0.53 -0.13 -1.14 0.00 0.00 176.83 176.09 1x8l s ARG 144 N -3.30 4.20 0.53 3.45 0.52 -0.95 -5.02 118.95 118.38 1x8l s ARG 144 Ca 0.06 1.02 -0.22 0.00 -0.52 0.00 0.00 55.73 56.07 1x8l s ARG 144 Cb 0.07 -3.64 -0.05 0.00 0.52 0.00 0.00 34.95 31.85 1x8l s ARG 144 CO 0.62 -0.53 1.35 -1.25 0.02 0.00 0.00 175.30 175.50 1x8l s PRO 145 N 2.88 3.26 0.40 3.54 0.04 -1.26 -4.75 135.00 139.11 1x8l s PRO 145 Ca 0.37 2.21 0.08 0.00 0.04 0.00 0.00 61.00 63.70 1x8l s PRO 145 Cb -0.15 -2.32 0.85 0.00 0.04 0.00 0.00 34.50 32.92 1x8l s PRO 145 CO 0.07 -1.09 2.01 0.78 0.04 0.00 0.00 177.00 178.82 1x8l h GLY 146 N 1.61 0.70 1.03 0.56 0.00 -1.88 -2.22 103.07 102.88 1x8l h GLY 146 Ca -0.51 -0.24 -0.03 0.00 0.00 0.00 0.00 47.33 46.56 1x8l h GLY 146 CO 0.58 0.20 0.43 1.48 0.00 0.00 0.00 176.54 179.22 1x8l h SER 147 N 0.60 1.08 0.49 0.19 4.64 -1.91 -1.24 113.55 117.40 1x8l h SER 147 Ca 0.23 -0.12 -0.13 0.00 -0.47 0.00 0.00 61.79 61.29 1x8l h SER 147 Cb 0.16 -0.28 -0.02 0.00 -0.31 0.00 0.00 62.40 61.96 1x8l h SER 147 CO -0.06 0.90 -0.59 0.77 -0.87 0.00 0.00 176.83 176.97 1x8l h SER 148 N 1.19 0.12 -0.39 4.97 4.64 -1.78 -2.12 113.55 120.18 1x8l h SER 148 Ca 0.29 -0.07 -0.03 0.00 -0.47 0.00 0.00 61.79 61.52 1x8l h SER 148 Cb 0.09 -0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 62.13 1x8l h SER 148 CO -0.04 0.68 0.13 -0.07 -0.87 0.00 0.00 176.83 176.66 1x8l h LEU 149 N 0.08 0.56 -0.37 5.97 3.38 -1.05 -2.30 115.31 121.57 1x8l h LEU 149 Ca -0.01 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 57.76 1x8l h LEU 149 Cb 1.07 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.65 1x8l h LEU 149 CO 0.08 0.60 0.21 -0.07 0.09 0.00 0.00 178.44 179.35 1x8l h LEU 150 N 0.48 0.45 -1.36 1.67 3.38 -0.98 -2.83 115.31 116.13 1x8l h LEU 150 Ca 0.13 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 1x8l h LEU 150 Cb 0.24 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.87 1x8l h LEU 150 CO -0.01 0.40 -0.15 0.00 0.09 0.00 0.00 178.44 178.77 1x8l h ALA 151 N 1.07 1.05 0.00 1.53 0.00 -1.31 -2.97 119.26 118.63 1x8l h ALA 151 Ca 0.13 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1x8l h ALA 151 Cb 0.04 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1x8l h ALA 151 CO -0.02 0.19 -0.13 0.00 0.00 0.00 0.00 179.25 179.28 1x8l h ALA 152 N 1.85 1.02 -2.41 0.00 0.00 -1.14 -3.44 119.26 115.14 1x8l h ALA 152 Ca -0.00 -0.12 -0.54 0.00 0.00 0.00 0.00 54.91 54.25 1x8l h ALA 152 Cb 0.61 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1x8l h ALA 152 CO 0.02 0.17 0.82 0.08 0.00 0.00 0.00 179.25 180.33 1x8l s VAL 153 N -3.67 3.62 0.59 0.00 1.01 -1.12 -4.98 120.40 115.84 1x8l s VAL 153 Ca 0.01 1.04 -0.20 0.00 0.00 0.00 0.00 61.98 62.83 1x8l s VAL 153 Cb 0.10 -3.67 -0.04 0.00 0.00 0.00 0.00 36.38 32.77 1x8l s VAL 153 CO 0.60 0.01 1.23 -2.65 0.00 0.00 0.00 175.10 174.30 1x8l n PRO 154 N 5.11 1.28 0.31 2.72 -0.02 -1.26 -4.89 135.00 138.24 1x8l n PRO 154 Ca 0.13 0.49 0.17 0.00 -2.02 0.00 0.00 63.50 62.27 1x8l n PRO 154 Cb 0.43 -2.45 0.98 0.00 -0.02 0.00 0.00 33.50 32.45 1x8l n PRO 154 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1x8l h PRO 155 N 0.88 0.00 -0.00 0.52 0.11 -1.94 -2.17 132.00 129.40 1x8l h PRO 155 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1x8l h PRO 155 Cb 1.33 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.44 1x8l h PRO 155 CO 0.54 0.02 0.00 0.25 -0.21 0.00 0.00 178.00 178.60 1x8l n THR 156 N -3.56 0.00 -4.60 -1.15 -2.24 -1.26 -4.64 114.28 96.83 1x8l n THR 156 Ca -0.03 -0.01 -0.33 0.00 -2.27 0.00 0.00 64.05 61.41 1x8l n THR 156 Cb 0.11 -0.37 -0.15 0.00 -2.10 0.00 0.00 70.33 67.81 1x8l n THR 156 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1x8l s GLU 157 N -2.00 3.27 0.16 -0.78 2.12 -0.82 -5.09 118.70 115.56 1x8l s GLU 157 Ca 0.39 -0.73 -0.32 0.00 0.36 0.00 0.00 54.97 54.67 1x8l s GLU 157 Cb 0.18 -2.63 -0.10 0.00 0.26 0.00 0.00 34.13 31.83 1x8l s GLU 157 CO 0.30 0.07 1.61 0.21 -0.54 0.00 0.00 175.26 176.91 1x8l s LYS 158 N 0.69 4.19 -0.22 4.30 2.20 -1.26 -4.79 119.74 124.85 1x8l s LYS 158 Ca -0.07 2.41 -0.18 0.00 -0.36 0.00 0.00 55.97 57.78 1x8l s LYS 158 Cb -0.16 -3.19 -0.03 0.00 -1.51 0.00 0.00 37.83 32.94 1x8l s LYS 158 CO 0.02 -0.65 0.49 1.03 -0.36 0.00 0.00 175.35 175.88 1x8l s ARG 159 N 1.34 4.14 -0.29 4.03 0.52 -1.26 -5.04 118.95 122.37 1x8l s ARG 159 Ca 0.72 0.33 -0.09 0.00 -0.52 0.00 0.00 55.73 56.17 1x8l s ARG 159 Cb -0.45 -3.59 -0.01 0.00 0.52 0.00 0.00 34.95 31.42 1x8l s ARG 159 CO 0.32 -0.21 0.13 -0.06 0.02 0.00 0.00 175.30 175.50 1x8l s PHE 160 N 1.84 3.16 -0.08 -0.53 0.40 -1.26 -1.75 117.98 119.76 1x8l s PHE 160 Ca 0.22 -0.54 0.02 0.00 -0.60 0.00 0.00 56.93 56.03 1x8l s PHE 160 Cb -0.15 -2.32 -0.02 0.00 0.51 0.00 0.00 43.02 41.03 1x8l s PHE 160 CO 0.09 -0.43 -0.14 0.08 0.70 0.00 0.00 175.22 175.52 1x8l s VAL 161 N 1.61 3.02 -0.11 -0.44 1.01 0.44 -1.36 120.40 124.58 1x8l s VAL 161 Ca 0.05 -0.71 0.00 0.00 0.00 0.00 0.00 61.98 61.32 1x8l s VAL 161 Cb -0.17 -2.21 -0.02 0.00 0.00 0.00 0.00 36.38 33.98 1x8l s VAL 161 CO 0.06 0.56 -0.13 -0.75 0.00 0.00 0.00 175.10 174.84 1x8l s LYS 162 N -0.28 3.20 -0.11 2.72 2.20 0.73 -0.83 119.74 127.36 1x8l s LYS 162 Ca 0.02 -0.67 -0.15 0.00 -0.36 0.00 0.00 55.97 54.81 1x8l s LYS 162 Cb -0.13 -2.59 0.04 0.00 -1.51 0.00 0.00 37.83 33.63 1x8l s LYS 162 CO 0.03 0.32 0.38 -0.08 -0.36 0.00 0.00 175.35 175.63 1x8l s THR 163 N 0.09 0.02 -1.62 3.43 -1.32 -0.95 -0.33 115.64 114.96 1x8l s THR 163 Ca -0.05 -0.13 0.20 0.00 -1.21 0.00 0.00 61.69 60.49 1x8l s THR 163 Cb -0.15 -0.59 0.65 0.00 -1.51 0.00 0.00 72.50 70.91 1x8l s THR 163 CO 0.04 -0.07 1.55 1.41 -2.21 0.00 0.00 174.62 175.34 1x8l n HIS 164 N 2.33 1.17 -2.49 9.09 8.25 -1.26 -2.91 115.22 129.40 1x8l n HIS 164 Ca -0.16 -0.52 -0.40 0.00 -0.26 0.00 0.00 57.72 56.38 1x8l n HIS 164 Cb 0.57 -0.11 -0.04 0.00 1.12 0.00 0.00 29.99 31.53 1x8l n HIS 164 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1x8l s LEU 165 N -1.36 4.56 0.74 2.41 1.43 -1.26 -4.68 118.68 120.51 1x8l s LEU 165 Ca 0.48 2.24 -0.13 0.00 -1.03 0.00 0.00 54.13 55.70 1x8l s LEU 165 Cb 0.28 -3.63 0.04 0.00 0.03 0.00 0.00 46.19 42.91 1x8l s LEU 165 CO 0.28 -0.13 1.12 -2.16 0.23 0.00 0.00 176.35 175.69 1x8l s PRO 166 N -1.39 2.32 0.44 1.29 0.04 -1.26 -4.83 135.00 131.62 1x8l s PRO 166 Ca 0.44 1.37 0.10 0.00 0.04 0.00 0.00 61.00 62.96 1x8l s PRO 166 Cb -0.31 -1.89 0.99 0.00 0.04 0.00 0.00 34.50 33.33 1x8l s PRO 166 CO 0.40 -1.62 2.08 -0.07 0.04 0.00 0.00 177.00 177.83 1x8l h LEU 167 N -0.65 0.32 -0.42 -3.56 3.38 -1.93 -1.86 115.31 110.58 1x8l h LEU 167 Ca -0.45 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.51 1x8l h LEU 167 Cb 1.25 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.92 1x8l h LEU 167 CO 0.51 0.23 0.00 -1.54 0.09 0.00 0.00 178.44 177.73 1x8l n SER 168 N -4.49 0.37 -0.42 -0.43 3.41 -1.26 -2.01 113.62 108.79 1x8l n SER 168 Ca 0.02 0.60 0.11 0.00 -0.26 0.00 0.00 58.87 59.34 1x8l n SER 168 Cb 0.09 -0.67 0.03 0.00 -0.26 0.00 0.00 64.21 63.40 1x8l n SER 168 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1x8l n LEU 169 N -1.92 1.83 -4.94 1.04 4.77 -0.70 -4.95 117.00 112.13 1x8l n LEU 169 Ca 0.02 -0.68 -0.22 