#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 2.17 -1.43 0.54 5.36 -1.26 -4.89 117.98 118.46 1x8l s PHE 9 Ca 0.00 0.57 0.30 0.00 -0.96 0.00 0.00 56.93 56.84 1x8l s PHE 9 Cb 0.00 -3.96 1.47 0.00 -0.34 0.00 0.00 43.02 40.19 1x8l s PHE 9 CO 0.00 -2.84 2.02 -0.35 -1.46 0.00 0.00 175.22 172.59 1x8l n PRO 10 N 7.58 0.43 -4.07 10.12 -0.04 -1.26 -4.87 135.00 142.89 1x8l n PRO 10 Ca 0.18 -0.03 -0.30 0.00 -0.04 0.00 0.00 63.50 63.31 1x8l n PRO 10 Cb 0.45 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.34 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 -2.58 3.15 0.25 0.54 4.12 -1.26 -5.07 117.35 116.50 1x8l s TYR 11 Ca 0.28 0.06 0.08 0.00 0.02 0.00 0.00 57.07 57.51 1x8l s TYR 11 Cb 0.20 -1.61 -0.04 0.00 -1.52 0.00 0.00 41.96 39.00 1x8l s TYR 11 CO 0.47 0.51 0.12 -1.21 0.02 0.00 0.00 175.55 175.46 1x8l s GLU 12 N -2.36 2.68 0.22 -0.62 0.41 -1.26 -4.90 118.70 112.87 1x8l s GLU 12 Ca 0.28 -1.17 0.10 0.00 -0.41 0.00 0.00 54.97 53.77 1x8l s GLU 12 Cb -0.12 -2.42 -0.04 0.00 -1.78 0.00 0.00 34.13 29.76 1x8l s GLU 12 CO 0.21 0.40 -0.08 -0.59 -0.49 0.00 0.00 175.26 174.71 1x8l s PHE 13 N -2.16 2.61 0.11 1.61 -0.12 -1.26 -0.52 117.98 118.26 1x8l s PHE 13 Ca 0.32 -0.24 0.06 0.00 -0.05 0.00 0.00 56.93 57.02 1x8l s PHE 13 Cb -0.08 -1.22 -0.04 0.00 -0.63 0.00 0.00 43.02 41.06 1x8l s PHE 13 CO 0.23 0.57 -0.15 -0.98 -0.05 0.00 0.00 175.22 174.85 1x8l s ARG 14 N -3.19 1.00 0.59 1.99 1.70 -0.29 -4.99 118.95 115.77 1x8l s ARG 14 Ca 0.28 -1.19 -0.17 0.00 -0.47 0.00 0.00 55.73 54.17 1x8l s ARG 14 Cb -0.08 -0.93 -0.03 0.00 -0.57 0.00 0.00 34.95 33.35 1x8l s ARG 14 CO 0.17 0.18 1.11 -1.21 -1.08 0.00 0.00 175.30 174.47 1x8l s GLU 15 N -2.48 3.14 0.37 3.89 0.41 -1.26 -1.71 118.70 121.06 1x8l s GLU 15 Ca 0.07 1.47 -0.28 0.00 -0.41 0.00 0.00 54.97 55.82 1x8l s GLU 15 Cb -0.06 -1.99 -0.11 0.00 -1.78 0.00 0.00 34.13 30.19 1x8l s GLU 15 CO 0.03 -1.00 1.50 -0.51 -0.49 0.00 0.00 175.26 174.80 1x8l s LEU 16 N -4.30 4.32 0.90 1.80 1.43 -1.26 -4.84 118.68 116.72 1x8l s LEU 16 Ca 0.69 3.06 -0.12 0.00 -1.03 0.00 0.00 54.13 56.73 1x8l s LEU 16 Cb -0.21 -3.67 0.13 0.00 0.03 0.00 0.00 46.19 42.47 1x8l s LEU 16 CO 0.34 -0.89 1.10 0.54 0.23 0.00 0.00 176.35 177.67 1x8l s ASN 17 N -0.07 3.52 0.24 2.29 2.20 -1.26 -4.78 114.94 117.08 1x8l s ASN 17 Ca 0.54 1.24 -0.05 0.00 -0.94 0.00 0.00 52.86 53.65 1x8l s ASN 17 Cb -0.47 -1.90 0.41 0.00 -2.00 0.00 0.00 41.25 37.29 1x8l s ASN 17 CO 0.62 -2.57 1.77 -0.65 -2.94 0.00 0.00 177.10 173.33 1x8l h PRO 18 N -1.51 0.58 -0.34 3.55 0.11 -1.98 -0.41 132.00 132.00 1x8l h PRO 18 Ca -0.50 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 65.50 1x8l h PRO 18 Cb 1.30 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 1x8l h PRO 18 CO 0.58 0.39 -0.05 1.49 -0.21 0.00 0.00 178.00 180.20 1x8l h GLU 19 N 0.60 0.64 -1.00 1.05 4.81 -2.00 -1.16 114.58 117.52 1x8l h GLU 19 Ca 0.40 -0.23 0.01 0.00 -0.13 0.00 0.00 59.36 59.41 1x8l h GLU 19 Cb 0.49 -0.04 -0.05 0.00 0.63 0.00 0.00 28.75 29.77 1x8l h GLU 19 CO -0.31 0.79 0.66 0.93 -0.73 0.00 0.00 179.01 180.35 1x8l h GLU 20 N 0.43 1.32 -0.31 1.92 5.08 -1.89 -3.06 114.58 118.07 1x8l h GLU 20 Ca 0.09 -0.08 -0.15 0.00 -1.00 0.00 0.00 59.36 58.22 1x8l h GLU 20 Cb 0.53 -0.30 -0.00 0.00 0.50 0.00 0.00 28.75 29.48 1x8l h GLU 20 CO 0.03 0.87 -0.39 0.22 -1.00 0.00 0.00 179.01 178.74 1x8l h ASP 21 N 1.36 0.89 -0.15 1.42 3.58 -0.77 -2.10 116.42 120.64 1x8l h ASP 21 Ca 0.37 -0.49 0.04 0.00 0.42 0.00 0.00 57.03 57.37 1x8l h ASP 21 Cb -0.15 -0.25 -0.04 0.00 1.72 0.00 0.00 39.33 40.61 1x8l h ASP 21 CO -0.08 1.20 -0.10 0.50 -2.88 0.00 0.00 179.24 177.88 1x8l h LYS 22 N 0.59 -0.10 -0.65 0.28 3.64 -1.22 0.83 116.57 119.95 1x8l h LYS 22 Ca 0.04 0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.40 1x8l h LYS 22 Cb 0.98 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.79 1x8l h LYS 22 CO 0.09 -0.07 0.29 1.25 -2.27 0.00 0.00 179.45 178.75 1x8l h LEU 23 N -0.10 0.88 0.23 5.20 5.85 -1.42 -1.36 115.31 124.59 1x8l h LEU 23 Ca 0.09 -0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.65 1x8l h LEU 23 Cb 0.23 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.04 1x8l h LEU 23 CO -0.21 0.79 -0.11 0.58 -0.34 0.00 0.00 178.44 179.15 1x8l h VAL 24 N 0.91 0.83 -0.43 1.05 2.07 -1.20 -2.99 116.25 116.50 1x8l h VAL 24 Ca 0.22 -0.66 0.12 0.00 0.82 0.00 0.00 66.70 67.20 1x8l h VAL 24 Cb 0.16 1.20 -0.02 0.00 -1.52 0.00 0.00 31.29 31.11 1x8l h VAL 24 CO -0.02 0.14 0.39 0.50 0.02 0.00 0.00 177.57 178.59 1x8l h LYS 25 N -0.66 0.00 -0.24 1.57 3.11 -0.82 0.17 116.57 119.69 1x8l h LYS 25 Ca -0.03 0.00 -0.11 0.00 -2.81 0.00 0.00 60.65 57.70 1x8l h LYS 25 Cb 0.47 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.68 1x8l h LYS 25 CO 0.05 0.00 -0.32 0.00 -2.81 0.00 0.00 179.45 176.38 1x8l h ALA 26 N 1.63 1.00 0.01 5.00 0.00 -1.09 -2.92 119.26 122.88 1x8l h ALA 26 Ca 0.20 -0.39 -0.36 0.00 0.00 0.00 0.00 54.91 54.37 1x8l h ALA 26 Cb 0.97 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.58 1x8l h ALA 26 CO -0.00 0.60 -2.27 0.09 0.00 0.00 0.00 179.25 177.66 1x8l n ASN 27 N -4.08 0.70 -0.14 0.00 5.03 -0.16 -4.76 115.26 111.84 1x8l n ASN 27 Ca -0.01 0.05 0.02 0.00 0.87 0.00 0.00 54.58 55.51 1x8l n ASN 27 Cb 0.45 0.41 0.03 0.00 -1.02 0.00 0.00 39.78 39.65 1x8l n ASN 27 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 1x8l n LEU 28 N -2.95 0.92 -0.12 3.41 4.77 -0.13 -1.37 117.00 121.53 1x8l n LEU 28 Ca -0.33 -1.32 -0.07 0.00 -0.03 0.00 0.00 56.01 54.25 1x8l n LEU 28 Cb 1.10 -0.08 0.09 0.00 -2.33 0.00 0.00 43.42 42.19 1x8l n LEU 28 CO 0.40 0.32 0.76 1.23 -1.33 0.00 0.00 177.39 178.76 1x8l h GLY 29 N 0.00 0.91 1.64 -0.72 0.00 -1.63 -2.10 103.07 101.17 1x8l h GLY 29 Ca 0.00 -0.72 0.03 0.00 0.00 0.00 0.00 47.33 46.63 1x8l h GLY 29 CO 0.00 0.66 0.19 0.00 0.00 0.00 0.00 176.54 177.39 1x8l h ALA 30 N 1.09 1.93 -2.49 3.60 0.00 -1.89 -3.42 119.26 118.09 1x8l h ALA 30 Ca 0.12 -0.01 -0.53 0.00 0.00 0.00 0.00 54.91 54.48 1x8l h ALA 30 Cb 0.65 -0.07 0.02 0.00 0.00 0.00 0.00 17.79 18.39 1x8l h ALA 30 CO 0.05 0.03 0.82 0.12 0.00 0.00 0.00 179.25 180.27 1x8l s PHE 31 N -5.27 2.98 0.25 0.00 5.36 -0.79 -4.93 117.98 115.58 1x8l s PHE 31 Ca -0.07 0.78 -0.02 0.00 -0.96 0.00 0.00 56.93 56.66 1x8l s PHE 31 Cb 0.18 -3.75 0.31 0.00 -0.34 0.00 0.00 43.02 39.42 1x8l s PHE 31 CO 0.71 -2.74 1.73 -1.35 -1.46 0.00 0.00 175.22 172.11 1x8l h PRO 32 N 7.35 0.77 -6.27 10.12 0.11 -1.86 -3.42 132.00 138.81 1x8l h PRO 32 Ca -0.41 -0.23 -0.55 0.00 0.11 0.00 0.00 66.00 64.92 1x8l h PRO 32 Cb 1.20 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 1x8l h PRO 32 CO 0.89 0.81 0.90 0.99 -0.21 0.00 0.00 178.00 181.38 1x8l s THR 33 N -4.88 3.94 0.49 -1.15 2.01 -1.26 -5.02 115.64 109.77 1x8l s THR 33 Ca -0.09 1.21 0.05 0.00 0.31 0.00 0.00 61.69 63.18 