0.00 -0.03 0.00 0.00 56.01 55.11 1x8l n LEU 169 Cb 0.19 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 1x8l n LEU 169 CO 0.16 0.35 0.12 -0.04 -1.33 0.00 0.00 177.39 176.65 1x8l s MET 170 N -2.53 2.40 0.03 3.23 -1.94 -0.85 -3.63 119.30 116.00 1x8l s MET 170 Ca 0.18 -1.71 -0.35 0.00 -1.71 0.00 0.00 55.69 52.10 1x8l s MET 170 Cb 0.18 -2.38 -0.14 0.00 2.01 0.00 0.00 34.83 34.50 1x8l s MET 170 CO 0.60 -0.52 1.65 -2.30 -0.01 0.00 0.00 175.02 174.44 1x8l n PRO 171 N -1.83 1.92 -2.02 2.03 -0.02 -1.20 -4.85 135.00 129.02 1x8l n PRO 171 Ca 0.05 0.70 -0.37 0.00 -2.02 0.00 0.00 63.50 61.86 1x8l n PRO 171 Cb 0.62 -2.46 0.02 0.00 -0.02 0.00 0.00 33.50 31.66 1x8l n PRO 171 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1x8l s PRO 172 N 2.07 3.32 -1.61 0.52 0.04 -1.26 -2.00 135.00 136.07 1x8l s PRO 172 Ca 0.86 1.95 0.00 0.00 0.04 0.00 0.00 61.00 63.85 1x8l s PRO 172 Cb -0.76 -2.22 0.00 0.00 0.04 0.00 0.00 34.50 31.56 1x8l s PRO 172 CO 0.46 -0.96 0.00 0.09 0.04 0.00 0.00 177.00 176.63 1x8l n ASN 173 N -0.99 -4.88 0.05 6.66 3.02 -1.26 -4.88 115.26 112.98 1x8l n ASN 173 Ca 0.10 0.29 0.04 0.00 -0.03 0.00 0.00 54.58 54.98 1x8l n ASN 173 Cb 0.47 -3.84 0.44 0.00 -0.61 0.00 0.00 39.78 36.25 1x8l n ASN 173 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1x8l h MET 174 N 0.00 0.44 0.00 3.52 -0.00 -1.77 -2.45 114.93 114.66 1x8l h MET 174 Ca -0.34 -0.04 0.00 0.00 -0.00 0.00 0.00 59.70 59.32 1x8l h MET 174 Cb 1.10 -0.09 0.00 0.00 -0.00 0.00 0.00 31.60 32.61 1x8l h MET 174 CO 0.47 0.32 0.00 1.28 -0.00 0.00 0.00 176.91 178.99 1x8l n LEU 175 N -4.45 0.10 0.11 -0.10 4.77 -1.26 -0.74 117.00 115.43 1x8l n LEU 175 Ca 0.02 0.53 0.02 0.00 -0.03 0.00 0.00 56.01 56.55 1x8l n LEU 175 Cb 0.10 -0.52 0.38 0.00 -2.33 0.00 0.00 43.42 41.05 1x8l n LEU 175 CO 0.36 -0.35 0.89 0.44 -1.33 0.00 0.00 177.39 177.40 1x8l h ASP 176 N 0.00 0.25 0.00 -1.43 3.32 -1.83 -3.37 116.42 113.35 1x8l h ASP 176 Ca 0.00 -0.05 -0.39 0.00 0.02 0.00 0.00 57.03 56.61 1x8l h ASP 176 Cb 0.22 -0.07 -0.06 0.00 0.22 0.00 0.00 39.33 39.64 1x8l h ASP 176 CO 0.00 0.40 -2.32 0.41 -1.72 0.00 0.00 179.24 176.01 1x8l n THR 177 N -4.27 1.30 -4.20 0.35 -1.04 0.08 -5.06 114.28 101.44 1x8l n THR 177 Ca -0.01 -0.36 -0.23 0.00 -2.04 0.00 0.00 64.05 61.42 1x8l n THR 177 Cb 0.27 -1.72 -0.06 0.00 -1.82 0.00 0.00 70.33 67.00 1x8l n THR 177 CO 0.00 0.00 0.00 0.68 -0.64 0.00 0.00 175.07 175.11 1x8l s VAL 178 N -2.44 3.95 0.05 12.58 -7.23 -0.38 -4.27 120.40 122.67 1x8l s VAL 178 Ca -0.33 -1.63 -0.08 0.00 -1.81 0.00 0.00 61.98 58.13 1x8l s VAL 178 Cb 0.12 -3.12 -0.05 0.00 0.56 0.00 0.00 36.38 33.89 1x8l s VAL 178 CO 0.44 -0.34 0.34 -0.54 -0.31 0.00 0.00 175.10 174.68 1x8l s LYS 179 N -3.70 3.67 -0.02 4.82 1.02 -1.12 -4.40 119.74 120.02 1x8l s LYS 179 Ca 0.32 0.05 0.01 0.00 0.02 0.00 0.00 55.97 56.37 1x8l s LYS 179 Cb -0.07 -3.03 0.02 0.00 -0.52 0.00 0.00 37.83 34.22 1x8l s LYS 179 CO 0.22 0.60 -0.02 1.41 -0.92 0.00 0.00 175.35 176.65 1x8l s MET 180 N -1.86 0.35 -0.21 1.68 -2.45 0.08 -0.75 119.30 116.15 1x8l s MET 180 Ca 0.31 -0.01 -0.07 0.00 -1.25 0.00 0.00 55.69 54.66 1x8l s MET 180 Cb -0.14 -0.45 -0.04 0.00 1.25 0.00 0.00 34.83 35.46 1x8l s MET 180 CO 0.17 -0.06 0.06 0.08 1.05 0.00 0.00 175.02 176.33 1x8l s VAL 181 N 0.63 4.56 -0.05 10.11 1.01 -0.23 -0.94 120.40 135.49 1x8l s VAL 181 Ca -0.07 -0.10 0.06 0.00 0.00 0.00 0.00 61.98 61.87 1x8l s VAL 181 Cb -0.10 -3.09 -0.02 0.00 0.00 0.00 0.00 36.38 33.18 1x8l s VAL 181 CO -0.01 0.40 -0.23 -0.47 0.00 0.00 0.00 175.10 174.79 1x8l s TYR 182 N 0.93 2.46 -0.11 5.22 5.04 -0.23 -1.19 117.35 129.47 1x8l s TYR 182 Ca 0.04 -0.56 0.01 0.00 -2.44 0.00 0.00 57.07 54.12 1x8l s TYR 182 Cb -0.14 -1.59 -0.02 0.00 0.35 0.00 0.00 41.96 40.57 1x8l s TYR 182 CO 0.03 -0.11 -0.13 -0.51 -1.34 0.00 0.00 175.55 173.49 1x8l s LEU 183 N -0.35 2.74 0.28 6.97 2.01 -0.65 -0.63 118.68 129.05 1x8l s LEU 183 Ca 0.02 -0.29 0.12 0.00 0.01 0.00 0.00 54.13 53.99 1x8l s LEU 183 Cb -0.12 -1.60 -0.05 0.00 0.01 0.00 0.00 46.19 44.42 1x8l s LEU 183 CO 0.02 0.20 -0.18 0.00 1.01 0.00 0.00 176.35 177.40 1x8l s ALA 184 N 0.12 2.78 -0.10 4.21 0.00 -0.40 -4.17 121.76 124.20 1x8l s ALA 184 Ca -0.06 -1.88 -0.21 0.00 0.00 0.00 0.00 51.96 49.81 1x8l s ALA 184 Cb -0.15 -0.27 0.05 0.00 0.00 0.00 0.00 23.12 22.75 1x8l s ALA 184 CO 0.05 0.27 0.51 0.50 0.00 0.00 0.00 175.76 177.08 1x8l s ARG 185 N -3.52 0.75 -0.41 0.00 3.52 -1.26 -0.55 118.95 117.48 1x8l s ARG 185 Ca 0.30 0.33 -0.43 0.00 -0.13 0.00 0.00 55.73 55.80 1x8l s ARG 185 Cb -0.05 0.35 -0.18 0.00 -1.56 0.00 0.00 34.95 33.52 1x8l s ARG 185 CO 0.15 -0.18 1.77 -3.47 -0.81 0.00 0.00 175.30 172.76 1x8l n ASP 186 N 1.83 1.64 0.32 -2.12 -0.08 -1.26 -4.76 116.55 112.12 1x8l n ASP 186 Ca -0.17 1.03 0.21 0.00 -1.51 0.00 0.00 54.79 54.34 1x8l n ASP 186 Cb 0.56 -1.00 1.06 0.00 2.34 0.00 0.00 41.12 44.08 1x8l n ASP 186 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1x8l h PRO 187 N 6.83 0.00 -0.39 -0.67 0.13 -1.99 -1.52 132.00 134.40 1x8l h PRO 187 Ca -0.39 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.62 1x8l h PRO 187 Cb 1.35 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.48 1x8l h PRO 187 CO 0.99 0.01 -0.23 0.00 -0.23 0.00 0.00 178.00 178.54 1x8l h ARG 188 N 0.00 0.84 -0.03 0.86 3.08 -1.99 0.31 114.38 117.45 1x8l h ARG 188 Ca -0.00 -0.38 -0.13 0.00 0.07 0.00 0.00 59.98 59.53 1x8l h ARG 188 Cb 0.14 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.16 1x8l h ARG 188 CO 0.00 1.02 -0.59 -0.44 -1.07 0.00 0.00 179.97 178.89 1x8l h ASP 189 N 0.65 0.12 -0.54 7.04 3.32 -1.70 -2.37 116.42 122.95 1x8l h ASP 189 Ca 0.08 -0.07 -0.03 0.00 0.02 0.00 0.00 57.03 57.03 1x8l h ASP 189 Cb 0.79 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 40.28 1x8l h ASP 189 CO 0.06 0.69 0.20 0.58 -1.72 0.00 0.00 179.24 179.05 1x8l h VAL 190 N 0.08 1.22 -0.44 -1.35 2.07 -1.23 -1.84 116.25 114.77 1x8l h VAL 190 Ca -0.01 -0.71 -0.03 0.00 0.82 0.00 0.00 66.70 66.78 1x8l h VAL 190 Cb 1.06 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 31.49 1x8l h VAL 190 CO 0.08 0.27 0.17 0.00 0.02 0.00 0.00 177.57 178.11 1x8l h ALA 191 N 1.05 0.57 -0.46 1.67 0.00 -0.67 0.65 119.26 122.07 1x8l h ALA 191 Ca 0.18 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1x8l h ALA 191 Cb 0.22 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1x8l h ALA 191 CO -0.01 0.18 0.22 0.28 0.00 0.00 0.00 179.25 179.92 1x8l h VAL 192 N 0.56 1.18 -0.20 0.00 2.07 -1.37 -0.91 116.25 117.59 1x8l h VAL 192 Ca 0.15 -0.51 -0.13 0.00 0.82 0.00 0.00 66.70 67.03 1x8l h VAL 192 Cb 0.20 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 1x8l h VAL 192 CO -0.01 0.20 -0.43 -1.28 0.02 0.00 0.00 177.57 176.07 1x8l h SER 193 N 0.60 0.51 -0.12 0.57 0.87 -0.86 -2.48 113.55 112.63 1x8l h SER 193 Ca 0.16 -0.23 -0.14 0.00 -1.23 0.00 0.00 61.79 60.35 1x8l h SER 193 Cb 0.11 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 61.92 1x8l h SER 193 CO -0.02 0.87 -0.39 0.28 -0.53 0.00 0.00 176.83 177.05 1x8l h SER 194 N 0.39 0.68 -0.12 6.23 0.02 -0.57 -1.51 113.55 118.67 1x8l h SER 194 Ca 0.03 -0.30 0.04 0.00 -0.84 0.00 0.00 61.79 60.72 1x8l h SER 194 Cb 0.92 -0.19 -0.05 0.00 0.14 0.00 0.00 62.40 63.22 1x8l h SER 194 CO 0.08 0.99 -0.17 0.15 -1.14 0.00 0.00 176.83 176.74 1x8l h PHE 195 N 0.53 -0.44 -0.04 3.45 3.57 -0.94 0.06 116.94 123.13 1x8l h PHE 195 Ca 0.05 0.02 -0.12 0.00 3.53 0.00 0.00 57.97 61.45 1x8l h PHE 195 Cb 0.90 0.21 -0.01 0.00 2.79 0.00 0.00 35.95 39.84 1x8l h PHE 195 CO 0.04 -0.25 -0.53 0.45 -2.23 0.00 0.00 178.31 175.80 1x8l h HIS 196 N -0.22 0.15 -0.07 0.41 3.86 -1.26 -2.15 115.15 115.88 1x8l h HIS 196 Ca 0.09 -0.05 -0.18 0.00 -1.16 0.00 0.00 60.37 59.07 1x8l h HIS 196 Cb 0.36 -0.03 -0.01 0.00 1.06 0.00 0.00 27.41 28.79 1x8l h HIS 196 CO -0.28 0.63 -0.73 1.25 0.86 0.00 0.00 177.93 179.66 1x8l h HIS 197 N 0.10 0.53 -0.59 2.45 -0.00 -1.09 -0.22 115.15 116.33 1x8l h HIS 197 Ca -0.00 -0.24 -0.04 0.00 -0.00 0.00 0.00 60.37 60.09 1x8l h HIS 197 Cb 0.97 -0.08 -0.03 0.00 -0.00 0.00 0.00 27.41 28.27 1x8l h HIS 197 CO 0.01 0.99 0.19 0.00 -0.00 0.00 0.00 177.93 179.13 1x8l h ALA 198 N 0.94 0.77 -0.73 5.26 0.00 -0.77 -2.63 119.26 122.10 1x8l h ALA 198 Ca -0.03 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 1x8l h ALA 198 Cb 1.31 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.84 1x8l h ALA 198 CO 0.13 0.43 0.38 0.00 0.00 0.00 0.00 179.25 180.18 1x8l h ARG 199 N 0.83 1.04 -0.88 0.00 2.47 -1.18 0.15 114.38 116.81 1x8l h ARG 199 Ca 0.19 -0.14 0.16 0.00 -1.26 0.00 0.00 59.98 58.93 1x8l h ARG 199 Cb 0.27 -0.20 -0.10 0.00 -1.65 0.00 0.00 29.97 28.30 1x8l h ARG 199 CO -0.01 0.79 0.46 1.25 0.56 0.00 0.00 179.97 183.03 1x8l h LEU 200 N 1.02 0.56 -2.89 3.04 5.85 -0.77 -2.39 115.31 119.72 1x8l h LEU 200 Ca 0.25 0.10 0.00 0.00 0.84 0.00 0.00 57.88 59.07 1x8l h LEU 200 Cb 0.08 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.12 1x8l h LEU 200 CO -0.04 0.21 0.00 0.18 -0.34 0.00 0.00 178.44 178.46 1x8l n LEU 201 N -4.87 4.03 -1.91 2.25 4.77 -1.01 -1.21 117.00 119.05 1x8l n LEU 201 Ca 0.18 -2.15 -0.17 0.00 -0.03 0.00 0.00 56.01 53.85 1x8l n LEU 201 Cb 0.47 -0.48 -0.01 0.00 -2.33 0.00 0.00 43.42 41.08 1x8l n LEU 201 CO 0.20 0.90 -0.20 -1.22 -1.33 0.00 0.00 177.39 175.74 1x8l n TYR 202 N 1.29 -0.82 0.12 -1.77 4.02 -0.87 -4.92 117.16 114.20 1x8l n TYR 202 Ca 0.23 0.02 -0.02 0.00 -0.01 0.00 0.00 57.90 58.12 1x8l n TYR 202 Cb 0.67 -3.38 0.19 0.00 -0.02 0.00 0.00 39.34 36.80 1x8l n TYR 202 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 176.86 175.78 1x8l h LEU 203 N -0.04 0.12-10.00 7.72 3.38 -1.24 -3.47 115.31 111.77 1x8l h LEU 203 Ca -0.40 -0.06 -0.57 0.00 0.09 0.00 0.00 57.88 56.94 1x8l h LEU 203 Cb 1.29 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.98 1x8l h LEU 203 CO 0.46 0.65 -0.47 -0.76 0.09 0.00 0.00 178.44 178.41 1x8l s LEU 204 N -7.88 4.34 0.36 1.67 1.43 -1.25 -4.44 118.68 112.91 1x8l s LEU 204 Ca -0.03 0.21 -0.27 0.00 -1.03 0.00 0.00 54.13 53.01 1x8l s LEU 204 Cb 0.13 -2.94 -0.09 0.00 0.03 0.00 0.00 46.19 43.32 1x8l s LEU 204 CO 0.77 0.09 1.26 0.20 0.23 0.00 0.00 176.35 178.90 1x8l s ASN 205 N -2.97 6.64 0.43 2.29 0.01 -0.69 -4.92 114.94 115.72 1x8l s ASN 205 Ca 0.35 2.57 0.18 0.00 -0.71 0.00 0.00 52.86 55.25 1x8l s ASN 205 Cb -0.12 -2.64 0.99 0.00 0.41 0.00 0.00 41.25 39.90 1x8l s ASN 205 CO 0.28 -0.62 1.93 0.50 -1.51 0.00 0.00 177.10 177.69 1x8l h LYS 206 N 3.07 0.00 0.00 -0.60 1.63 -1.97 -2.94 116.57 115.76 1x8l h LYS 206 Ca -0.49 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.31 1x8l h LYS 206 Cb 1.23 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.86 1x8l h LYS 206 CO 0.64 0.25 0.00 1.96 -3.45 0.00 0.00 179.45 178.85 1x8l h GLN 207 N 0.00 0.00 -7.31 1.90 1.08 -1.95 -3.45 115.11 105.38 1x8l h GLN 207 Ca -0.00 0.00 -0.51 0.00 -1.45 0.00 0.00 58.65 56.69 1x8l h GLN 207 Cb 0.50 0.00 0.11 0.00 -0.05 0.00 0.00 27.48 28.04 1x8l h GLN 207 CO 0.03 0.00 0.35 -1.12 -0.95 0.00 0.00 178.83 177.14 1x8l s SER 208 N -5.64 5.00 0.45 1.46 0.01 -1.11 -5.09 113.70 108.77 1x8l s SER 208 Ca 0.06 1.74 0.03 0.00 1.31 0.00 0.00 55.95 59.10 1x8l s SER 208 Cb 0.08 -2.51 -0.01 0.00 0.21 0.00 0.00 66.02 63.78 1x8l s SER 208 CO 0.61 -1.70 0.12 0.54 0.41 0.00 0.00 173.24 173.21 1x8l s ASN 209 N -3.49 3.18 0.25 2.44 2.20 -1.26 -4.98 114.94 113.27 1x8l s ASN 209 Ca 0.60 -1.73 -0.05 0.00 -0.94 0.00 0.00 52.86 50.75 1x8l s ASN 209 Cb -0.16 0.62 0.28 0.00 -2.00 0.00 0.00 41.25 39.99 1x8l s ASN 209 CO 0.54 -0.98 1.82 0.15 -2.94 0.00 0.00 177.10 175.69 1x8l h PHE 210 N 1.63 1.07 -0.65 1.54 3.57 -1.98 -2.31 116.94 119.81 1x8l h PHE 210 Ca -0.36 -0.07 0.04 0.00 3.53 0.00 0.00 57.97 61.11 1x8l h PHE 210 Cb 1.29 -0.33 -0.05 0.00 2.79 0.00 0.00 35.95 39.66 1x8l h PHE 210 CO 1.70 0.82 0.38 -0.22 -2.23 0.00 0.00 178.31 178.76 1x8l h LYS 211 N 1.04 0.72 -0.89 1.11 3.64 -1.97 0.41 116.57 120.62 1x8l h LYS 211 Ca 0.24 -0.04 0.09 0.00 -1.27 0.00 0.00 60.65 59.67 1x8l h LYS 211 Cb 0.20 -0.16 -0.07 0.00 -0.41 0.00 0.00 32.23 31.78 1x8l h LYS 211 CO -0.02 0.47 0.54 -0.44 -2.27 0.00 0.00 179.45 177.74 1x8l h ASP 212 N 0.74 0.82 -0.04 4.20 3.32 -1.90 -0.42 116.42 123.13 1x8l h ASP 212 Ca 0.27 0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.35 1x8l h ASP 212 Cb 0.09 -0.13 -0.00 0.00 0.22 0.00 0.00 39.33 39.50 1x8l h ASP 212 CO -0.14 0.48 0.01 0.15 -1.72 0.00 0.00 179.24 178.03 1x8l h PHE 213 N 0.93 0.07 -0.63 4.55 3.57 -0.63 -2.67 116.94 122.13 1x8l h PHE 213 Ca 0.42 -0.01 0.11 0.00 3.53 0.00 0.00 57.97 62.02 1x8l h PHE 213 Cb 0.31 -0.02 -0.08 0.00 2.79 0.00 0.00 35.95 38.94 1x8l h PHE 213 CO -0.03 0.28 0.19 2.35 -2.23 0.00 0.00 178.31 178.87 1x8l h TRP 214 N -0.16 0.32 0.06 0.41 2.91 0.09 0.22 115.95 119.80 1x8l h TRP 214 Ca 0.01 0.03 0.02 0.00 1.13 0.00 0.00 58.89 60.09 1x8l h TRP 214 Cb 0.25 -0.04 -0.03 0.00 -0.51 0.00 0.00 29.16 28.82 1x8l h TRP 214 CO 0.01 0.02 -0.22 0.93 -1.03 0.00 0.00 178.44 178.15 1x8l h GLU 215 N 0.34 -0.37 -0.04 2.65 4.39 -0.99 -1.11 114.58 119.44 1x8l h GLU 215 Ca 0.33 0.03 0.03 0.00 0.34 0.00 0.00 59.36 60.08 1x8l h GLU 215 Cb 0.48 0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 29.18 1x8l h GLU 215 CO -0.38 -0.25 -0.12 1.98 -1.16 0.00 0.00 179.01 179.09 1x8l h MET 216 N -0.39 -0.17 0.06 2.33 4.05 -1.09 -3.12 114.93 116.60 1x8l h MET 216 Ca 0.04 0.01 -0.00 0.00 -0.28 0.00 0.00 59.70 59.47 1x8l h MET 216 Cb 0.44 0.04 0.00 0.00 -0.80 0.00 0.00 31.60 31.27 1x8l h MET 216 CO -0.16 -0.11 -0.03 0.35 0.23 0.00 0.00 176.91 177.18 1x8l h PHE 217 N -0.18 -0.08 0.00 1.39 3.57 0.06 -1.98 116.94 119.72 1x8l h PHE 217 Ca 0.06 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.56 1x8l h PHE 217 Cb 0.26 0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.03 1x8l h PHE 217 CO -0.20 -0.05 0.00 -2.39 -2.23 0.00 0.00 178.31 173.44 1x8l n HIS 218 N -5.13 0.37 1.20 0.41 1.44 -0.48 -2.28 115.22 110.75 1x8l n HIS 218 Ca -0.08 0.11 0.13 0.00 -2.01 0.00 0.00 57.72 55.87 1x8l n HIS 218 Cb 0.06 -0.68 0.34 0.00 0.12 0.00 0.00 29.99 29.83 1x8l n HIS 218 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 1x8l n ARG 219 N -1.81 1.97 -1.83 -1.40 1.74 -1.12 -4.96 116.66 109.25 1x8l n ARG 219 Ca 0.06 -1.42 0.00 0.00 -0.77 0.00 0.00 57.85 55.72 1x8l n ARG 219 Cb 0.36 -1.47 0.00 0.00 -1.02 0.00 0.00 32.46 30.34 1x8l n ARG 219 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1x8l