1x8l s THR 33 Cb 0.14 -3.78 0.03 0.00 0.01 0.00 0.00 72.50 68.90 1x8l s THR 33 CO 0.81 -0.06 0.68 0.42 -0.69 0.00 0.00 174.62 175.78 1x8l s THR 34 N 3.11 2.78 0.18 -0.82 -4.23 -1.26 -4.96 115.64 110.44 1x8l s THR 34 Ca 0.62 -0.87 0.05 0.00 -1.18 0.00 0.00 61.69 60.31 1x8l s THR 34 Cb -0.28 -2.91 -0.04 0.00 1.34 0.00 0.00 72.50 70.61 1x8l s THR 34 CO 0.23 0.00 0.21 -0.31 -0.54 0.00 0.00 174.62 174.20 1x8l s TYR 35 N -2.55 3.27 0.22 3.99 1.51 -1.26 -0.73 117.35 121.80 1x8l s TYR 35 Ca 0.57 0.01 0.04 0.00 -1.01 0.00 0.00 57.07 56.68 1x8l s TYR 35 Cb -0.10 -1.55 -0.05 0.00 -0.11 0.00 0.00 41.96 40.16 1x8l s TYR 35 CO 0.36 0.51 -0.04 0.14 -1.11 0.00 0.00 175.55 175.41 1x8l s VAL 36 N -1.82 1.19 -0.16 0.71 -7.23 -0.00 -4.67 120.40 108.42 1x8l s VAL 36 Ca 0.32 -2.06 -0.07 0.00 -1.81 0.00 0.00 61.98 58.36 1x8l s VAL 36 Cb -0.10 -2.25 -0.04 0.00 0.56 0.00 0.00 36.38 34.55 1x8l s VAL 36 CO 0.26 -0.42 0.09 -0.54 -0.31 0.00 0.00 175.10 174.18 1x8l s LYS 37 N -3.81 3.81 -0.21 4.82 1.02 -0.69 -1.68 119.74 123.00 1x8l s LYS 37 Ca 0.26 -0.27 0.00 0.00 0.02 0.00 0.00 55.97 55.98 1x8l s LYS 37 Cb 0.04 -3.22 0.03 0.00 -0.52 0.00 0.00 37.83 34.16 1x8l s LYS 37 CO 0.08 0.44 -0.14 -1.17 -0.92 0.00 0.00 175.35 173.64 1x8l s LEU 38 N -0.08 2.68 0.00 3.17 2.96 0.18 -1.14 118.68 126.45 1x8l s LEU 38 Ca 0.08 -0.82 0.00 0.00 -0.22 0.00 0.00 54.13 53.17 1x8l s LEU 38 Cb -0.12 -1.56 0.00 0.00 0.50 0.00 0.00 46.19 45.02 1x8l s LEU 38 CO 0.01 -0.07 0.00 0.61 -1.32 0.00 0.00 176.35 175.58 1x8l n GLY 39 N 4.61 -0.73 0.27 7.98 0.00 0.32 -2.67 105.19 114.98 1x8l n GLY 39 Ca -0.18 -1.72 0.15 0.00 0.00 0.00 0.00 46.02 44.27 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 -1.31 132.00 130.46 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 0.08 -0.20 1.63 -0.23 0.00 0.00 178.00 179.28 1x8l n LYS 41 N -3.34 0.12 -3.30 0.86 5.02 -1.26 -4.97 118.16 111.29 1x8l n LYS 41 Ca -0.01 0.07 -0.17 0.00 -2.02 0.00 0.00 58.31 56.18 1x8l n LYS 41 Cb 0.27 -1.61 0.06 0.00 -0.02 0.00 0.00 35.03 33.72 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 1.42 -0.14 3.65 0.72 0.00 -0.50 -4.63 105.19 105.72 1x8l n GLY 42 Ca 0.06 0.00 -0.50 0.00 0.00 0.00 0.00 46.02 45.58 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 -4.31 2.00 -2.28 1.61 4.02 -1.09 -4.43 117.16 112.68 1x8l n TYR 43 Ca 0.00 0.38 -0.43 0.00 -0.01 0.00 0.00 57.90 57.84 1x8l n TYR 43 Cb 0.55 -2.48 -0.02 0.00 -0.02 0.00 0.00 39.34 37.36 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 1.81 3.63 -0.02 -0.72 -1.94 -0.42 -0.65 119.30 121.00 1x8l s MET 44 Ca 0.87 1.15 0.07 0.00 -1.71 0.00 0.00 55.69 56.07 1x8l s MET 44 Cb -0.84 -4.02 -0.02 0.00 2.01 0.00 0.00 34.83 31.96 1x8l s MET 44 CO 0.48 -1.49 -0.24 0.14 -0.01 0.00 0.00 175.02 173.89 1x8l s VAL 45 N 5.42 1.93 0.29 -6.03 -7.23 -0.67 0.08 120.40 114.19 1x8l s VAL 45 Ca 0.64 -1.04 -0.30 0.00 -1.81 0.00 0.00 61.98 59.47 1x8l s VAL 45 Cb -0.17 -1.60 -0.12 0.00 0.56 0.00 0.00 36.38 35.05 1x8l s VAL 45 CO 0.31 0.55 1.56 -1.22 -0.31 0.00 0.00 175.10 175.99 1x8l n TYR 46 N 2.50 2.78 -0.29 2.82 4.02 -1.26 -0.82 117.16 126.90 1x8l n TYR 46 Ca -0.16 0.29 0.12 0.00 -0.01 0.00 0.00 57.90 58.14 1x8l n TYR 46 Cb 0.52 -2.58 0.28 0.00 -0.02 0.00 0.00 39.34 37.54 1x8l n TYR 46 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 176.86 175.76 1x8l h ARG 47 N 4.56 0.30 0.00 -0.72 2.43 -1.19 0.24 114.38 120.00 1x8l h ARG 47 Ca -0.47 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 1x8l h ARG 47 Cb 1.23 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.71 1x8l h ARG 47 CO 0.78 0.20 0.12 -1.35 -1.51 0.00 0.00 179.97 178.20 1x8l h PRO 48 N 0.31 0.00 -0.94 0.20 0.11 -1.85 -2.42 132.00 127.40 1x8l h PRO 48 Ca 0.54 0.00 0.16 0.00 0.11 0.00 0.00 66.00 66.81 1x8l h PRO 48 Cb 1.04 0.00 -0.08 0.00 0.11 0.00 0.00 31.00 32.07 1x8l h PRO 48 CO -0.57 0.00 0.60 -0.92 -0.21 0.00 0.00 178.00 176.89 1x8l h TYR 49 N 0.00 0.88 -0.26 0.65 3.20 -1.16 -3.04 116.97 117.24 1x8l h TYR 49 Ca 0.00 0.03 0.04 0.00 3.14 0.00 0.00 58.73 61.94 1x8l h TYR 49 Cb 0.23 -0.27 -0.01 0.00 1.54 0.00 0.00 36.73 38.22 1x8l h TYR 49 CO 0.00 0.28 0.18 -0.07 -1.64 0.00 0.00 178.16 176.91 1x8l h LEU 50 N 0.71 0.15 -1.99 2.82 3.38 -1.64 -1.64 115.31 117.10 1x8l h LEU 50 Ca 0.49 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.46 1x8l h LEU 50 Cb 0.81 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.53 1x8l h LEU 50 CO -0.25 0.10 0.00 0.07 0.09 0.00 0.00 178.44 178.45 1x8l h LYS 51 N 0.17 0.00 -0.00 1.13 2.10 -1.76 -3.12 116.57 115.09 1x8l h LYS 51 Ca 0.11 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.76 1x8l h LYS 51 Cb 0.23 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.56 1x8l h LYS 51 CO -0.02 0.00 -0.05 -3.47 -2.00 0.00 0.00 179.45 173.91 1x8l n ASP 52 N -3.05 0.99 -0.13 7.07 2.03 -0.69 -4.80 116.55 117.96 1x8l n ASP 52 Ca -0.01 -0.99 -0.06 0.00 0.52 0.00 0.00 54.79 54.25 1x8l n ASP 52 Cb 0.22 0.31 0.03 0.00 -0.72 0.00 0.00 41.12 40.95 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 0.73 0.51 -0.58 -1.67 0.00 -1.29 -0.34 119.26 116.62 1x8l h ALA 53 Ca 0.00 0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 1x8l h ALA 53 Cb 0.15 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1x8l h ALA 53 CO 0.00 -0.18 -0.04 0.00 0.00 0.00 0.00 179.25 179.04 1x8l h ALA 54 N 1.23 0.79 -0.75 0.00 0.00 -1.87 -0.78 119.26 117.89 1x8l h ALA 54 Ca 0.18 -0.33 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 1x8l h ALA 54 Cb 0.11 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 1x8l h ALA 54 CO -0.15 0.66 0.36 -0.91 0.00 0.00 0.00 179.25 179.22 1x8l h ASN 55 N 0.95 0.98 -0.43 0.00 2.35 -1.75 -2.41 115.58 115.26 1x8l h ASN 55 Ca 0.16 -0.13 -0.11 0.00 -0.55 0.00 0.00 56.30 55.67 1x8l h ASN 55 Cb 0.60 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.71 1x8l h ASN 55 CO 0.04 0.83 -0.15 0.40 -1.65 0.00 0.00 177.43 176.90 1x8l h ILE 56 N 1.05 1.28 -0.11 2.81 2.04 -0.93 0.34 117.51 123.99 1x8l h ILE 56 Ca 0.26 -1.29 0.03 0.00 1.00 0.00 0.00 64.86 64.86 1x8l h ILE 56 Cb 0.11 1.20 -0.00 0.00 -0.74 0.00 0.00 36.82 37.39 1x8l h ILE 56 CO -0.03 0.44 0.09 0.22 0.00 0.00 0.00 178.15 178.86 1x8l h TYR 57 N 0.70 0.00 -0.16 1.37 3.20 -1.00 -2.90 116.97 118.17 1x8l h TYR 57 Ca 0.10 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.97 1x8l h TYR 57 Cb 0.71 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.98 1x8l h TYR 57 CO 0.05 0.00 0.00 0.09 -1.64 0.00 0.00 178.16 176.66 1x8l n ASN 58 N -4.19 3.16 -4.73 -2.11 3.02 -0.92 -3.36 115.26 106.13 1x8l n ASN 58 Ca -0.00 -2.89 -0.42 0.00 -0.03 0.00 0.00 54.58 51.24 1x8l n ASN 58 Cb 0.20 -0.44 -0.03 0.00 -0.61 0.00 0.00 39.78 38.90 1x8l n ASN 58 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1x8l s MET 59 N -2.56 4.21 0.30 3.52 0.23 