n GLY 220 N 1.26 0.69 0.03 -0.13 0.00 -0.97 -4.99 105.19 101.09 1x8l n GLY 220 Ca 0.17 -0.72 0.04 0.00 0.00 0.00 0.00 46.02 45.50 1x8l n GLY 220 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1x8l n LEU 221 N -0.11 2.05 -4.74 0.99 4.77 -0.76 -4.43 117.00 114.77 1x8l n LEU 221 Ca 0.00 -2.34 -0.23 0.00 -0.03 0.00 0.00 56.01 53.42 1x8l n LEU 221 Cb 0.43 -0.16 -0.06 0.00 -2.33 0.00 0.00 43.42 41.30 1x8l n LEU 221 CO 0.00 0.56 -0.21 -0.47 -1.33 0.00 0.00 177.39 175.94 1x8l s TYR 222 N -1.65 2.77 -0.49 -1.77 5.04 -1.25 -4.88 117.35 115.11 1x8l s TYR 222 Ca 0.12 -0.31 -0.45 0.00 -2.44 0.00 0.00 57.07 53.99 1x8l s TYR 222 Cb 0.10 -1.54 -0.19 0.00 0.35 0.00 0.00 41.96 40.68 1x8l s TYR 222 CO 0.01 0.40 1.83 2.41 -1.34 0.00 0.00 175.55 178.86 1x8l n THR 223 N -1.13 0.00 -1.13 4.34 -1.04 -1.26 -1.73 114.28 112.33 1x8l n THR 223 Ca -0.04 0.00 -0.05 0.00 -2.04 0.00 0.00 64.05 61.92 1x8l n THR 223 Cb 0.60 -0.49 -0.02 0.00 -1.82 0.00 0.00 70.33 68.60 1x8l n THR 223 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1x8l n LEU 224 N 5.62 -0.01 -4.91 -4.42 7.99 0.92 -4.94 117.00 117.24 1x8l n LEU 224 Ca 0.42 0.11 -0.29 0.00 -0.01 0.00 0.00 56.01 56.25 1x8l n LEU 224 Cb -0.05 -1.64 0.10 0.00 -0.11 0.00 0.00 43.42 41.72 1x8l n LEU 224 CO 0.87 -0.55 0.77 0.42 -1.51 0.00 0.00 177.39 177.39 1x8l s THR 225 N -1.85 2.05 0.14 -5.08 -4.23 -0.71 -4.66 115.64 101.29 1x8l s THR 225 Ca 0.00 -0.05 -0.33 0.00 -1.18 0.00 0.00 61.69 60.13 1x8l s THR 225 Cb 0.00 -2.99 -0.12 0.00 1.34 0.00 0.00 72.50 70.72 1x8l s THR 225 CO 0.00 0.00 1.73 -2.65 -0.54 0.00 0.00 174.62 173.16 1x8l n PRO 226 N -3.31 2.53 -0.09 3.99 -0.02 -1.26 -1.25 135.00 135.60 1x8l n PRO 226 Ca 0.09 0.92 -0.06 0.00 -2.02 0.00 0.00 63.50 62.42 1x8l n PRO 226 Cb 0.61 -2.76 0.00 0.00 -0.02 0.00 0.00 33.50 31.33 1x8l n PRO 226 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 1x8l h TYR 227 N 7.35 -0.40 -0.08 6.00 3.20 -1.86 -2.78 116.97 128.39 1x8l h TYR 227 Ca -0.45 0.04 -0.15 0.00 3.14 0.00 0.00 58.73 61.30 1x8l h TYR 227 Cb 1.23 0.23 -0.01 0.00 1.54 0.00 0.00 36.73 39.72 1x8l h TYR 227 CO 0.71 -0.24 -0.62 0.74 -1.64 0.00 0.00 178.16 177.11 1x8l h PHE 228 N -0.11 0.39 -0.36 -3.82 -1.00 -1.99 -2.34 116.94 107.72 1x8l h PHE 228 Ca 0.17 -0.15 0.03 0.00 2.81 0.00 0.00 57.97 60.82 1x8l h PHE 228 Cb 0.37 -0.07 -0.03 0.00 3.61 0.00 0.00 35.95 39.83 1x8l h PHE 228 CO -0.37 0.84 0.16 0.93 -1.61 0.00 0.00 178.31 178.26 1x8l h GLU 229 N 0.22 0.32 -0.32 1.51 4.39 -1.96 0.26 114.58 119.00 1x8l h GLU 229 Ca -0.01 -0.02 0.06 0.00 0.34 0.00 0.00 59.36 59.73 1x8l h GLU 229 Cb 1.14 -0.07 -0.06 0.00 -0.10 0.00 0.00 28.75 29.66 1x8l h GLU 229 CO 0.10 0.21 -0.05 1.25 -1.16 0.00 0.00 179.01 179.37 1x8l h HIS 230 N 0.33 -0.10 -0.34 4.33 2.76 -1.25 -1.69 115.15 119.19 1x8l h HIS 230 Ca 0.15 0.03 -0.08 0.00 -2.20 0.00 0.00 60.37 58.27 1x8l h HIS 230 Cb 0.09 0.10 -0.01 0.00 1.55 0.00 0.00 27.41 29.13 1x8l h HIS 230 CO -0.11 -0.10 -0.09 0.28 -1.30 0.00 0.00 177.93 176.60 1x8l h VAL 231 N 0.04 1.28 0.00 5.26 2.07 -1.07 -3.15 116.25 120.68 1x8l h VAL 231 Ca 0.16 -1.16 -0.02 0.00 0.82 0.00 0.00 66.70 66.49 1x8l h VAL 231 Cb 0.23 1.33 -0.00 0.00 -1.52 0.00 0.00 31.29 31.32 1x8l h VAL 231 CO -0.30 0.38 -0.11 0.11 0.02 0.00 0.00 177.57 177.66 1x8l h LYS 232 N 0.45 0.00 -0.30 1.57 1.57 -0.21 -1.24 116.57 118.41 1x8l h LYS 232 Ca 0.08 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.80 1x8l h LYS 232 Cb 0.60 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.90 1x8l h LYS 232 CO 0.04 0.11 -0.06 0.93 -0.57 0.00 0.00 179.45 179.89 1x8l h GLU 233 N 0.00 0.57 -0.26 3.15 5.08 -1.27 -2.12 114.58 119.72 1x8l h GLU 233 Ca -0.00 -0.21 -0.10 0.00 -1.00 0.00 0.00 59.36 58.05 1x8l h GLU 233 Cb 0.23 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.45 1x8l h GLU 233 CO 0.01 0.76 -0.22 0.00 -1.00 0.00 0.00 179.01 178.56 1x8l h ALA 234 N 0.79 0.38 -0.89 3.43 0.00 -1.51 -3.15 119.26 118.31 1x8l h ALA 234 Ca 0.08 -0.37 0.16 0.00 0.00 0.00 0.00 54.91 54.78 1x8l h ALA 234 Cb 0.54 -0.08 -0.10 0.00 0.00 0.00 0.00 17.79 18.15 1x8l h ALA 234 CO 0.03 0.34 0.47 2.35 0.00 0.00 0.00 179.25 182.44 1x8l h TRP 235 N 0.34 0.82 0.00 0.00 2.91 -1.24 -0.77 115.95 118.02 1x8l h TRP 235 Ca 0.05 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.10 1x8l h TRP 235 Cb 0.78 -0.23 0.00 0.00 -0.51 0.00 0.00 29.16 29.19 1x8l h TRP 235 CO 0.07 0.18 0.00 0.00 -1.03 0.00 0.00 178.44 177.66 1x8l h ALA 236 N 1.59 1.00 -0.28 2.65 0.00 -1.34 -2.82 119.26 120.06 1x8l h ALA 236 Ca 0.50 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.40 1x8l h ALA 236 Cb 0.74 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.52 1x8l h ALA 236 CO -0.38 0.00 0.00 1.63 0.00 0.00 0.00 179.25 180.50 1x8l n LYS 237 N -2.88 2.98 0.15 0.00 4.76 -0.31 -4.72 118.16 118.14 1x8l n LYS 237 Ca -0.00 -2.87 0.13 0.00 -2.87 0.00 0.00 58.31 52.70 1x8l n LYS 237 Cb 0.20 -1.87 0.41 0.00 -1.84 0.00 0.00 35.03 31.93 1x8l n LYS 237 CO 0.00 0.00 0.00 0.07 -1.37 0.00 0.00 177.40 176.10 1x8l h ARG 238 N 1.87 0.00 0.00 1.97 0.11 -1.30 -2.70 114.38 114.34 1x8l h ARG 238 Ca 0.01 0.00 -0.12 0.00 0.10 0.00 0.00 59.98 59.96 1x8l h ARG 238 Cb 1.48 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 32.54 1x8l h ARG 238 CO 0.24 0.00 -0.68 0.45 0.10 0.00 0.00 179.97 180.08 1x8l h HIS 239 N 0.00 0.00 -2.95 4.08 3.86 -1.84 -3.44 115.15 114.86 1x8l h HIS 239 Ca 0.00 0.00 -0.55 0.00 -1.16 0.00 0.00 60.37 58.66 1x8l h HIS 239 Cb 0.67 0.00 0.08 0.00 1.06 0.00 0.00 27.41 29.22 1x8l h HIS 239 CO 0.00 0.55 0.78 -3.47 0.86 0.00 0.00 177.93 176.65 1x8l n ASP 240 N -3.19 3.39 0.23 2.45 -0.08 -1.02 -4.87 116.55 113.47 1x8l n ASP 240 Ca 0.00 1.14 0.14 0.00 -1.51 0.00 0.00 54.79 54.56 1x8l n ASP 240 Cb 0.77 -1.52 0.77 0.00 2.34 0.00 0.00 41.12 43.48 1x8l n ASP 240 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1x8l h PRO 241 N 4.72 0.00 -0.46 -0.67 0.11 -1.90 -1.89 132.00 131.92 1x8l h PRO 241 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1x8l h PRO 241 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1x8l h PRO 241 CO 0.79 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 178.67 1x8l n ASN 242 N -2.53 3.27 -4.27 -2.05 3.02 -1.26 -4.89 115.26 106.54 1x8l n ASN 242 Ca -0.02 -1.97 -0.32 0.00 -0.03 0.00 0.00 54.58 52.24 1x8l n ASN 242 Cb 0.11 -0.31 -0.16 0.00 -0.61 0.00 0.00 39.78 38.81 1x8l n ASN 242 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 1x8l s MET 243 N -1.03 3.12 -0.30 3.52 1.75 -0.71 -0.74 119.30 124.90 1x8l s MET 243 Ca 0.33 -0.82 0.00 0.00 -1.25 0.00 0.00 55.69 53.95 1x8l s MET 243 Cb 0.17 -2.39 0.06 0.00 2.84 0.00 0.00 34.83 35.52 1x8l s MET 243 CO 0.23 0.21 -0.01 -1.17 -0.65 0.00 0.00 175.02 173.62 1x8l s LEU 244 N 0.30 3.97 -0.35 4.11 2.96 -0.12 -4.71 118.68 124.84 1x8l s LEU 244 Ca -0.15 -1.48 -0.20 0.00 -0.22 0.00 0.00 54.13 52.07 1x8l s LEU 244 Cb -0.17 -1.66 0.00 0.00 0.50 0.00 0.00 46.19 44.86 1x8l s LEU 244 CO 0.08 -0.28 0.63 0.12 -1.32 0.00 0.00 176.35 175.58 1x8l s PHE 245 N 1.15 3.16 0.29 5.38 5.36 -1.26 -1.07 117.98 130.99 1x8l s PHE 245 Ca -0.03 0.38 0.11 0.00 -0.96 0.00 0.00 56.93 56.42 1x8l s PHE 245 Cb -0.20 -3.10 -0.05 0.00 -0.34 0.00 0.00 43.02 39.33 1x8l s PHE 245 CO -0.03 -0.60 -0.10 -0.51 -1.46 0.00 0.00 175.22 172.52 1x8l s LEU 246 N 2.68 2.85 -0.10 6.12 1.43 0.20 -4.98 118.68 126.88 1x8l s LEU 246 Ca 0.24 -0.91 -0.00 0.00 -1.03 0.00 0.00 54.13 52.43 1x8l s LEU 246 Cb -0.15 -1.33 -0.02 0.00 0.03 0.00 0.00 46.19 44.72 1x8l s LEU 246 CO 0.14 -0.03 -0.09 -0.36 0.23 0.00 0.00 176.35 176.25 1x8l s PHE 247 N -2.46 2.89 0.33 0.29 0.40 -1.26 -1.27 117.98 116.90 1x8l s PHE 247 Ca 0.31 -0.26 0.12 0.00 -0.60 0.00 0.00 56.93 56.51 1x8l s PHE 247 Cb -0.04 -1.79 0.99 0.00 0.51 0.00 0.00 43.02 42.69 1x8l s PHE 247 CO 0.17 0.08 1.69 -0.92 0.70 0.00 0.00 175.22 176.95 1x8l h TYR 248 N 6.00 0.97 0.00 0.36 3.20 -0.99 -1.73 116.97 124.78 1x8l h TYR 248 Ca -0.38 0.04 -0.07 0.00 3.14 0.00 0.00 58.73 61.46 1x8l h TYR 248 Cb 1.18 -0.27 -0.01 0.00 1.54 0.00 0.00 36.73 39.18 1x8l h TYR 248 CO 0.53 -0.06 -0.31 0.93 -1.64 0.00 0.00 178.16 177.60 1x8l h GLU 249 N 0.44 0.00 0.00 1.82 3.07 -1.92 -1.82 114.58 116.17 1x8l h GLU 249 Ca 0.69 0.00 -0.08 0.00 -0.50 0.00 0.00 59.36 59.47 1x8l h GLU 249 Cb 1.47 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 29.36 1x8l h GLU 249 CO -0.55 0.31 -0.39 -0.44 -1.40 0.00 0.00 179.01 176.55 1x8l h ASP 250 N 0.00 0.00 -0.83 1.42 3.32 -1.70 -1.82 116.42 116.81 1x8l h ASP 250 Ca -0.00 0.00 0.02 0.00 0.02 0.00 0.00 57.03 57.07 1x8l h ASP 250 Cb 0.64 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.14 1x8l h ASP 250 CO 0.04 0.39 0.54 1.88 -1.72 0.00 0.00 179.24 180.37 1x8l h TYR 251 N 0.00 1.02 -0.34 4.55 0.99 -1.35 -1.31 116.97 120.53 1x8l h TYR 251 Ca -0.00 0.03 -0.15 0.00 2.00 0.00 0.00 58.73 60.61 1x8l h TYR 251 Cb 0.85 -0.34 -0.01 0.00 1.00 0.00 0.00 36.73 38.23 1x8l h TYR 251 CO 0.00 0.62 -0.37 -0.07 -0.00 0.00 0.00 178.16 178.34 1x8l h LEU 252 N 1.08 0.85 0.14 3.88 3.38 -1.49 -2.93 115.31 120.21 1x8l h LEU 252 Ca 0.32 -0.37 -0.29 0.00 0.09 0.00 0.00 57.88 57.63 1x8l h LEU 252 Cb -0.06 -0.24 0.01 0.00 0.09 0.00 0.00 40.66 40.46 1x8l h LEU 252 CO -0.09 1.12 -1.28 0.11 0.09 0.00 0.00 178.44 178.39 1x8l h LYS 253 N 0.66 0.37 -0.98 1.13 1.57 -1.27 -3.43 116.57 114.62 1x8l h LYS 253 Ca 0.06 -0.60 -0.17 0.00 -1.87 0.00 0.00 60.65 58.07 1x8l h LYS 253 Cb 0.92 0.22 -0.17 0.00 0.08 0.00 0.00 32.23 33.29 1x8l h LYS 253 CO 0.08 1.28 -0.51 -3.47 -0.57 0.00 0.00 179.45 176.26 1x8l n ASP 254 N -3.61 -3.34 0.01 0.86 2.03 -0.50 -5.03 116.55 106.97 1x8l n ASP 254 Ca -0.11 -2.93 -0.12 0.00 0.52 0.00 0.00 54.79 52.16 1x8l n ASP 254 Cb 1.03 1.69 -0.07 0.00 -0.72 0.00 0.00 41.12 43.05 1x8l n ASP 254 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 1x8l h LEU 255 N 4.95 0.05 -0.94 -2.67 5.85 -1.64 -1.82 115.31 119.10 1x8l h LEU 255 Ca 0.05 -0.15 0.08 0.00 0.84 0.00 0.00 57.88 58.70 1x8l h LEU 255 Cb 1.10 -0.01 -0.07 0.00 0.37 0.00 0.00 40.66 42.05 1x8l h LEU 255 CO 0.04 0.19 0.59 -0.65 -0.34 0.00 0.00 178.44 178.28 1x8l h PRO 256 N -0.09 1.02 -0.28 5.25 0.11 -1.91 -0.16 132.00 135.94 1x8l h PRO 256 Ca 0.01 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 66.05 1x8l h PRO 256 Cb 0.15 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 31.02 1x8l h PRO 256 CO -0.00 0.67 0.11 0.78 -0.21 0.00 0.00 178.00 179.35 1x8l h GLY 257 N 1.05 0.44 0.97 -0.55 0.00 -1.91 -1.41 103.07 101.67 1x8l h GLY 257 Ca 0.42 -0.24 0.01 0.00 0.00 0.00 0.00 47.33 47.52 1x8l h GLY 257 CO -0.20 0.23 0.37 1.76 0.00 0.00 0.00 176.54 178.71 1x8l h SER 258 N 0.29 0.64 -0.57 0.19 0.02 -0.86 -2.09 113.55 111.17 1x8l h SER 258 Ca 0.09 -0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 61.00 1x8l h SER 258 Cb 0.18 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 62.54 1x8l h SER 258 CO -0.01 0.46 0.25 0.40 -1.14 0.00 0.00 176.83 176.79 1x8l h ILE 259 N 0.76 1.21 -0.17 3.27 2.04 -0.85 -2.00 117.51 121.76 1x8l h ILE 259 Ca 0.22 -0.65 -0.16 0.00 1.00 0.00 0.00 64.86 65.27 1x8l h ILE 259 Cb -0.06 0.48 -0.01 0.00 -0.74 0.00 0.00 36.82 36.49 1x8l h ILE 259 CO -0.06 0.26 -0.54 0.00 0.00 0.00 0.00 178.15 177.81 1x8l h ALA 260 N 1.41 0.73 -0.26 1.87 0.00 -0.98 -1.24 119.26 120.79 1x8l h ALA 260 Ca 0.21 -0.51 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 1x8l h ALA 260 Cb 0.15 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1x8l h ALA 260 CO -0.02 0.69 0.14 0.00 0.00 0.00 0.00 179.25 180.05 1x8l h ARG 261 N 0.40 0.37 -0.32 0.00 3.08 -1.08 -1.57 114.38 115.25 1x8l h ARG 261 Ca 0.01 -0.05 0.01 0.00 0.07 0.00 0.00 59.98 60.02 1x8l h ARG 261 Cb 1.08 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 31.04 1x8l h ARG 261 CO 0.10 0.35 0.20 0.82 -1.07 0.00 0.00 179.97 180.38 1x8l h ILE 262 N 0.30 1.07 -0.20 2.04 2.04 -1.07 -0.51 117.51 121.18 1x8l h ILE 262 Ca 0.09 -0.14 0.01 0.00 1.00 0.00 0.00 64.86 65.82 1x8l h ILE 262 Cb 0.09 0.61 -0.01 0.00 -0.74 0.00 0.00 36.82 36.77 1x8l h ILE 262 CO -0.01 0.08 0.11 0.00 0.00 0.00 0.00 178.15 178.32 1x8l h ALA 263 N 1.13 0.24 -0.19 1.87 0.00 -1.16 -1.29 119.26 119.86 1x8l h ALA 263 Ca 0.12 -0.00 0.04 0.00 0.00 0.00 0.00 54.91 55.07 1x8l h ALA 263 Cb -0.03 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 1x8l h ALA 263 CO -0.04 -0.30 -0.04 -0.44 0.00 0.00 0.00 179.25 178.44 1x8l h ASP 264 N 0.23 -0.15 -0.97 0.00 5.19 -1.21 -0.91 116.42 118.61 1x8l h ASP 264 Ca 0.08 0.05 0.16 0.00 -0.62 0.00 0.00 57.03 56.70 1x8l h ASP 264 Cb -0.00 0.11 -0.10 0.00 0.18 0.00 0.00 39.33 39.52 1x8l h ASP 264 CO -0.04 -0.05 0.58 0.15 -3.12 0.00 0.00 179.24 176.76 1x8l h PHE 265 N 0.02 1.03 -0.01 4.55 3.57 -0.76 -2.32 116.94 123.02 1x8l h PHE 265 Ca 0.09 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.63 1x8l h PHE 265 Cb 0.13 -0.31 0.00 0.00 2.79 0.00 0.00 35.95 38.56 1x8l h PHE 265 CO -0.20 0.29 -0.03 1.28 -2.23 0.00 0.00 178.31 177.42 1x8l n LEU 266 N -4.74 1.07 0.00 0.59 4.77 -0.52 -4.94 117.00 113.23 1x8l n LEU 266 Ca 0.21 -0.33 0.00 0.00 -0.03 0.00 0.00 56.01 55.85 1x8l n LEU 266 Cb 0.47 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 1x8l n LEU 266 CO 0.23 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 177.08 1x8l n GLY 267 N 1.17 0.69 3.42 -0.72 0.00 -0.77 -5.04 105.19 103.93 1x8l n GLY 267 Ca 0.19 -0.15 -0.35 0.00 0.00 0.00 0.00 46.02 45.71 1x8l n GLY 267 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x8l s LYS 268 N -0.59 3.57 0.03 1.61 -0.14 -0.42 -5.01 119.74 118.79 1x8l s LYS 268 Ca 0.00 -0.54 -0.26 0.00 -1.36 0.00 0.00 55.97 53.81 1x8l s LYS 268 Cb 0.00 -3.08 -0.05 0.00 -1.68 0.00 0.00 37.83 33.02 1x8l s LYS 268 CO 0.00 -0.05 0.80 -1.59 -0.76 0.00 0.00 175.35 173.75 1x8l s LYS 269 N 1.15 4.52 0.01 1.68 -2.85 -1.26 -3.90 119.74 119.09 1x8l s LYS 269 Ca 0.03 1.12 0.07 0.00 -1.00 0.00 0.00 55.97 56.18 1x8l s LYS 269 Cb -0.14 -3.39 -0.02 0.00 -2.06 0.00 0.00 37.83 32.22 1x8l s LYS 269 CO 0.01 0.21 -0.20 -0.51 0.10 0.00 0.00 175.35 174.96 1x8l s LEU 270 N 0.19 2.10 0.86 2.77 1.43 -1.26 -5.12 118.68 119.66 1x8l s LEU 270 Ca 0.41 -0.44 -0.12 0.00 -1.03 0.00 0.00 54.13 52.95 1x8l s LEU 270 Cb -0.20 -0.98 0.11 0.00 0.03 0.00 0.00 46.19 45.15 1x8l s LEU 270 CO 0.24 0.20 1.12 -0.94 0.23 0.00 0.00 176.35 177.19 1x8l s SER 271 N -0.82 3.93 0.27 2.29 1.04 -1.26 -4.89 113.70 114.26 1x8l s SER 271 Ca 0.07 1.09 -0.04 0.00 0.48 0.00 0.00 55.95 57.55 1x8l s SER 271 Cb -0.08 -1.72 0.34 0.00 0.10 0.00 0.00 66.02 64.66 1x8l s SER 271 CO 0.00 -2.30 1.92 -0.08 0.98 0.00 0.00 173.24 173.76 1x8l h GLU 272 N -1.32 1.16 -0.23 4.02 4.57 -2.01 -2.55 114.58 118.22 1x8l h GLU 272 Ca -0.49 -0.10 -0.04 0.00 -1.18 0.00 0.00 59.36 57.55 1x8l h GLU 272 Cb 1.31 -0.24 -0.01 0.00 -0.16 0.00 0.00 28.75 29.64 1x8l h GLU 272 CO 0.61 0.81 -0.03 0.93 -1.18 0.00 0.00 179.01 180.15 1x8l h GLU 273 N 1.18 0.34 0.19 1.92 3.07 -2.00 -1.92 114.58 117.37 1x8l h GLU 273 Ca 0.31 -0.06 -0.32 0.00 -0.50 0.00 0.00 59.36 58.79 1x8l h GLU 273 Cb -0.05 -0.05 0.03 0.00 -0.84 0.00 0.00 28.75 27.84 1x8l h GLU 273 CO -0.06 0.40 -1.37 1.96 -1.40 0.00 0.00 179.01 178.54 1x8l h GLN 274 N 0.33 0.55 -0.46 2.33 4.20 -1.85 -2.84 115.11 117.38 1x8l h GLN 274 Ca 0.07 -0.85 0.01 0.00 0.06 0.00 0.00 58.65 57.95 1x8l h GLN 274 Cb 0.28 0.30 -0.03 0.00 0.30 0.00 0.00 27.48 28.33 1x8l h GLN 274 CO 0.01 1.40 0.28 0.82 -0.67 0.00 0.00 178.83 180.67 1x8l h ILE 275 N 0.19 1.07 -0.45 2.54 2.04 -1.27 -1.66 117.51 119.97 1x8l h ILE 275 Ca -0.22 -0.20 0.01 0.00 1.00 0.00 0.00 64.86 65.45 1x8l h ILE 275 Cb 2.06 0.45 -0.02 0.00 -0.74 0.00 0.00 36.82 38.57 1x8l h ILE 275 CO 0.26 0.10 0.30 1.56 0.00 0.00 0.00 178.15 180.37 1x8l h GLN 276 N 0.57 0.60 -0.65 2.37 1.08 -1.37 0.15 115.11 117.86 1x8l h GLN 276 Ca 0.18 -0.04 0.02 0.00 -1.45 0.00 0.00 58.65 57.36 1x8l h GLN 276 Cb -0.02 -0.13 -0.04 0.00 -0.05 0.00 0.00 27.48 27.24 1x8l h GLN 276 CO -0.07 0.39 0.41 -0.09 -0.95 0.00 0.00 178.83 178.53 1x8l h ARG 277 N 0.61 0.79 -0.60 1.46 2.43 -1.46 0.26 114.38 117.88 1x8l h ARG 277 Ca 0.17 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.29 1x8l h ARG 277 Cb -0.07 -0.18 -0.03 0.00 -0.42 0.00 0.00 29.97 29.27 1x8l h ARG 277 CO -0.04 0.53 0.36 -0.07 -1.51 0.00 0.00 179.97 179.24 1x8l h LEU 278 N 0.82 0.72 -0.58 3.80 3.38 -0.83 -1.76 115.31 120.86 1x8l h LEU 278 Ca 0.25 -0.06 -0.07 0.00 0.09 0.00 0.00 57.88 58.10 1x8l h LEU 278 Cb -0.02 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 1x8l h LEU 278 CO -0.09 0.57 0.10 -1.28 0.09 0.00 0.00 178.44 177.82 1x8l h SER 279 N 0.81 0.92 -0.67 -0.43 0.87 -0.24 -2.19 113.55 112.61 1x8l h SER 279 Ca 0.21 -0.26 -0.04 0.00 -1.23 0.00 0.00 61.79 60.47 1x8l h SER 279 Cb -0.02 -0.24 -0.03 0.00 -0.44 0.00 0.00 62.40 61.66 1x8l h SER 279 CO -0.04 0.94 0.26 -0.33 -0.53 0.00 0.00 176.83 177.13 1x8l h GLU 280 N 0.86 1.04 -0.20 2.24 5.08 -0.39 -2.53 114.58 120.68 1x8l h GLU 280 Ca 0.18 -0.19 -0.05 0.00 -1.00 0.00 0.00 59.36 58.30 1x8l h GLU 280 Cb 0.42 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 1x8l h GLU 280 CO 0.01 0.86 -0.10 1.25 -1.00 0.00 0.00 179.01 180.04 1x8l h HIS 281 N 1.01 0.32 -0.12 4.33 2.76 -0.87 -2.35 115.15 120.24 1x8l h HIS 281 Ca 0.23 -0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.37 1x8l h HIS 281 Cb 0.23 -0.09 0.00 0.00 1.55 0.00 0.00 27.41 29.10 1x8l h HIS 281 CO 0.02 0.41 0.00 1.28 -1.30 0.00 0.00 177.93 178.34 1x8l n LEU 282 N -4.28 1.85 -4.50 0.26 7.99 -0.87 -4.27 117.00 113.19 1x8l n LEU 282 Ca -0.00 -0.71 -0.52 0.00 -0.01 0.00 0.00 56.01 54.76 1x8l n LEU 282 Cb 0.26 -0.07 -0.05 0.00 -0.11 0.00 0.00 43.42 43.45 1x8l n LEU 282 CO 0.38 0.36 0.46 -3.20 -1.51 0.00 0.00 177.39 173.87 1x8l n ASN 283 N 0.44 0.11 0.18 -1.43 2.85 -0.89 -4.77 115.26 111.76 1x8l n ASN 283 Ca 0.17 1.15 -0.14 0.00 -0.11 0.00 0.00 54.58 55.65 1x8l n ASN 283 Cb 0.38 -1.03 -0.07 0.00 1.24 0.00 0.00 39.78 40.30 1x8l n ASN 283 CO 0.00 0.00 0.00 0.15 -2.11 0.00 0.00 177.26 175.30 1x8l h PHE 284 N 2.56 -0.53 -0.80 1.20 3.57 -1.92 -1.36 116.94 119.66 1x8l h PHE 284 Ca -0.42 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.06 1x8l h PHE 284 Cb 1.40 0.19 -0.04 0.00 2.79 0.00 0.00 35.95 40.30 1x8l h PHE 284 CO 0.52 -0.31 0.40 0.93 -2.23 0.00 0.00 178.31 177.62 1x8l h GLU 285 N -0.48 1.14 -0.00 1.11 4.39 -1.97 -0.35 114.58 118.42 1x8l h GLU 285 Ca -0.02 -0.15 -0.00 0.00 0.34 0.00 0.00 59.36 59.53 1x8l h GLU 285 Cb 0.41 -0.21 -0.00 0.00 -0.10 0.00 0.00 28.75 28.85 1x8l h GLU 285 CO 0.00 0.86 0.00 0.87 -1.16 0.00 0.00 179.01 179.58 1x8l h LYS 286 N 1.13 0.00 -0.47 2.33 6.56 -1.88 -2.81 116.57 121.43 1x8l h LYS 286 Ca 0.28 -0.00 -0.00 0.00 -1.06 0.00 0.00 60.65 59.86 1x8l h LYS 286 Cb 0.08 -0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 31.72 1x8l h LYS 286 CO -0.04 0.18 0.28 0.35 -2.06 0.00 0.00 179.45 178.16 1x8l h PHE 287 N -0.17 0.63 -0.10 -1.35 3.57 -0.98 -2.15 116.94 116.39 1x8l h PHE 287 Ca 0.00 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.53 1x8l h PHE 287 Cb 0.18 -0.21 -0.00 0.00 2.79 0.00 0.00 35.95 38.71 1x8l h PHE 287 CO -0.02 0.45 0.08 -0.22 -2.23 0.00 0.00 178.31 176.37 1x8l h LYS 288 N 0.63 0.00 -0.28 1.11 3.64 -1.10 -0.90 116.57 119.67 1x8l h LYS 288 Ca 0.17 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.55 1x8l h LYS 288 Cb 0.01 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.83 1x8l h LYS 288 CO -0.03 0.00 0.00 0.09 -2.27 0.00 0.00 179.45 177.24 1x8l n ASN 289 N -4.46 2.00 -4.45 4.20 3.02 -0.85 -4.81 115.26 109.91 1x8l n ASN 289 Ca -0.00 -1.85 -0.44 0.00 -0.03 0.00 0.00 54.58 52.26 1x8l n ASN 289 Cb 0.19 -0.18 -0.05 0.00 -0.61 0.00 0.00 39.78 39.13 1x8l n ASN 289 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1x8l s ASN 290 N -1.33 6.22 0.64 6.41 3.84 -0.34 -4.91 114.94 125.48 1x8l s ASN 290 Ca 0.30 -0.93 0.32 0.00 0.21 0.00 0.00 52.86 52.77 1x8l s ASN 290 Cb 0.16 -2.36 1.75 0.00 -0.55 0.00 0.00 41.25 40.25 1x8l s ASN 290 CO 0.23 -1.18 2.02 1.23 -2.79 0.00 0.00 177.10 176.62 1x8l h GLY 291 N 10.53 0.00 2.00 1.21 0.00 -1.87 -0.47 103.07 114.47 1x8l h GLY 291 Ca -0.28 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 46.95 1x8l h GLY 291 CO 1.08 0.00 -0.47 0.00 0.00 0.00 0.00 176.54 177.15 1x8l h ALA 292 N 1.53 1.13 0.00 3.60 0.00 -1.89 -3.38 119.26 120.26 1x8l h ALA 292 Ca 0.04 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1x8l h ALA 292 Cb 0.59 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1x8l h ALA 292 CO -0.00 0.59 -0.08 1.33 0.00 0.00 0.00 179.25 181.09 1x8l n VAL 293 N -3.85 0.00 1.44 0.00 0.24 -0.79 -0.90 118.33 114.48 1x8l n VAL 293 Ca -0.01 -0.37 0.13 0.00 -2.04 0.00 0.00 64.34 62.05 1x8l n VAL 293 Cb 0.51 0.94 0.50 0.00 -1.47 0.00 0.00 33.84 34.32 1x8l n VAL 293 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 1x8l n ASN 294 N -0.85 1.43 -1.19 -1.34 0.23 -0.25 -4.93 115.26 108.35 1x8l n ASN 294 Ca 0.00 -1.54 -0.16 0.00 -0.53 0.00 0.00 54.58 52.35 1x8l n ASN 294 Cb 0.00 -0.04 -0.07 0.00 -2.08 0.00 0.00 39.78 37.59 1x8l n ASN 294 CO 0.00 0.00 0.00 0.23 -0.93 0.00 0.00 177.26 176.56 1x8l n MET 295 N 0.13 -1.60 0.19 -3.83 2.81 -1.26 -4.39 117.12 109.16 1x8l n MET 295 Ca 0.18 1.05 0.14 0.00 -1.81 0.00 0.00 57.70 57.26 1x8l n MET 295 Cb 0.32 -5.47 0.52 0.00 -0.71 0.00 0.00 33.22 27.89 1x8l n MET 295 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 1x8l h GLU 296 N 0.00 0.00 -0.04 0.03 4.39 -1.92 -2.15 114.58 114.89 1x8l h GLU 296 Ca -0.32 0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.39 1x8l