0.07 -4.91 119.30 120.15 1x8l s MET 59 Ca 0.34 2.39 -0.30 0.00 -1.03 0.00 0.00 55.69 57.09 1x8l s MET 59 Cb 0.28 -3.12 -0.12 0.00 -1.53 0.00 0.00 34.83 30.34 1x8l s MET 59 CO 0.07 -0.57 1.58 -2.30 -2.03 0.00 0.00 175.02 171.77 1x8l n PRO 60 N 3.38 2.69 -4.33 3.16 -0.02 -1.26 -4.93 135.00 133.69 1x8l n PRO 60 Ca 0.12 0.95 -0.24 0.00 -2.02 0.00 0.00 63.50 62.31 1x8l n PRO 60 Cb 0.39 -2.73 -0.08 0.00 -0.02 0.00 0.00 33.50 31.05 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 -0.61 3.00 0.04 2.45 1.43 -1.26 -4.99 118.68 118.74 1x8l s LEU 61 Ca 0.63 -0.97 0.03 0.00 -1.03 0.00 0.00 54.13 52.79 1x8l s LEU 61 Cb -0.50 -1.38 -0.02 0.00 0.03 0.00 0.00 46.19 44.32 1x8l s LEU 61 CO 0.50 -0.23 -0.10 -0.13 0.23 0.00 0.00 176.35 176.62 1x8l s ARG 62 N -3.72 0.65 0.55 1.70 0.52 -1.26 -5.05 118.95 112.35 1x8l s ARG 62 Ca 0.35 -0.73 0.37 0.00 -0.52 0.00 0.00 55.73 55.19 1x8l s ARG 62 Cb -0.00 -0.54 1.80 0.00 0.52 0.00 0.00 34.95 36.73 1x8l s ARG 62 CO 0.19 0.12 2.10 -1.00 0.02 0.00 0.00 175.30 176.73 1x8l h PRO 63 N 4.72 0.00 -0.01 3.54 0.13 -2.00 -2.25 132.00 136.13 1x8l h PRO 63 Ca -0.36 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.77 1x8l h PRO 63 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1x8l h PRO 63 CO 0.42 0.00 -0.24 0.25 -0.23 0.00 0.00 178.00 178.20 1x8l n THR 64 N -2.91 0.00 -1.81 1.56 -2.24 -1.26 -4.77 114.28 102.85 1x8l n THR 64 Ca -0.01 -0.22 -0.41 0.00 -2.27 0.00 0.00 64.05 61.14 1x8l n THR 64 Cb 0.16 0.73 -0.01 0.00 -2.10 0.00 0.00 70.33 69.11 1x8l n THR 64 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1x8l s ASP 65 N -2.36 6.38 -0.08 3.42 1.01 -0.85 -4.57 116.67 119.63 1x8l s ASP 65 Ca 0.26 2.98 0.04 0.00 0.71 0.00 0.00 52.55 56.54 1x8l s ASP 65 Cb 0.19 -2.65 -0.00 0.00 1.01 0.00 0.00 42.92 41.47 1x8l s ASP 65 CO 0.48 -0.88 -0.22 0.54 0.21 0.00 0.00 175.17 175.30 1x8l s VAL 66 N -0.50 1.86 -0.11 -1.27 0.11 -0.83 -2.61 120.40 117.06 1x8l s VAL 66 Ca 0.58 -0.93 -0.02 0.00 -2.93 0.00 0.00 61.98 58.69 1x8l s VAL 66 Cb -0.47 -1.60 -0.03 0.00 -1.53 0.00 0.00 36.38 32.75 1x8l s VAL 66 CO 0.54 0.52 -0.04 -0.36 -3.33 0.00 0.00 175.10 172.43 1x8l s PHE 67 N 0.21 3.02 -0.27 1.54 0.40 0.01 -0.49 117.98 122.40 1x8l s PHE 67 Ca -0.12 -0.07 -0.03 0.00 -0.60 0.00 0.00 56.93 56.10 1x8l s PHE 67 Cb -0.16 -1.83 0.03 0.00 0.51 0.00 0.00 43.02 41.57 1x8l s PHE 67 CO 0.06 0.21 -0.01 0.08 0.70 0.00 0.00 175.22 176.27 1x8l s VAL 68 N -0.36 3.21 0.14 -0.44 1.01 0.71 -1.14 120.40 123.53 1x8l s VAL 68 Ca 0.06 -1.00 0.09 0.00 0.00 0.00 0.00 61.98 61.13 1x8l s VAL 68 Cb -0.12 -2.68 -0.04 0.00 0.00 0.00 0.00 36.38 33.53 1x8l s VAL 68 CO 0.02 0.10 -0.22 0.00 0.00 0.00 0.00 175.10 175.01 1x8l s ALA 69 N 1.36 2.10 -0.12 5.51 0.00 -0.34 -1.64 121.76 128.63 1x8l s ALA 69 Ca -0.00 -1.43 -0.33 0.00 0.00 0.00 0.00 51.96 50.20 1x8l s ALA 69 Cb -0.17 -0.27 0.13 0.00 0.00 0.00 0.00 23.12 22.80 1x8l s ALA 69 CO -0.02 0.37 1.12 -1.54 0.00 0.00 0.00 175.76 175.69 1x8l s SER 70 N -2.29 -0.19 0.22 0.00 1.04 -0.92 -1.02 113.70 110.54 1x8l s SER 70 Ca 0.13 -0.02 -0.30 0.00 0.48 0.00 0.00 55.95 56.24 1x8l s SER 70 Cb -0.08 0.22 -0.09 0.00 0.10 0.00 0.00 66.02 66.16 1x8l s SER 70 CO 0.06 -0.36 1.35 -0.47 0.98 0.00 0.00 173.24 174.80 1x8l s TYR 71 N -2.63 3.17 0.73 5.02 5.04 -1.26 -4.06 117.35 123.36 1x8l s TYR 71 Ca 0.09 1.17 -0.16 0.00 -2.44 0.00 0.00 57.07 55.73 1x8l s TYR 71 Cb -0.01 -3.68 0.00 0.00 0.35 0.00 0.00 41.96 38.63 1x8l s TYR 71 CO -0.06 -2.13 0.89 0.00 -1.34 0.00 0.00 175.55 172.91 1x8l n GLN 72 N 2.40 0.42 -2.33 4.97 10.64 -1.26 -3.48 117.38 128.74 1x8l n GLN 72 Ca 0.06 0.20 -0.10 0.00 -1.83 0.00 0.00 57.00 55.33 1x8l n GLN 72 Cb 0.42 -2.15 0.00 0.00 -0.86 0.00 0.00 30.24 27.65 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 -1.74 -1.32 -0.04 2.61 5.12 -1.26 -4.89 116.66 115.14 1x8l n ARG 73 Ca 0.12 0.47 0.02 0.00 -1.93 0.00 0.00 57.85 56.53 1x8l n ARG 73 Cb 0.50 -4.47 0.04 0.00 -1.16 0.00 0.00 32.46 27.37 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 -0.04 1.98 0.00 0.55 7.64 -1.23 -4.72 113.62 117.81 1x8l n SER 74 Ca -0.10 -1.74 0.00 0.00 1.01 0.00 0.00 58.87 58.04 1x8l n SER 74 Cb 0.58 -0.05 0.00 0.00 -1.01 0.00 0.00 64.21 63.73 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 -0.07 1.72 0.13 0.23 0.00 -1.26 -4.26 105.19 101.67 1x8l n GLY 75 Ca 0.03 0.00 -0.11 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 1.20 -0.20 2.61 2.02 -1.92 -2.66 112.91 113.96 1x8l h THR 76 Ca 0.00 -0.64 -0.01 0.00 0.77 0.00 0.00 66.41 66.52 1x8l h THR 76 Cb 0.00 1.22 -0.01 0.00 -1.74 0.00 0.00 68.15 67.62 1x8l h THR 76 CO 0.00 0.20 0.07 0.74 0.37 0.00 0.00 175.52 176.90 1x8l h THR 77 N 0.17 1.18 -0.65 3.16 2.02 -1.99 -0.50 112.91 116.30 1x8l h THR 77 Ca 0.07 -0.55 0.06 0.00 0.77 0.00 0.00 66.41 66.75 1x8l h THR 77 Cb 0.26 1.17 -0.05 0.00 -1.74 0.00 0.00 68.15 67.78 1x8l h THR 77 CO -0.00 0.17 0.36 0.24 0.37 0.00 0.00 175.52 176.67 1x8l h MET 78 N 0.16 0.66 -0.60 6.66 2.86 -2.00 -2.41 114.93 120.26 1x8l h MET 78 Ca 0.07 -0.04 -0.06 0.00 -2.06 0.00 0.00 59.70 57.61 1x8l h MET 78 Cb 0.21 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.69 1x8l h MET 78 CO -0.00 0.43 0.15 1.15 1.06 0.00 0.00 176.91 179.70 1x8l h THR 79 N 0.68 1.25 -1.00 2.22 2.02 -1.20 -2.38 112.91 114.49 1x8l h THR 79 Ca 0.29 -0.90 0.04 0.00 0.77 0.00 0.00 66.41 66.62 1x8l h THR 79 Cb 0.17 0.69 -0.06 0.00 -1.74 0.00 0.00 68.15 67.21 1x8l h THR 79 CO -0.18 0.33 0.65 1.56 0.37 0.00 0.00 175.52 178.26 1x8l h GLN 80 N 0.86 1.21 -0.17 6.66 4.20 -0.88 -0.39 115.11 126.59 1x8l h GLN 80 Ca 0.19 -0.07 -0.08 0.00 0.06 0.00 0.00 58.65 58.75 1x8l h GLN 80 Cb 0.34 -0.27 -0.00 0.00 0.30 0.00 0.00 27.48 27.85 1x8l h GLN 80 CO 0.00 0.80 -0.20 1.49 -0.67 0.00 0.00 178.83 180.25 1x8l h GLU 81 N 1.24 0.44 -0.00 1.46 4.57 -1.17 -1.46 114.58 119.66 1x8l h GLU 81 Ca 0.41 -0.24 -0.00 0.00 -1.18 0.00 0.00 59.36 58.35 1x8l h GLU 81 Cb 0.05 0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 28.65 1x8l h GLU 81 CO -0.14 0.82 0.00 -0.07 -1.18 0.00 0.00 179.01 178.44 1x8l h LEU 82 N 0.08 0.00 -0.46 1.64 3.38 -1.12 -1.63 115.31 117.21 1x8l h LEU 82 Ca 0.02 -0.20 0.06 0.00 0.09 0.00 0.00 57.88 57.85 1x8l h LEU 82 Cb 0.75 -0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.45 1x8l h LEU 82 CO 0.05 0.21 0.18 0.58 0.09 0.00 0.00 178.44 179.54 1x8l h VAL 83 N -0.20 0.87 -0.54 1.22 2.07 -1.11 -1.42 116.25 117.14 1x8l h VAL 83 Ca 0.00 -0.12 -0.05 0.00 0.82 0.00 0.00 66.70 67.35 1x8l h VAL 83 Cb 0.20 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 30.43 1x8l h VAL 83 CO -0.00 0.07 0.13 -0.25 0.02 0.00 0.00 177.57 177.54 1x8l h TRP 84 N 0.36 0.91 -0.38 1.57 7.01 -1.06 -2.13 115.95 122.22 1x8l h TRP 84 Ca 0.21 -0.11 -0.11 0.00 2.11 0.00 0.00 58.89 61.00 1x8l h TRP 84 Cb 0.20 -0.26 -0.01 0.00 -2.10 0.00 0.00 29.16 26.99 1x8l h TRP 84 CO -0.15 0.79 -0.17 -0.07 -2.79 0.00 0.00 178.44 176.05 1x8l h LEU 85 N 0.76 0.81 -0.19 0.65 3.38 -1.02 -1.17 115.31 118.54 1x8l h LEU 85 Ca 0.17 -0.40 -0.01 0.00 0.09 0.00 0.00 57.88 57.73 1x8l h LEU 85 Cb 0.33 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1x8l h LEU 85 CO 0.00 1.03 0.09 0.40 0.09 0.00 0.00 178.44 180.06 1x8l h ILE 86 N 0.59 1.13 0.00 1.22 2.04 -1.20 0.36 117.51 121.65 1x8l h ILE 86 Ca 0.09 -0.36 -0.04 0.00 1.00 0.00 0.00 64.86 65.55 1x8l h ILE 86 Cb 0.72 1.02 -0.01 0.00 -0.74 0.00 0.00 36.82 37.82 1x8l h ILE 86 CO 0.05 0.12 -0.18 -0.33 0.00 0.00 0.00 178.15 177.82 1x8l h GLU 87 N 0.18 0.00 -1.00 2.37 4.39 -1.38 -2.77 114.58 116.37 1x8l h GLU 87 Ca 0.06 0.00 -0.52 0.00 0.34 0.00 0.00 59.36 59.25 1x8l h GLU 87 Cb 0.11 0.00 -0.30 0.00 -0.10 0.00 0.00 28.75 28.46 1x8l h GLU 87 CO -0.01 0.18 0.66 0.09 -1.16 0.00 0.00 179.01 178.77 1x8l n ASN 88 N -4.26 3.93 -3.90 1.42 3.02 -0.45 -4.93 115.26 110.10 1x8l n ASN 88 Ca -0.02 -3.59 -0.30 0.00 -0.03 0.00 0.00 54.58 50.64 1x8l n ASN 88 Cb 0.24 -0.84 0.03 0.00 -0.61 0.00 0.00 39.78 38.60 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 -1.11 -4.96 -4.07 6.41 10.43 -0.85 -2.05 116.55 120.35 1x8l n ASP 89 Ca 0.59 -0.76 -0.33 0.00 2.57 0.00 0.00 54.79 56.86 1x8l n ASP 89 Cb 1.61 -3.96 -0.01 0.00 1.84 0.00 0.00 41.12 40.60 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 -4.72 -2.09 -4.56 0.64 4.77 0.12 -4.87 117.00 106.29 1x8l n LEU 90 Ca 0.04 -0.93 -0.42 0.00 -0.03 0.00 0.00 56.01 54.68 1x8l n LEU 90 Cb 0.53 -2.28 -0.02 0.00 -2.33 0.00 0.00 43.42 39.32 1x8l n LEU 90 CO 0.75 0.37 1.63 0.21 -1.33 0.00 0.00 177.39 179.02 1x8l s ASN 91 N -3.45 6.64 0.41 -1.43 3.84 -0.87 -4.82 114.94 115.26 1x8l s ASN 91 Ca 0.61 -1.86 0.12 0.00 0.21 0.00 0.00 52.86 51.94 1x8l s ASN 91 Cb -0.32 -2.56 0.88 0.00 -0.55 0.00 0.00 41.25 38.69 1x8l s ASN 91 CO 0.89 -1.35 1.94 -0.26 -2.79 0.00 0.00 177.10 175.52 1x8l h PHE 92 N 8.92 0.09 -0.18 0.43 -1.00 -1.90 -2.76 116.94 120.53 1x8l h PHE 92 Ca 0.29 -0.01 -0.01 0.00 2.81 0.00 0.00 57.97 61.05 1x8l h PHE 92 Cb 0.96 -0.02 -0.01 0.00 3.61 0.00 0.00 35.95 40.49 1x8l h PHE 92 CO 1.32 0.28 0.07 1.49 -1.61 0.00 0.00 178.31 179.86 1x8l h GLU 93 N 0.08 0.28 0.00 1.51 4.57 -2.01 -2.95 114.58 116.05 1x8l h GLU 93 Ca 0.01 -0.05 -0.08 0.00 -1.18 0.00 0.00 59.36 58.06 1x8l h GLU 93 Cb 0.39 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 28.93 1x8l h GLU 93 CO 0.03 0.35 -0.38 0.00 -1.18 0.00 0.00 179.01 177.83 1x8l h ALA 94 N 0.91 1.18 0.00 2.92 0.00 -1.92 -1.91 119.26 120.44 1x8l h ALA 94 Ca 0.06 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1x8l h ALA 94 Cb 0.18 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1x8l h ALA 94 CO -0.00 0.47 0.00 0.00 0.00 0.00 0.00 179.25 179.72 1x8l n ALA 95 N -2.38 1.62 0.53 0.00 0.00 -1.06 -3.10 120.51 116.12 1x8l n ALA 95 Ca -0.01 -0.05 0.06 0.00 0.00 0.00 0.00 53.44 53.44 1x8l n ALA 95 Cb 0.45 -1.19 0.30 0.00 0.00 0.00 0.00 19.45 19.01 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 -1.41 0.09 -2.42 0.00 5.02 -0.72 -4.76 118.16 113.97 1x8l n LYS 96 Ca 0.04 0.22 -0.33 0.00 -2.02 0.00 0.00 58.31 56.23 1x8l n LYS 96 Cb 0.12 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.60 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 -2.80 4.13 0.39 -0.18 -4.23 -1.18 -4.66 115.64 107.10 1x8l s THR 97 Ca 0.09 1.15 -0.25 0.00 -1.18 0.00 0.00 61.69 61.49 1x8l s THR 97 Cb 0.09 -3.54 -0.11 0.00 1.34 0.00 0.00 72.50 70.28 1x8l s THR 97 CO 0.22 -0.46 1.10 -1.22 -0.54 0.00 0.00 174.62 173.72 1x8l n TYR 98 N -1.37 1.52 0.24 3.99 0.53 -1.26 -4.85 117.16 115.95 1x8l n TYR 98 Ca 0.08 0.57 0.06 0.00 -1.02 0.00 0.00 57.90 57.59 1x8l n TYR 98 Cb 0.53 -2.28 0.56 0.00 -1.03 0.00 0.00 39.34 37.12 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 1.83 0.00 0.00 -0.72 1.85 -1.53 -2.19 114.93 114.17 1x8l h MET 99 Ca -0.45 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 58.64 1x8l h MET 99 Cb 1.32 0.00 0.00 0.00 0.43 0.00 0.00 31.60 33.35 1x8l h MET 99 CO 0.59 0.11 0.00 0.66 -0.40 0.00 0.00 176.91 177.87 1x8l h SER 100 N 0.00 0.00 0.52 1.39 4.64 -1.84 -1.61 113.55 116.66 1x8l h SER 100 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1x8l h SER 100 Cb 0.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 1x8l h SER 100 CO 0.01 0.00 -0.84 0.18 -0.87 0.00 0.00 176.83 175.32 1x8l n LEU 101 N -2.81 0.63 -0.02 5.97 4.77 -0.84 -4.33 117.00 120.37 1x8l n LEU 101 Ca 0.02 0.02 0.01 0.00 -0.03 0.00 0.00 56.01 56.02 1x8l n LEU 101 Cb 0.33 -0.14 -0.13 0.00 -2.33 0.00 0.00 43.42 41.14 1x8l n LEU 101 CO 0.26 0.04 -0.72 0.54 -1.33 0.00 0.00 177.39 176.19 1x8l n ARG 102 N -1.89 0.66 -4.83 3.23 1.74 -0.94 -4.93 116.66 109.70 1x8l n ARG 102 Ca 0.03 0.01 -0.29 0.00 -0.77 0.00 0.00 57.85 56.83 1x8l n ARG 102 Cb 0.41 -1.62 -0.15 0.00 -1.02 0.00 0.00 32.46 30.09 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 -2.98 2.16 -0.18 -1.55 1.51 -0.65 -4.46 117.35 111.20 1x8l s TYR 103 Ca -0.07 -0.40 -0.18 0.00 -1.01 0.00 0.00 57.07 55.41 1x8l s TYR 103 Cb 0.09 -1.29 -0.04 0.00 -0.11 0.00 0.00 41.96 40.61 1x8l s TYR 103 CO 0.85 0.12 0.48 0.42 -1.11 0.00 0.00 175.55 176.30 1x8l s ILE 104 N -0.80 5.15 -0.70 2.71 1.01 -0.39 -4.65 121.20 123.52 1x8l s ILE 104 Ca 0.10 0.89 -0.22 0.00 0.00 0.00 0.00 60.65 61.43 1x8l s ILE 104 Cb -0.10 -3.81 0.08 0.00 0.01 0.00 0.00 42.46 38.65 1x8l s ILE 104 CO 0.02 0.24 0.98 -0.47 0.00 0.00 0.00 174.94 175.70 1x8l s TYR 105 N 1.28 2.77 0.17 3.97 6.04 -1.26 -0.29 117.35 130.02 1x8l s TYR 105 Ca 0.23 -0.72 -0.16 0.00 0.04 0.00 0.00 57.07 56.46 1x8l s TYR 105 Cb -0.15 -4.28 0.12 0.00 -1.04 0.00 0.00 41.96 36.61 1x8l s TYR 105 CO 0.09 -1.60 1.69 1.25 -1.54 0.00 0.00 175.55 175.44 1x8l h LEU 106 N 11.13 -0.22 -2.68 6.97 5.85 -1.32 -2.90 115.31 132.12 1x8l h LEU 106 Ca -0.21 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.61 1x8l h LEU 106 Cb 1.06 0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.29 1x8l h LEU 106 CO 1.17 -0.07 0.00 -0.90 -0.34 0.00 0.00 178.44 178.30 1x8l n ASP 107 N -5.23 3.60 -0.29 1.25 5.75 -1.26 -3.77 116.55 116.61 1x8l n ASP 107 Ca 0.03 -1.98 0.17 0.00 -0.01 0.00 0.00 54.79 52.99 1x8l n ASP 107 Cb 0.22 -0.38 0.44 0.00 -1.03 0.00 0.00 41.12 40.37 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 3.76 1.21 1.82 6.12 0.00 -1.86 -2.98 103.07 111.13 1x8l h GLY 108 Ca 0.00 -0.26 -0.03 0.00 0.00 0.00 0.00 47.33 47.05 1x8l h GLY 108 CO 0.00 -0.01 -0.02 0.27 0.00 0.00 0.00 176.54 176.78 1x8l h PHE 109 N 0.56 0.24 0.00 5.60 -5.15 -1.80 -3.28 116.94 113.10 1x8l h PHE 109 Ca 0.51 -0.01 -0.01 0.00 -0.20 0.00 0.00 57.97 58.25 1x8l h PHE 109 Cb 1.05 -0.07 -0.00 0.00 0.22 0.00 0.00 35.95 37.15 1x8l h PHE 109 CO -0.00 0.27 -0.06 0.00 -2.00 0.00 0.00 178.31 176.51 1x8l h MET 110 N 0.24 0.00 0.00 6.09 -0.00 -1.81 -1.88 114.93 117.57 1x8l h MET 110 Ca 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.76 1x8l h MET 110 Cb 0.19 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.79 1x8l h MET 110 CO 0.01 0.06 0.00 0.97 -0.00 0.00 0.00 176.91 177.95 1x8l h ILE 111 N 0.00 0.00 -3.34 -0.10 2.10 -1.81 -3.38 117.51 110.99 1x8l h ILE 111 Ca -0.00 -0.23 -0.65 0.00 1.08 0.00 0.00 64.86 65.06 1x8l h ILE 111 Cb 0.37 1.07 -0.26 0.00 -1.09 0.00 0.00 36.82 36.91 1x8l h ILE 111 CO 0.01 0.00 -0.73 -0.47 -1.08 0.00 0.00 178.15 175.88 1x8l s TYR 112 N -3.66 2.91 -0.41 2.19 5.04 -0.71 -4.70 117.35 118.01 1x8l s TYR 112 Ca -0.00 -0.67 -0.09 0.00 -2.44 0.00 0.00 57.07 53.88 1x8l s TYR 112 Cb 0.09 -1.96 0.08 0.00 0.35 0.00 0.00 41.96 40.53 1x8l s TYR 112 CO 0.41 -0.28 0.25 0.34 -1.34 0.00 0.00 175.55 174.92 1x8l s ASP 113 N 0.73 5.59 0.60 4.32 3.68 -1.26 -4.84 116.67 125.49 1x8l s ASP 113 Ca -0.04 -1.53 0.29 0.00 2.13 0.00 0.00 52.55 53.40 1x8l s ASP 113 Cb -0.15 -1.97 1.56 0.00 -1.45 0.00 0.00 42.92 40.91 1x8l s ASP 113 CO 0.02 -0.53 1.98 -0.65 0.13 0.00 0.00 175.17 176.12 1x8l h PRO 114 N 8.37 0.00 0.00 4.34 0.11 -1.96 0.21 132.00 143.06 1x8l h PRO 114 Ca -0.22 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.84 1x8l h PRO 114 Cb 1.08 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 1x8l h PRO 114 CO 0.75 0.00 -0.21 1.49 -0.21 0.00 0.00 178.00 179.82 1x8l h GLU 115 N 0.00 0.00 -0.66 1.05 4.81 -2.05 -3.04 114.58 114.68 1x8l h GLU 115 Ca 0.15 0.00 -0.30 0.00 -0.13 0.00 0.00 59.36 59.07 1x8l h GLU 115 Cb 0.87 0.00 -0.18 0.00 0.63 0.00 0.00 28.75 30.07 1x8l h GLU 115 CO -0.00 0.21 0.27 1.63 -0.73 0.00 0.00 179.01 180.39 1x8l n LYS 116 N -4.04 2.42 -0.36 1.92 5.02 0.72 -4.79 118.16 119.07 1x8l n LYS 116 Ca -0.02 -3.08 0.01 0.00 -2.02 0.00 0.00 58.31 53.21 1x8l n LYS 116 Cb 0.28 -2.03 0.08 0.00 -0.02 0.00 0.00 35.03 33.34 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 1.37 -0.01 0.00 1.97 4.15 -1.56 -1.49 115.11 119.53 1x8l h GLN 117 Ca 0.37 0.00 -0.03 0.00 0.77 0.00 0.00 58.65 59.76 1x8l h GLN 117 Cb 2.24 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 29.92 1x8l h GLN 117 CO 0.72 -0.01 -0.15 0.93 -1.93 0.00 0.00 178.83 178.40 1x8l h GLU 118 N -0.01 0.00 0.00 1.69 3.07 -1.89 -2.90 114.58 114.54 1x8l h GLU 118 Ca 0.39 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.25 1x8l h GLU 118 Cb 0.64 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.55 1x8l h GLU 118 CO -0.97 0.15 0.00 0.93 -1.40 0.00 0.00 179.01 177.71 1x8l h GLU 119 N 0.00 0.00 -0.03 2.33 5.08 -1.66 -3.38 114.58 116.92 1x8l h GLU 119 Ca -0.00 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 58.10 1x8l h GLU 119 Cb 0.26 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.53 1x8l h GLU 119 CO 0.02 0.00 -0.99 1.88 -1.00 0.00 0.00 179.01 178.92 1x8l h TYR 120 N 0.00 1.05 0.00 4.33 -1.99 -1.58 -3.19 116.97 115.59 1x8l h TYR 120 Ca 0.00 -0.54 -0.03 0.00 2.00 0.00 0.00 58.73 60.15 1x8l h TYR 120 Cb 0.91 -0.13 -0.00 0.00 2.00 0.00 0.00 36.73 39.50 1x8l h TYR 120 CO 0.00 1.38 -0.16 -2.95 -0.00 0.00 0.00 178.16 176.43 1x8l h ASN 121 N 0.43 0.00 0.00 3.88 7.08 -1.77 -3.01 115.58 122.19 1x8l h ASN 121 Ca -0.11 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.11 1x8l h ASN 121 Cb 1.63 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.87 1x8l h ASN 121 CO 0.19 0.16 0.02 0.44 -2.08 0.00 0.00 177.43 176.16 1x8l h ASP 122 N 0.00 0.00 1.11 6.14 5.19 -1.74 -1.63 116.42 125.49 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 0.73 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.24 1x8l h ASP 122 CO 0.02 0.00 -0.08 -0.38 -3.12 0.00 0.00 179.24 175.68 1x8l n ILE 123 N -2.79 0.23 -3.28 0.35 2.08 -1.14 -4.85 119.36 109.96 1x8l n ILE 123 Ca -0.02 -0.12 -0.37 0.00 0.56 0.00 0.00 62.75 62.81 1x8l n ILE 123 Cb 0.07 -0.44 -0.06 0.00 -0.75 0.00 0.00 39.64 38.46 1x8l n ILE 123 CO 0.00 0.00 0.00 -0.76 0.56 0.00 0.00 176.55 176.35 1x8l s LEU 124 N -3.60 4.40 0.45 1.39 1.43 -0.61 -4.98 118.68 117.16 1x8l s LEU 124 Ca 0.12 1.20 0.23 0.00 -1.03 0.00 0.00 54.13 54.65 1x8l s LEU 124 Cb 0.16 -3.20 1.06 0.00 0.03 0.00 0.00 46.19 44.25 1x8l s LEU 124 CO 0.58 0.15 1.91 1.55 0.23 0.00 0.00 176.35 180.76 1x8l h PRO 125 N 3.86 0.00 -2.10 1.29 0.14 -1.88 -3.36 132.00 129.95 1x8l h PRO 125 Ca -0.49 0.00 -0.57 0.00 0.14 0.00 0.00 66.00 65.08 1x8l h PRO 125 Cb 1.20 0.00 -0.40 0.00 0.14 0.00 0.00 31.00 31.94 1x8l h PRO 125 CO 0.65 0.23 -0.98 0.09 0.14 0.00 0.00 178.00 178.13 1x8l n ASN 126 N -3.61 0.87 0.27 1.44 4.13 -1.26 -4.97 115.26 112.13 1x8l n ASN 126 Ca -0.01 -2.82 0.13 0.00 1.68 0.00 0.00 54.58 53.56 1x8l n ASN 126 Cb 0.36 -0.64 0.76 0.00 -1.54 0.00 0.00 39.78 38.72 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 4.23 0.00 0.00 3.52 0.11 -1.82 -2.62 132.00 135.43 1x8l h PRO 127 Ca 0.12 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.23 1x8l h PRO 127 Cb 0.84 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.95 1x8l h PRO 127 CO 0.53 0.10 -0.00 1.05 -0.21 0.00 0.00 178.00 179.47 1x8l h GLU 128 N 0.00 0.00 -0.67 1.05 9.09 -1.95 -3.00 114.58 119.09 1x8l h GLU 128 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1x8l h GLU 128 Cb 0.27 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.37 1x8l h GLU 128 CO 0.01 0.00 0.00 0.09 0.05 0.00 0.00 179.01 179.16 1x8l n ASN 129 N -3.45 4.64 -4.77 3.06 3.02 -0.99 -4.93 115.26 111.85 1x8l n ASN 129 Ca -0.03 -2.40 -0.40 0.00 -0.03 0.00 0.00 54.58 51.72 1x8l n ASN 129 Cb 0.08 -0.57 -0.03 0.00 -0.61 0.00 0.00 39.78 38.65 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 -1.74 4.45 -0.62 3.41 1.43 -1.14 -4.69 118.68 119.78 1x8l s LEU 130 Ca 0.51 2.54 -0.27 0.00 -1.03 0.00 0.00 54.13 55.87 1x8l s LEU 130 Cb 0.32 -3.66 0.01 0.00 0.03 0.00 0.00 46.19 42.89 1x8l s LEU 130 CO 0.25 -0.42 1.43 -0.62 0.23 0.00 0.00 176.35 177.22 1x8l s ASP 131 N -0.64 6.02 0.18 2.29 -1.08 -0.91 -4.90 116.67 117.63 1x8l s ASP 131 Ca 0.48 0.07 -0.06 0.00 -0.52 0.00 0.00 52.55 52.51 1x8l s ASP 131 Cb -0.37 -2.55 0.08 0.00 -1.46 0.00 0.00 42.92 38.62 1x8l s ASP 131 CO 0.48 -1.84 1.52 0.24 0.52 0.00 0.00 175.17 176.10 1x8l h MET 132 N 11.28 0.74 -0.33 4.34 2.86 -1.93 0.46 114.93 132.35 1x8l h MET 132 Ca -0.27 -0.40 0.03 0.00 -2.06 0.00 0.00 59.70 57.00 1x8l h MET 132 Cb 1.09 0.02 -0.03 0.00 0.06 0.00 0.00 31.60 32.73 1x8l h MET 132 CO 1.21 1.02 0.14 1.49 1.06 0.00 0.00 176.91 181.83 1x8l h GLU 133 N 0.60 0.28 -0.06 1.72 4.81 -1.99 0.23 114.58 120.18 1x8l h GLU 133 Ca 0.04 -0.02 -0.16 0.00 -0.13 0.00 0.00 59.36 59.10 1x8l h GLU 133 Cb 0.97 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.28 1x8l h GLU 133 CO 0.09 0.19 -0.66 0.00 -0.73 0.00 0.00 179.01 177.90 