h GLU 296 Cb 1.27 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.92 1x8l h GLU 296 CO 0.47 0.00 0.05 0.38 -1.16 0.00 0.00 179.01 178.75 1x8l h ASP 297 N 0.00 0.00 1.89 1.42 2.03 -1.89 -2.36 116.42 117.51 1x8l h ASP 297 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1x8l h ASP 297 Cb 0.52 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.02 1x8l h ASP 297 CO 0.00 0.00 0.00 1.88 -1.03 0.00 0.00 179.24 180.09 1x8l h TYR 298 N 0.00 0.00 -0.12 4.15 -1.99 -1.79 -3.18 116.97 114.05 1x8l h TYR 298 Ca 0.02 0.00 -0.15 0.00 2.00 0.00 0.00 58.73 60.60 1x8l h TYR 298 Cb 0.12 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 38.84 1x8l h TYR 298 CO 0.00 0.00 -0.57 -0.09 -0.00 0.00 0.00 178.16 177.50 1x8l h ARG 299 N 0.00 0.36 -0.96 4.88 2.43 -1.58 -2.43 114.38 117.08 1x8l h ARG 299 Ca 0.00 -0.23 0.07 0.00 -0.81 0.00 0.00 59.98 59.01 1x8l h ARG 299 Cb 0.94 0.03 -0.07 0.00 -0.42 0.00 0.00 29.97 30.45 1x8l h ARG 299 CO 0.00 0.83 0.61 0.93 -1.51 0.00 0.00 179.97 180.83 1x8l h GLU 300 N 0.27 1.06 -0.17 0.20 5.08 -1.61 -1.99 114.58 117.43 1x8l h GLU 300 Ca 0.00 -0.06 -0.10 0.00 -1.00 0.00 0.00 59.36 58.20 1x8l h GLU 300 Cb 1.08 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 30.08 1x8l h GLU 300 CO 0.10 0.70 -0.34 0.82 -1.00 0.00 0.00 179.01 179.29 1x8l h ILE 301 N 1.09 1.28 0.00 3.13 2.04 -1.51 -3.40 117.51 120.14 1x8l h ILE 301 Ca 0.43 -1.38 0.00 0.00 1.00 0.00 0.00 64.86 64.90 1x8l h ILE 301 Cb 0.22 1.53 0.00 0.00 -0.74 0.00 0.00 36.82 37.83 1x8l h ILE 301 CO -0.19 0.42 0.00 0.61 0.00 0.00 0.00 178.15 179.00 1x8l n GLY 302 N -0.29 1.23 0.75 5.37 0.00 -0.75 -2.14 105.19 109.37 1x8l n GLY 302 Ca -0.01 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.09 1x8l n GLY 302 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1x8l n ILE 303 N -1.37 0.45 -4.00 -0.61 -5.35 -1.21 -4.91 119.36 102.38 1x8l n ILE 303 Ca 0.00 -0.73 -0.35 0.00 -0.27 0.00 0.00 62.75 61.40 1x8l n ILE 303 Cb 0.00 0.95 -0.06 0.00 -1.74 0.00 0.00 39.64 38.79 1x8l n ILE 303 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 1x8l s LEU 304 N -1.17 4.18 0.28 7.28 1.43 -1.26 -4.67 118.68 124.75 1x8l s LEU 304 Ca 0.25 0.34 -0.22 0.00 -1.03 0.00 0.00 54.13 53.47 1x8l s LEU 304 Cb 0.15 -2.18 -0.09 0.00 0.03 0.00 0.00 46.19 44.10 1x8l s LEU 304 CO 0.21 0.35 0.82 0.00 0.23 0.00 0.00 176.35 177.96 1x8l s ALA 305 N -1.10 3.31 0.53 4.21 0.00 -0.35 -4.97 121.76 123.39 1x8l s ALA 305 Ca 0.19 0.31 -0.21 0.00 0.00 0.00 0.00 51.96 52.24 1x8l s ALA 305 Cb -0.12 -2.98 -0.07 0.00 0.00 0.00 0.00 23.12 19.96 1x8l s ALA 305 CO 0.09 0.26 1.10 -0.25 0.00 0.00 0.00 175.76 176.95 1x8l n ASP 306 N 0.54 1.53 0.00 0.00 8.00 -1.26 -2.82 116.55 122.54 1x8l n ASP 306 Ca 0.00 0.93 0.00 0.00 0.71 0.00 0.00 54.79 56.43 1x8l n ASP 306 Cb 0.51 -1.44 0.00 0.00 -0.02 0.00 0.00 41.12 40.17 1x8l n ASP 306 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1x8l n GLY 307 N 1.09 2.77 3.90 0.44 0.00 -1.26 -5.00 105.19 107.13 1x8l n GLY 307 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 1x8l n GLY 307 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1x8l s GLU 308 N -0.07 3.45 0.03 1.61 0.41 -1.13 -5.10 118.70 117.91 1x8l s GLU 308 Ca 0.00 -0.30 0.03 0.00 -0.41 0.00 0.00 54.97 54.29 1x8l s GLU 308 Cb 0.00 -3.09 -0.02 0.00 -1.78 0.00 0.00 34.13 29.24 1x8l s GLU 308 CO 0.00 0.67 -0.10 -1.01 -0.49 0.00 0.00 175.26 174.33 1x8l s HIS 309 N -1.33 0.84 0.22 1.61 3.76 -1.26 -4.83 115.29 114.30 1x8l s HIS 309 Ca 0.28 -0.34 -0.03 0.00 -0.15 0.00 0.00 55.06 54.82 1x8l s HIS 309 Cb -0.13 -0.50 0.20 0.00 1.11 0.00 0.00 32.58 33.26 1x8l s HIS 309 CO 0.19 -0.02 1.60 0.35 -0.85 0.00 0.00 174.74 176.01 1x8l h PHE 310 N 5.05 0.75 -3.67 1.40 3.57 -1.96 -3.36 116.94 118.72 1x8l h PHE 310 Ca -0.35 -0.20 -0.68 0.00 3.53 0.00 0.00 57.97 60.27 1x8l h PHE 310 Cb 1.19 -0.17 -0.21 0.00 2.79 0.00 0.00 35.95 39.55 1x8l h PHE 310 CO 0.54 0.90 -0.53 0.42 -2.23 0.00 0.00 178.31 177.41 1x8l s ILE 311 N -4.35 4.81 0.00 1.41 -1.09 -1.26 -5.01 121.20 115.70 1x8l s ILE 311 Ca -0.08 -0.39 -0.01 0.00 -2.23 0.00 0.00 60.65 57.94 1x8l s ILE 311 Cb 0.12 -3.47 -0.00 0.00 -1.58 0.00 0.00 42.46 37.53 1x8l s ILE 311 CO 0.83 0.03 -0.02 -1.14 -1.23 0.00 0.00 174.94 173.41 1x8l n ARG 312 N 5.02 0.03 0.00 2.79 0.63 -1.26 -4.94 116.66 118.93 1x8l n ARG 312 Ca -0.13 0.01 0.00 0.00 -0.92 0.00 0.00 57.85 56.81 1x8l n ARG 312 Cb 0.49 -0.27 0.00 0.00 0.45 0.00 0.00 32.46 33.13 1x8l n ARG 312 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 1x8l n LYS 313 N -2.69 0.00 -0.86 -0.14 4.76 -1.26 -5.02 118.16 112.94 1x8l n LYS 313 Ca -0.01 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.43 1x8l n LYS 313 Cb 0.03 -0.43 0.00 0.00 -1.84 0.00 0.00 35.03 32.78 1x8l n LYS 313 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1x8l n GLY 314 N 2.38 0.85 3.70 0.72 0.00 -1.26 -5.06 105.19 106.53 1x8l n GLY 314 Ca 0.00 -0.58 -0.23 0.00 0.00 0.00 0.00 46.02 45.22 1x8l n GLY 314 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x8l s LYS 315 N -1.94 2.40 -0.03 1.61 -0.14 -1.26 -5.03 119.74 115.35 1x8l s LYS 315 Ca 0.00 -1.43 0.03 0.00 -1.36 0.00 0.00 55.97 53.21 1x8l s LYS 315 Cb 0.00 -2.21 -0.03 0.00 -1.68 0.00 0.00 37.83 33.91 1x8l s LYS 315 CO 0.00 0.26 -0.09 0.00 -0.76 0.00 0.00 175.35 174.76 1x8l s ALA 316 N -2.35 2.90 0.00 5.17 0.00 -1.26 -4.75 121.76 121.47 1x8l s ALA 316 Ca 0.34 -0.98 0.00 0.00 0.00 0.00 0.00 51.96 51.33 1x8l s ALA 316 Cb -0.05 -1.10 0.00 0.00 0.00 0.00 0.00 23.12 21.97 1x8l s ALA 316 CO 0.22 0.58 0.00 0.41 0.00 0.00 0.00 175.76 176.97 1x8l n GLY 317 N 1.96 0.77 0.00 0.00 0.00 -1.26 -4.94 105.19 101.73 1x8l n GLY 317 Ca -0.17 0.00 0.13 0.00 0.00 0.00 0.00 46.02 45.98 1x8l n GLY 317 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x8l h TRP 319 N 0.00 0.09 0.00 0.00 5.08 -1.92 -1.65 115.95 117.55 1x8l h TRP 319 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 1x8l h TRP 319 Cb 0.01 -0.03 0.00 0.00 -3.00 0.00 0.00 29.16 26.14 1x8l h TRP 319 CO 0.00 0.04 0.08 0.00 -1.28 0.00 0.00 178.44 177.28 1x8l h ARG 320 N 0.08 0.00 0.00 0.12 3.08 -1.90 -0.41 114.38 115.35 1x8l h ARG 320 Ca 0.26 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.31 1x8l h ARG 320 Cb 0.92 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.97 1x8l h ARG 320 CO -0.02 0.00 0.00 -0.44 -1.07 0.00 0.00 179.97 178.44 1x8l h ASP 321 N 0.00 0.00 0.00 7.04 3.32 -1.57 -3.34 116.42 121.87 1x8l h ASP 321 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1x8l h ASP 321 Cb 0.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.71 1x8l h ASP 321 CO 0.00 0.00 -1.29 -1.22 -1.72 0.00 0.00 179.24 175.01 1x8l n TYR 322 N -2.92 0.00 -3.62 4.55 4.02 -0.20 -4.99 117.16 114.00 1x8l n TYR 322 Ca 0.02 0.00 -0.37 0.00 -0.01 0.00 0.00 57.90 57.54 1x8l n TYR 322 Cb 0.39 -0.19 -0.10 0.00 -0.02 0.00 0.00 39.34 39.42 1x8l n TYR 322 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 1x8l s PHE 323 N -2.57 3.27 0.96 -0.72 0.40 -1.02 -4.86 117.98 113.45 1x8l s PHE 323 Ca -0.02 0.18 -0.16 0.00 -0.60 0.00 0.00 56.93 56.33 1x8l s PHE 323 Cb 0.07 -2.33 0.23 0.00 0.51 0.00 0.00 43.02 41.50 1x8l s PHE 323 CO 0.42 -0.05 1.06 -0.40 0.70 0.00 0.00 175.22 176.95 1x8l n ASP 324 N 4.68 -0.91 0.02 1.36 3.85 -1.26 -4.79 116.55 119.50 1x8l n ASP 324 Ca -0.14 -1.26 -0.07 0.00 -0.71 0.00 0.00 54.79 52.61 1x8l n ASP 324 Cb 0.52 -0.88 0.11 0.00 -1.35 0.00 0.00 41.12 39.51 1x8l n ASP 324 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.20 177.24 1x8l h GLU 325 N 0.00 0.47 0.43 0.11 9.09 -1.99 -1.33 114.58 121.35 1x8l h GLU 325 Ca -0.37 -0.27 -0.02 0.00 0.05 0.00 0.00 59.36 58.75 1x8l h GLU 325 Cb 1.07 0.02 0.00 0.00 -1.65 0.00 0.00 28.75 28.19 1x8l h GLU 325 CO 0.25 0.85 -0.20 1.49 0.05 0.00 0.00 179.01 181.45 1x8l h GLU 326 N 0.37 -0.55 -0.86 1.06 4.57 -2.00 -2.23 114.58 114.96 1x8l h GLU 326 Ca 0.02 0.04 0.09 0.00 -1.18 0.00 0.00 59.36 58.33 1x8l h GLU 326 Cb 0.99 0.13 -0.06 0.00 -0.16 0.00 0.00 28.75 29.64 1x8l h GLU 326 CO 0.09 -0.29 0.56 0.52 -1.18 0.00 0.00 179.01 178.70 1x8l h MET 327 N -0.72 0.82 -0.63 1.92 2.86 -1.91 -1.49 114.93 115.78 1x8l h MET 327 Ca -0.06 -0.05 -0.02 0.00 -2.06 0.00 0.00 59.70 57.51 1x8l h MET 327 Cb 0.51 -0.18 -0.03 0.00 0.06 0.00 0.00 31.60 31.96 1x8l h MET 327 CO 0.10 0.54 0.29 1.15 1.06 0.00 0.00 176.91 180.05 1x8l h THR 328 N 0.84 1.21 0.03 2.22 2.02 -0.94 -0.00 112.91 118.28 1x8l h THR 328 Ca 0.39 -0.59 -0.22 0.00 0.77 0.00 0.00 66.41 66.76 1x8l h THR 328 Cb 0.40 0.41 -0.02 0.00 -1.74 0.00 0.00 68.15 67.20 1x8l h THR 328 CO -0.16 0.25 -1.04 0.11 0.37 0.00 0.00 175.52 175.05 1x8l h LYS 329 N 0.89 0.07 -0.52 6.66 1.79 -0.99 -1.58 116.57 122.88 1x8l h LYS 329 Ca 0.22 -0.11 -0.04 0.00 -2.18 0.00 0.00 60.65 58.54 1x8l h LYS 329 Cb 0.10 0.04 -0.02 0.00 -1.58 0.00 0.00 32.23 30.77 1x8l h LYS 329 CO -0.03 1.03 0.16 0.37 -1.08 0.00 0.00 179.45 179.90 1x8l h GLN 330 N 0.02 0.81 -0.24 3.15 4.15 -0.99 -1.90 115.11 120.11 1x8l h GLN 330 Ca -0.04 -0.18 -0.04 0.00 0.77 0.00 0.00 58.65 59.16 1x8l h GLN 330 Cb 1.78 -0.12 -0.01 0.00 0.21 0.00 0.00 27.48 29.35 1x8l h GLN 330 CO 0.14 0.76 -0.01 0.00 -1.93 0.00 0.00 178.83 177.79 1x8l h ALA 331 N 1.02 0.32 -0.14 3.38 0.00 -0.92 -2.09 119.26 120.83 1x8l h ALA 331 Ca 0.17 -0.22 0.05 0.00 0.00 0.00 0.00 54.91 54.90 1x8l h ALA 331 Cb 0.29 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.94 1x8l h ALA 331 CO -0.00 0.06 -0.19 0.93 0.00 0.00 0.00 179.25 180.05 1x8l h GLU 332 N 0.19 -0.22 -0.39 0.00 5.08 -1.23 0.17 114.58 118.18 1x8l h GLU 332 Ca 0.07 0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.45 1x8l h GLU 332 Cb 0.43 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.70 1x8l h GLU 332 CO 0.01 -0.15 0.25 -0.22 -1.00 0.00 0.00 179.01 177.91 1x8l h LYS 333 N -0.23 0.50 -0.37 2.33 3.64 -1.36 -1.92 116.57 119.16 1x8l h LYS 333 Ca 0.10 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.43 1x8l h LYS 333 Cb 0.38 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.07 1x8l h LYS 333 CO -0.28 0.33 0.14 2.35 -2.27 0.00 0.00 179.45 179.73 1x8l h TRP 334 N 0.52 0.57 -0.23 1.91 7.01 -0.99 -0.76 115.95 123.99 1x8l h TRP 334 Ca 0.15 -0.05 -0.03 0.00 2.11 0.00 0.00 58.89 61.07 1x8l h TRP 334 Cb -0.05 -0.17 -0.01 0.00 -2.10 0.00 0.00 29.16 26.83 1x8l h TRP 334 CO -0.05 0.53 0.03 0.82 -2.79 0.00 0.00 178.44 176.97 1x8l h ILE 335 N 0.46 1.23 -0.08 2.65 2.04 -0.92 -2.44 117.51 120.45 1x8l h ILE 335 Ca 0.12 -0.79 0.02 0.00 1.00 0.00 0.00 64.86 65.21 1x8l h ILE 335 Cb 0.20 1.31 -0.02 0.00 -0.74 0.00 0.00 36.82 37.57 1x8l h ILE 335 CO -0.01 0.25 -0.02 0.50 0.00 0.00 0.00 178.15 178.87 1x8l h LYS 336 N 0.18 -0.00 -0.99 2.37 3.64 -1.24 -1.11 116.57 119.42 1x8l h LYS 336 Ca 0.07 0.00 0.12 0.00 -1.27 0.00 0.00 60.65 59.57 1x8l h LYS 336 Cb 0.34 0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 32.08 1x8l h LYS 336 CO 0.01 -0.00 0.63 -0.44 -2.27 0.00 0.00 179.45 177.37 1x8l h ASP 337 N -0.00 0.90 1.67 4.20 3.45 -1.09 -1.19 116.42 124.35 1x8l h ASP 337 Ca 0.04 0.05 0.00 0.00 0.43 0.00 0.00 57.03 57.55 1x8l h ASP 337 Cb 0.06 -0.13 0.00 0.00 -0.56 0.00 0.00 39.33 38.70 1x8l h ASP 337 CO -0.08 0.47 -0.31 0.78 -1.57 0.00 0.00 179.24 178.52 1x8l h ASN 338 N 0.96 0.00 0.06 6.45 2.35 -0.99 -3.22 115.58 121.18 1x8l h ASN 338 Ca 0.49 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.24 1x8l h ASN 338 Cb 0.53 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.90 1x8l h ASN 338 CO -0.26 0.00 -0.65 0.18 -1.65 0.00 0.00 177.43 175.05 1x8l n LEU 339 N -2.94 1.42 -4.77 1.61 4.77 -0.46 -4.86 117.00 111.76 1x8l n LEU 339 Ca 0.03 -0.55 -0.40 0.00 -0.03 0.00 0.00 56.01 55.06 1x8l n LEU 339 Cb 0.53 -0.03 -0.01 0.00 -2.33 0.00 0.00 43.42 41.58 1x8l n LEU 339 CO 0.36 0.29 1.05 -0.75 -1.33 0.00 0.00 177.39 177.01 1x8l s LYS 340 N -2.72 4.11 -1.63 3.23 2.20 -0.48 -2.91 119.74 121.54 1x8l s LYS 340 Ca 0.15 2.38 -0.01 0.00 -0.36 0.00 0.00 55.97 58.12 1x8l s LYS 340 Cb 0.17 -2.92 0.00 0.00 -1.51 0.00 0.00 37.83 33.57 1x8l s LYS 340 CO 0.69 -0.46 0.15 -0.25 -0.36 0.00 0.00 175.35 175.12 1x8l n ASP 341 N 0.42 -5.65 -3.93 1.43 8.00 -1.26 -5.00 116.55 110.56 1x8l n ASP 341 Ca 0.02 -0.06 -0.08 0.00 0.71 0.00 0.00 54.79 55.37 1x8l n ASP 341 Cb 0.41 -4.68 -0.08 0.00 -0.02 0.00 0.00 41.12 36.75 1x8l n ASP 341 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1x8l s THR 342 N -3.02 0.16 -2.20 -3.53 -4.23 -1.15 -5.03 115.64 96.65 1x8l s THR 342 Ca 0.08 -1.32 0.19 0.00 -1.18 0.00 0.00 61.69 59.46 1x8l s THR 342 Cb -0.04 -1.28 0.43 0.00 1.34 0.00 0.00 72.50 72.96 1x8l s THR 342 CO 0.10 -0.73 1.51 -0.90 -0.54 0.00 0.00 174.62 174.06 1x8l n ASP 343 N 0.19 1.51 -4.67 3.99 5.75 -1.26 -4.92 116.55 117.15 1x8l n ASP 343 Ca -0.16 -1.73 -0.42 0.00 -0.01 0.00 0.00 54.79 52.47 1x8l n ASP 343 Cb 0.61 -0.11 -0.03 0.00 -1.03 0.00 0.00 41.12 40.56 1x8l n ASP 343 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 1x8l s LEU 344 N -1.48 4.41 0.02 -2.12 2.96 -1.26 -4.99 118.68 116.23 1x8l s LEU 344 Ca 0.30 2.65 0.01 0.00 -0.22 0.00 0.00 54.13 56.88 1x8l s LEU 344 Cb 0.16 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 43.29 1x8l s LEU 344 CO 0.24 -1.02 -0.05 -0.13 -1.32 0.00 0.00 176.35 174.07 1x8l s ARG 345 N 3.77 0.39 -0.08 1.98 1.81 -1.26 -4.94 118.95 120.62 1x8l s ARG 345 Ca 0.84 -0.54 -0.05 0.00 -1.72 0.00 0.00 55.73 54.26 1x8l s ARG 345 Cb -0.43 -0.15 -0.04 0.00 -0.45 0.00 0.00 34.95 33.88 1x8l s ARG 345 CO 0.38 0.02 0.14 0.71 -0.68 0.00 0.00 175.30 175.88 1x8l s TYR 346 N -1.07 3.53 0.15 -0.53 1.51 -1.26 -5.03 117.35 114.66 1x8l s TYR 346 Ca -0.09 0.43 -0.12 0.00 -1.01 0.00 0.00 57.07 56.28 1x8l s TYR 346 Cb -0.08 -1.88 0.03 0.00 -0.11 0.00 0.00 41.96 39.92 1x8l s TYR 346 CO -0.00 0.68 1.63 -1.35 -1.11 0.00 0.00 175.55 175.40 1x8l h PRO 347 N 4.60 0.87 0.00 -1.71 0.11 -2.00 -2.97 132.00 130.90 1x8l h PRO 347 Ca -0.53 -0.25 0.00 0.00 0.11 0.00 0.00 66.00 65.33 1x8l h PRO 347 Cb 1.21 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1x8l h PRO 347 CO 0.61 0.88 -0.08 -0.91 -0.21 0.00 0.00 178.00 178.29 1x8l h ASN 348 N 0.75 0.00 0.00 -2.05 2.35 -1.96 -3.53 115.58 111.14 1x8l h ASN 348 Ca 0.15 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.89 1x8l h ASN 348 Cb 0.45 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.82 1x8l h ASN 348 CO 0.02 0.00 0.00 0.23 -1.65 0.00 0.00 177.43 176.03