1x8l h ARG 134 N 0.29 0.23 -0.17 1.92 3.08 -1.93 -1.86 114.38 115.95 1x8l h ARG 134 Ca 0.14 -0.17 -0.05 0.00 0.07 0.00 0.00 59.98 59.97 1x8l h ARG 134 Cb 0.09 0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.17 1x8l h ARG 134 CO -0.13 0.81 -0.09 -0.92 -1.07 0.00 0.00 179.97 178.56 1x8l h TYR 135 N 0.16 0.42 -0.40 3.04 3.20 -0.44 -1.98 116.97 120.98 1x8l h TYR 135 Ca -0.01 -0.11 -0.03 0.00 3.14 0.00 0.00 58.73 61.72 1x8l h TYR 135 Cb 1.18 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 39.34 1x8l h TYR 135 CO 0.02 0.69 0.10 -0.07 -1.64 0.00 0.00 178.16 177.26 1x8l h LEU 136 N 0.03 0.53 -0.99 2.82 3.38 -0.51 -1.37 115.31 119.21 1x8l h LEU 136 Ca 0.04 -0.07 -0.08 0.00 0.09 0.00 0.00 57.88 57.85 1x8l h LEU 136 Cb 0.58 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 1x8l h LEU 136 CO 0.03 0.53 -0.10 1.23 0.09 0.00 0.00 178.44 180.21 1x8l h GLY 137 N 0.79 0.66 0.80 0.83 0.00 -1.19 0.04 103.07 105.00 1x8l h GLY 137 Ca 0.13 -0.47 -0.06 0.00 0.00 0.00 0.00 47.33 46.93 1x8l h GLY 137 CO -0.01 0.43 -0.11 -2.00 0.00 0.00 0.00 176.54 174.86 1x8l h LEU 138 N 0.57 0.43 -0.28 3.11 5.85 -0.67 -1.58 115.31 122.74 1x8l h LEU 138 Ca 0.10 -0.43 0.04 0.00 0.84 0.00 0.00 57.88 58.44 1x8l h LEU 138 Cb 0.52 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.39 1x8l h LEU 138 CO 0.03 0.76 0.06 -0.07 -0.34 0.00 0.00 178.44 178.88 1x8l h LEU 139 N 0.10 0.02 -0.21 2.25 3.38 -1.04 -0.87 115.31 118.94 1x8l h LEU 139 Ca 0.04 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 1x8l h LEU 139 Cb 0.61 0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 1x8l h LEU 139 CO 0.03 0.04 0.12 -0.08 0.09 0.00 0.00 178.44 178.64 1x8l h GLU 140 N 0.16 0.28 -0.79 1.13 4.81 -0.97 -1.35 114.58 117.87 1x8l h GLU 140 Ca 0.13 -0.03 0.01 0.00 -0.13 0.00 0.00 59.36 59.33 1x8l h GLU 140 Cb 0.13 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.42 1x8l h GLU 140 CO -0.17 0.26 0.51 -0.92 -0.73 0.00 0.00 179.01 177.96 1x8l h TYR 141 N 0.23 1.00 0.00 0.92 3.20 -1.17 -2.19 116.97 118.95 1x8l h TYR 141 Ca 0.07 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.96 1x8l h TYR 141 Cb 0.06 -0.34 0.00 0.00 1.54 0.00 0.00 36.73 37.99 1x8l h TYR 141 CO -0.04 0.63 0.00 0.77 -1.64 0.00 0.00 178.16 177.88 1x8l h SER 142 N 1.07 0.00 1.21 -2.11 0.02 -0.69 -2.52 113.55 110.53 1x8l h SER 142 Ca 0.29 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.24 1x8l h SER 142 Cb -0.11 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.43 1x8l h SER 142 CO -0.06 0.00 0.00 0.28 -1.14 0.00 0.00 176.83 175.91 1x8l h SER 143 N 0.00 0.00 -3.38 3.07 0.02 -0.59 -3.41 113.55 109.26 1x8l h SER 143 Ca 0.00 0.00 -0.57 0.00 -0.84 0.00 0.00 61.79 60.38 1x8l h SER 143 Cb 0.62 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 63.10 1x8l h SER 143 CO 0.00 0.00 0.86 -0.13 -1.14 0.00 0.00 176.83 176.42 1x8l s ARG 144 N -3.58 4.00 0.37 3.45 0.52 -0.95 -4.99 118.95 117.77 1x8l s ARG 144 Ca 0.02 0.98 -0.28 0.00 -0.52 0.00 0.00 55.73 55.94 1x8l s ARG 144 Cb 0.08 -3.77 -0.11 0.00 0.52 0.00 0.00 34.95 31.67 1x8l s ARG 144 CO 0.57 -0.99 1.39 -2.30 0.02 0.00 0.00 175.30 173.98 1x8l n PRO 145 N 7.05 2.37 -0.30 3.54 -0.02 -1.26 -4.78 135.00 141.60 1x8l n PRO 145 Ca 0.12 0.83 0.11 0.00 -2.02 0.00 0.00 63.50 62.54 1x8l n PRO 145 Cb 0.47 -2.51 0.28 0.00 -0.02 0.00 0.00 33.50 31.73 1x8l n PRO 145 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1x8l h GLY 146 N 2.67 1.48 0.99 -1.23 0.00 -1.88 -1.99 103.07 103.12 1x8l h GLY 146 Ca -0.49 -0.19 0.01 0.00 0.00 0.00 0.00 47.33 46.66 1x8l h GLY 146 CO 0.63 -0.19 0.62 1.48 0.00 0.00 0.00 176.54 179.07 1x8l h SER 147 N 0.47 1.07 0.37 0.19 4.64 -1.90 -2.19 113.55 116.20 1x8l h SER 147 Ca 0.53 -0.03 -0.13 0.00 -0.47 0.00 0.00 61.79 61.69 1x8l h SER 147 Cb 0.93 -0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 62.74 1x8l h SER 147 CO -0.48 0.77 -0.54 0.77 -0.87 0.00 0.00 176.83 176.48 1x8l h SER 148 N 1.26 0.21 -0.22 4.97 4.64 -1.73 -1.48 113.55 121.20 1x8l h SER 148 Ca 0.35 -0.11 -0.01 0.00 -0.47 0.00 0.00 61.79 61.55 1x8l h SER 148 Cb -0.13 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 61.89 1x8l h SER 148 CO -0.08 0.71 0.09 -0.07 -0.87 0.00 0.00 176.83 176.62 1x8l h LEU 149 N 0.15 0.30 -0.37 5.97 3.38 -1.21 -2.18 115.31 121.34 1x8l h LEU 149 Ca 0.00 -0.15 0.03 0.00 0.09 0.00 0.00 57.88 57.85 1x8l h LEU 149 Cb 1.01 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.65 1x8l h LEU 149 CO 0.08 0.37 0.19 -0.07 0.09 0.00 0.00 178.44 179.10 1x8l h LEU 150 N 0.21 0.28 -2.03 1.67 3.38 -1.20 -2.81 115.31 114.81 1x8l h LEU 150 Ca 0.07 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 1x8l h LEU 150 Cb 0.16 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 40.87 1x8l h LEU 150 CO -0.01 0.20 -0.02 0.00 0.09 0.00 0.00 178.44 178.71 1x8l h ALA 151 N 1.19 1.03 0.00 1.53 0.00 -1.10 -2.67 119.26 119.25 1x8l h ALA 151 Ca 0.16 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1x8l h ALA 151 Cb 0.06 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1x8l h ALA 151 CO -0.11 0.02 0.00 0.00 0.00 0.00 0.00 179.25 179.17 1x8l h ALA 152 N 1.98 1.00 -2.37 0.00 0.00 -1.12 -3.44 119.26 115.32 1x8l h ALA 152 Ca -0.00 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 54.36 1x8l h ALA 152 Cb 0.32 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1x8l h ALA 152 CO 0.00 0.00 0.72 0.08 0.00 0.00 0.00 179.25 180.05 1x8l s VAL 153 N -3.16 4.04 0.66 0.00 1.01 -1.01 -4.99 120.40 116.95 1x8l s VAL 153 Ca 0.09 1.40 -0.17 0.00 0.00 0.00 0.00 61.98 63.30 1x8l s VAL 153 Cb 0.11 -3.90 -0.01 0.00 0.00 0.00 0.00 36.38 32.58 1x8l s VAL 153 CO 0.58 0.02 1.22 -2.65 0.00 0.00 0.00 175.10 174.27 1x8l n PRO 154 N 5.00 0.95 0.30 2.72 -0.02 -1.26 -4.89 135.00 137.80 1x8l n PRO 154 Ca 0.11 0.38 0.20 0.00 -2.02 0.00 0.00 63.50 62.17 1x8l n PRO 154 Cb 0.45 -2.45 0.98 0.00 -0.02 0.00 0.00 33.50 32.46 1x8l n PRO 154 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1x8l h PRO 155 N 0.33 0.00 -0.17 0.52 0.13 -1.95 -2.41 132.00 128.45 1x8l h PRO 155 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1x8l h PRO 155 Cb 1.34 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.47 1x8l h PRO 155 CO 0.52 0.00 0.00 0.25 -0.23 0.00 0.00 178.00 178.54 1x8l n THR 156 N -2.98 0.22 -5.10 1.56 -2.24 -1.26 -4.73 114.28 99.74 1x8l n THR 156 Ca -0.02 -0.27 -0.32 0.00 -2.27 0.00 0.00 64.05 61.18 1x8l n THR 156 Cb 0.15 0.15 -0.17 0.00 -2.10 0.00 0.00 70.33 68.36 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 -1.78 2.95 0.22 -0.78 2.12 -0.91 -5.11 118.70 115.40 1x8l s GLU 157 Ca 0.24 -0.84 -0.31 0.00 0.36 0.00 0.00 54.97 54.42 1x8l s GLU 157 Cb 0.12 -2.25 -0.10 0.00 0.26 0.00 0.00 34.13 32.16 1x8l s GLU 157 CO 0.18 0.14 1.52 0.21 -0.54 0.00 0.00 175.26 176.78 1x8l s LYS 158 N 0.43 4.22 -0.31 4.30 2.20 -1.26 -4.77 119.74 124.55 1x8l s LYS 158 Ca -0.17 2.37 -0.18 0.00 -0.36 0.00 0.00 55.97 57.63 1x8l s LYS 158 Cb -0.18 -3.12 -0.01 0.00 -1.51 0.00 0.00 37.83 33.01 1x8l s LYS 158 CO 0.07 -0.54 0.52 1.03 -0.36 0.00 0.00 175.35 176.08 1x8l s ARG 159 N 0.31 3.85 -0.25 4.03 0.52 -1.26 -5.04 118.95 121.10 1x8l s ARG 159 Ca 0.65 0.09 -0.09 0.00 -0.52 0.00 0.00 55.73 55.86 1x8l s ARG 159 Cb -0.44 -3.73 -0.04 0.00 0.52 0.00 0.00 34.95 31.26 1x8l s ARG 159 CO 0.38 -0.51 0.12 -0.06 0.02 0.00 0.00 175.30 175.25 1x8l s PHE 160 N 2.39 3.17 -0.10 -0.53 0.40 -1.26 -1.96 117.98 120.08 1x8l s PHE 160 Ca 0.20 -0.13 0.04 0.00 -0.60 0.00 0.00 56.93 56.44 1x8l s PHE 160 Cb -0.15 -2.27 0.00 0.00 0.51 0.00 0.00 43.02 41.11 1x8l s PHE 160 CO 0.11 -0.20 -0.23 0.08 0.70 0.00 0.00 175.22 175.68 1x8l s VAL 161 N 1.48 1.99 -0.11 -0.44 1.01 0.35 -1.26 120.40 123.42 1x8l s VAL 161 Ca 0.06 -0.98 -0.02 0.00 0.00 0.00 0.00 61.98 61.03 1x8l s VAL 161 Cb -0.15 -1.72 -0.03 0.00 0.00 0.00 0.00 36.38 34.48 1x8l s VAL 161 CO 0.06 0.55 -0.02 -0.75 0.00 0.00 0.00 175.10 174.93 1x8l s LYS 162 N 0.33 3.27 -0.09 2.72 2.20 0.60 -0.21 119.74 128.56 1x8l s LYS 162 Ca -0.18 -0.47 -0.15 0.00 -0.36 0.00 0.00 55.97 54.81 1x8l s LYS 162 Cb -0.18 -2.83 0.03 0.00 -1.51 0.00 0.00 37.83 33.34 1x8l s LYS 162 CO 0.08 0.50 0.38 -0.08 -0.36 0.00 0.00 175.35 175.87 1x8l s THR 163 N -0.33 0.02 -1.81 3.43 -1.32 -0.65 -0.82 115.64 114.16 1x8l s THR 163 Ca 0.06 -0.18 0.19 0.00 -1.21 0.00 0.00 61.69 60.55 1x8l s THR 163 Cb -0.12 -0.60 0.44 0.00 -1.51 0.00 0.00 72.50 70.70 1x8l s THR 163 CO 0.02 -0.10 1.36 1.41 -2.21 0.00 0.00 174.62 175.10 1x8l n HIS 164 N 2.15 0.60 -2.19 9.09 8.25 -1.26 -2.16 115.22 129.70 1x8l n HIS 164 Ca -0.17 -0.37 -0.40 0.00 -0.26 0.00 0.00 57.72 56.52 1x8l n HIS 164 Cb 0.57 -0.01 -0.02 0.00 1.12 0.00 0.00 29.99 31.65 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 -1.15 4.36 0.69 2.41 1.43 -1.26 -4.66 118.68 120.49 1x8l s LEU 165 Ca 0.36 2.55 -0.14 0.00 -1.03 0.00 0.00 54.13 55.87 1x8l s LEU 165 Cb 0.20 -3.76 0.01 0.00 0.03 0.00 0.00 46.19 42.67 1x8l s LEU 165 CO 0.27 -0.56 1.10 -2.16 0.23 0.00 0.00 176.35 175.23 1x8l s PRO 166 N -1.92 2.68 0.40 1.29 0.04 -1.26 -4.80 135.00 131.44 1x8l s PRO 166 Ca 0.51 1.31 0.09 0.00 0.04 0.00 0.00 61.00 62.96 1x8l s PRO 166 Cb -0.36 -1.94 0.88 0.00 0.04 0.00 0.00 34.50 33.11 1x8l s PRO 166 CO 0.48 -1.33 1.99 -0.07 0.04 0.00 0.00 177.00 178.10 1x8l h LEU 167 N -0.27 0.51 -0.71 -3.56 3.38 -1.94 -2.10 115.31 110.61 1x8l h LEU 167 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.51 1x8l h LEU 167 Cb 1.24 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1x8l h LEU 167 CO 0.54 0.33 0.00 -1.54 0.09 0.00 0.00 178.44 177.86 1x8l n SER 168 N -4.48 0.45 -0.15 -0.43 3.41 -1.26 -2.04 113.62 109.14 1x8l n SER 168 Ca 0.09 0.65 0.11 0.00 -0.26 0.00 0.00 58.87 59.45 1x8l n SER 168 Cb 0.25 -0.73 0.01 0.00 -0.26 0.00 0.00 64.21 63.48 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 -2.04 1.19 -4.91 1.04 4.77 -0.79 -4.95 117.00 111.31 1x8l n LEU 169 Ca 0.01 -0.47 -0.22 0.00 -0.03 0.00 0.00 56.01 55.31 1x8l n LEU 169 Cb 0.14 -0.05 -0.01 0.00 -2.33 0.00 0.00 43.42 41.17 1x8l n LEU 169 CO 0.14 0.26 0.06 -0.04 -1.33 0.00 0.00 177.39 176.47 1x8l s MET 170 N -2.83 2.46 0.28 3.23 -1.94 -0.86 -3.62 119.30 116.01 1x8l s MET 170 Ca 0.12 -1.64 -0.30 0.00 -1.71 0.00 0.00 55.69 52.16 1x8l s MET 170 Cb 0.17 -2.37 -0.12 0.00 2.01 0.00 0.00 34.83 34.53 1x8l s MET 170 CO 0.74 -0.37 1.62 -2.30 -0.01 0.00 0.00 175.02 174.70 1x8l n PRO 171 N -1.69 2.73 -2.06 2.03 -0.02 -1.21 -4.85 135.00 129.91 1x8l n PRO 171 Ca 0.04 0.97 -0.37 0.00 -2.02 0.00 0.00 63.50 62.13 1x8l n PRO 171 Cb 0.62 -2.77 0.02 0.00 -0.02 0.00 0.00 33.50 31.35 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 -0.20 3.27 -1.39 0.52 0.04 -1.26 -1.96 135.00 134.01 1x8l s PRO 172 Ca 0.66 1.87 0.00 0.00 0.04 0.00 0.00 61.00 63.57 1x8l s PRO 172 Cb -0.50 -2.14 0.00 0.00 0.04 0.00 0.00 34.50 31.91 1x8l s PRO 172 CO 0.46 -0.98 0.00 0.09 0.04 0.00 0.00 177.00 176.60 1x8l n ASN 173 N -1.14 -4.97 0.00 6.66 3.02 -1.26 -4.88 115.26 112.70 1x8l n ASN 173 Ca 0.11 0.32 0.09 0.00 -0.03 0.00 0.00 54.58 55.08 1x8l n ASN 173 Cb 0.48 -3.62 0.51 0.00 -0.61 0.00 0.00 39.78 36.55 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 0.04 0.36 0.00 3.52 -0.00 -1.76 -2.09 114.93 115.00 1x8l h MET 174 Ca -0.27 -0.02 0.00 0.00 -0.00 0.00 0.00 59.70 59.41 1x8l h MET 174 Cb 0.98 -0.08 0.00 0.00 -0.00 0.00 0.00 31.60 32.50 1x8l h MET 174 CO 0.39 0.24 0.00 1.28 -0.00 0.00 0.00 176.91 178.82 1x8l n LEU 175 N -4.48 0.19 0.23 -0.10 4.77 -1.26 -1.10 117.00 115.24 1x8l n LEU 175 Ca 0.06 0.55 0.07 0.00 -0.03 0.00 0.00 56.01 56.66 1x8l n LEU 175 Cb 0.24 -0.53 0.54 0.00 -2.33 0.00 0.00 43.42 41.35 1x8l n LEU 175 CO 0.35 -0.37 0.89 0.44 -1.33 0.00 0.00 177.39 177.37 1x8l h ASP 176 N 0.00 0.00 0.00 -1.43 3.32 -1.77 -3.38 116.42 113.16 1x8l h ASP 176 Ca 0.00 0.00 -0.25 0.00 0.02 0.00 0.00 57.03 56.80 1x8l h ASP 176 Cb 0.26 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.77 1x8l h ASP 176 CO 0.00 0.20 -1.79 0.41 -1.72 0.00 0.00 179.24 176.34 1x8l n THR 177 N -4.08 0.91 -4.01 0.35 -1.04 -0.26 -5.06 114.28 101.08 1x8l n THR 177 Ca -0.02 -0.19 -0.23 0.00 -2.04 0.00 0.00 64.05 61.57 1x8l n THR 177 Cb 0.27 -1.74 -0.03 0.00 -1.82 0.00 0.00 70.33 67.02 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 -2.31 4.98 0.11 12.58 -7.23 -0.47 -4.38 120.40 123.69 1x8l s VAL 178 Ca -0.22 -1.04 -0.12 0.00 -1.81 0.00 0.00 61.98 58.80 1x8l s VAL 178 Cb 0.08 -3.65 -0.06 0.00 0.56 0.00 0.00 36.38 33.30 1x8l s VAL 178 CO 0.28 -0.26 0.47 -0.54 -0.31 0.00 0.00 175.10 174.74 1x8l s LYS 179 N -3.68 3.87 -0.04 4.82 1.02 -1.07 -4.43 119.74 120.22 1x8l s LYS 179 Ca 0.33 0.33 0.01 0.00 0.02 0.00 0.00 55.97 56.66 1x8l s LYS 179 Cb -0.09 -2.97 0.02 0.00 -0.52 0.00 0.00 37.83 34.27 1x8l s LYS 179 CO 0.27 0.52 -0.03 1.41 -0.92 0.00 0.00 175.35 176.61 1x8l s MET 180 N -1.93 0.65 -0.25 1.68 -2.45 0.06 -0.81 119.30 116.24 1x8l s MET 180 Ca 0.35 -0.03 -0.10 0.00 -1.25 0.00 0.00 55.69 54.66 1x8l s MET 180 Cb -0.14 -0.74 -0.05 0.00 1.25 0.00 0.00 34.83 35.15 1x8l s MET 180 CO 0.19 -0.12 0.16 0.08 1.05 0.00 0.00 175.02 176.38 1x8l s VAL 181 N 1.03 5.21 -0.12 10.11 1.01 -0.29 -0.92 120.40 136.42 1x8l s VAL 181 Ca -0.09 0.13 -0.01 0.00 0.00 0.00 0.00 61.98 62.01 1x8l s VAL 181 Cb -0.14 -3.45 -0.02 0.00 0.00 0.00 0.00 36.38 32.77 1x8l s VAL 181 CO -0.01 0.31 -0.10 -0.47 0.00 0.00 0.00 175.10 174.83 1x8l s TYR 182 N 1.38 2.87 -0.14 5.22 5.04 -0.64 -1.20 117.35 129.87 1x8l s TYR 182 Ca 0.07 -0.43 -0.03 0.00 -2.44 0.00 0.00 57.07 54.24 1x8l s TYR 182 Cb -0.15 -1.84 -0.03 0.00 0.35 0.00 0.00 41.96 40.29 1x8l s TYR 182 CO 0.07 -0.06 -0.02 -0.51 -1.34 0.00 0.00 175.55 173.68 1x8l s LEU 183 N 0.12 3.35 0.15 6.97 2.01 -0.19 -1.07 118.68 130.02 1x8l s LEU 183 Ca -0.04 -0.06 0.11 0.00 0.01 0.00 0.00 54.13 54.15 1x8l s LEU 183 Cb -0.14 -1.80 -0.04 0.00 0.01 0.00 0.00 46.19 44.22 1x8l s LEU 183 CO 0.04 0.22 -0.25 0.00 1.01 0.00 0.00 176.35 177.36 1x8l s ALA 184 N 0.08 2.45 0.04 4.21 0.00 -0.56 -4.08 121.76 123.90 1x8l s ALA 184 Ca 0.00 -1.52 -0.11 0.00 0.00 0.00 0.00 51.96 50.34 1x8l s ALA 184 Cb -0.13 -0.38 0.01 0.00 0.00 0.00 0.00 23.12 22.61 1x8l s ALA 184 CO 0.02 0.51 0.23 0.50 0.00 0.00 0.00 175.76 177.02 1x8l s ARG 185 N -2.26 0.72 -0.34 0.00 3.52 -1.26 -1.02 118.95 118.30 1x8l s ARG 185 Ca 0.16 -0.57 -0.41 0.00 -0.13 0.00 0.00 55.73 54.78 1x8l s ARG 185 Cb -0.09 0.31 -0.16 0.00 -1.56 0.00 0.00 34.95 33.44 1x8l s ARG 185 CO 0.08 -0.22 1.77 -3.47 -0.81 0.00 0.00 175.30 172.65 1x8l n ASP 186 N 0.70 2.05 0.28 -2.12 -0.08 -1.26 -4.79 116.55 111.34 1x8l n ASP 186 Ca -0.19 1.03 0.15 0.00 -1.51 0.00 0.00 54.79 54.27 1x8l n ASP 186 Cb 0.59 -1.08 0.84 0.00 2.34 0.00 0.00 41.12 43.81 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 7.27 0.00 -0.31 -0.67 0.13 -1.99 -1.27 132.00 135.16 1x8l h PRO 187 Ca -0.43 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.68 1x8l h PRO 187 Cb 1.33 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.45 1x8l h PRO 187 CO 0.98 0.06 0.10 0.00 -0.23 0.00 0.00 178.00 178.92 1x8l h ARG 188 N 0.00 0.47 -0.09 0.86 3.08 -2.00 -0.95 114.38 115.75 1x8l h ARG 188 Ca -0.00 -0.10 -0.10 0.00 0.07 0.00 0.00 59.98 59.86 1x8l h ARG 188 Cb 0.21 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 1x8l h ARG 188 CO 0.01 0.51 -0.38 -0.44 -1.07 0.00 0.00 179.97 178.59 1x8l h ASP 189 N 0.34 0.19 -0.69 7.04 3.32 -1.73 -2.81 116.42 122.09 1x8l h ASP 189 Ca 0.10 -0.07 -0.06 0.00 0.02 0.00 0.00 57.03 57.01 1x8l h ASP 189 Cb 0.23 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 39.70 1x8l h ASP 189 CO -0.00 0.56 0.19 0.58 -1.72 0.00 0.00 179.24 178.85 1x8l h VAL 190 N 0.16 1.26 0.19 -1.35 2.07 -1.03 -1.70 116.25 115.85 1x8l h VAL 190 Ca 0.02 -0.93 -0.00 0.00 0.82 0.00 0.00 66.70 66.61 1x8l h VAL 190 Cb 0.75 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 31.06 1x8l h VAL 190 CO 0.06 0.36 -0.15 0.00 0.02 0.00 0.00 177.57 177.86 1x8l h ALA 191 N 1.08 -0.32 -0.04 1.67 0.00 -1.00 0.19 119.26 120.84 1x8l h ALA 191 Ca 0.22 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.08 1x8l h ALA 191 Cb 0.34 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1x8l h ALA 191 CO -0.00 -0.70 -0.00 0.28 0.00 0.00 0.00 179.25 178.83 1x8l h VAL 192 N -0.35 0.97 -0.42 0.00 2.07 -1.46 0.19 116.25 117.26 1x8l h VAL 192 Ca -0.01 -0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.54 1x8l h VAL 192 Cb 0.31 0.95 -0.04 0.00 -1.52 0.00 0.00 31.29 31.00 1x8l h VAL 192 CO -0.01 0.00 0.20 -1.28 0.02 0.00 0.00 177.57 176.51 1x8l h SER 193 N 0.01 0.29 -0.35 0.57 0.87 -1.18 -2.39 113.55 111.37 1x8l h SER 193 Ca 0.02 0.02 -0.01 0.00 -1.23 0.00 0.00 61.79 60.59 1x8l h SER 193 Cb 0.03 -0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 61.94 1x8l h SER 193 CO -0.04 0.21 0.19 0.28 -0.53 0.00 0.00 176.83 176.94 1x8l h SER 194 N 0.41 0.47 -0.25 6.23 0.02 -0.26 -0.89 113.55 119.28 1x8l h SER 194 Ca 0.18 -0.03 -0.07 0.00 -0.84 0.00 0.00 61.79 61.03 1x8l h SER 194 Cb 0.10 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.51 1x8l h SER 194 CO -0.13 0.39 -0.11 0.15 -1.14 0.00 0.00 176.83 175.98 1x8l h PHE 195 N 0.53 0.59 -0.08 3.45 3.57 -0.63 -0.83 116.94 123.54 1x8l h PHE 195 Ca 0.14 -0.15 -0.09 0.00 3.53 0.00 0.00 57.97 61.40 1x8l h PHE 195 Cb 0.04 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 38.63 1x8l h PHE 195 CO 0.00 0.77 -0.34 0.45 -2.23 0.00 0.00 178.31 176.97 1x8l h HIS 196 N 0.24 0.19 -0.02 0.41 3.86 -1.10 -1.76 115.15 116.96 1x8l h HIS 196 Ca 0.06 -0.04 -0.20 0.00 -1.16 0.00 0.00 60.37 59.03 1x8l h HIS 196 Cb 0.62 -0.04 -0.00 0.00 1.06 0.00 0.00 27.41 29.04 1x8l h HIS 196 CO 0.06 0.49 -0.84 1.25 0.86 0.00 0.00 177.93 179.75 1x8l h HIS 197 N 0.14 0.47 -0.12 2.45 -0.00 -1.07 -0.38 115.15 116.65 1x8l h HIS 197 Ca 0.02 -0.24 -0.01 0.00 -0.00 0.00 0.00 60.37 60.14 1x8l h HIS 197 Cb 0.68 -0.06 -0.00 0.00 -0.00 0.00 0.00 27.41 28.02 1x8l h HIS 197 CO 0.01 1.03 0.02 0.00 -0.00 0.00 0.00 177.93 178.99 1x8l h ALA 198 N 0.90 0.16 -0.75 5.26 0.00 -0.79 -2.10 119.26 121.93 1x8l h ALA 198 Ca -0.05 -0.14 0.14 0.00 0.00 0.00 0.00 54.91 54.85 1x8l h ALA 198 Cb 1.45 -0.04 -0.09 0.00 0.00 0.00 0.00 17.79 19.10 1x8l h ALA 198 CO 0.14 -0.20 0.31 0.00 0.00 0.00 0.00 179.25 179.50 1x8l h ARG 199 N -0.02 0.46 -0.62 0.00 2.47 -1.28 0.79 114.38 116.17 1x8l h ARG 199 Ca 0.04 -0.03 0.09 0.00 -1.26 0.00 0.00 59.98 58.82 1x8l h ARG 199 Cb 0.27 -0.10 -0.07 0.00 -1.65 0.00 0.00 29.97 28.42 1x8l h ARG 199 CO 0.00 0.30 0.26 1.25 0.56 0.00 0.00 179.97 182.34 1x8l h LEU 200 N 0.47 0.30 -2.86 3.04 5.85 -0.43 -1.63 115.31 120.05 1x8l h LEU 200 Ca 0.41 0.07 0.00 0.00 0.84 0.00 0.00 57.88 59.20 1x8l h LEU 200 Cb 0.60 0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.65 1x8l h LEU 200 CO -0.38 0.18 0.00 0.18 -0.34 0.00 0.00 178.44 178.07 1x8l n LEU 201 N -4.95 4.43 -2.76 2.25 4.77 -0.85 -0.95 117.00 118.94 1x8l n LEU 201 Ca 0.09 -2.24 -0.22 0.00 -0.03 0.00 0.00 56.01 53.61 1x8l n LEU 201 Cb 0.26 -0.57 0.02 0.00 -2.33 0.00 0.00 43.42 40.79 1x8l n LEU 201 CO 0.24 0.68 -0.12 -1.22 -1.33 0.00 0.00 177.39 175.64 1x8l n TYR 202 N 0.86 -1.56 0.09 -1.77 4.02 -0.61 -4.91 117.16 113.27 1x8l n TYR 202 Ca 0.23 0.30 -0.13 0.00 -0.01 0.00 0.00 57.90 58.29 1x8l n TYR 202 Cb 0.86 -4.26 -0.10 0.00 -0.02 0.00 0.00 39.34 35.82 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 -0.79 0.34 -9.92 7.72 3.38 -1.10 -3.47 115.31 111.47 1x8l h LEU 203 Ca -0.52 -0.34 -0.51 0.00 0.09 0.00 0.00 57.88 56.60 1x8l h LEU 203 Cb 1.37 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.98 1x8l h LEU 203 CO 0.58 1.23 0.08 -0.76 0.09 0.00 0.00 178.44 179.66 1x8l s LEU 204 N -7.20 4.22 0.06 1.67 1.43 -1.25 -4.47 118.68 113.15 1x8l s LEU 204 Ca -0.03 1.32 -0.31 0.00 -1.03 0.00 0.00 54.13 54.09 1x8l s LEU 204 Cb 0.08 -3.77 -0.08 0.00 0.03 0.00 0.00 46.19 42.46 1x8l s LEU 204 CO 0.86 -0.06 1.63 0.20 0.23 0.00 0.00 176.35 179.22 1x8l s ASN 205 N -1.93 6.62 0.42 2.29 0.01 -0.47 -4.89 114.94 116.99 1x8l s ASN 205 Ca 0.47 2.45 0.29 0.00 -0.71 0.00 0.00 52.86 55.36 1x8l s ASN 205 Cb -0.14 -2.56 1.45 0.00 0.41 0.00 0.00 41.25 40.41 1x8l s ASN 205 CO 0.19 -0.88 1.88 0.50 -1.51 0.00 0.00 177.10 177.29 1x8l h LYS 206 N 8.33 0.00 -0.00 -0.60 1.63 -1.96 -0.37 116.57 123.59 1x8l h LYS 206 Ca -0.42 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.38 1x8l h LYS 206 Cb 1.20 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.83 1x8l h LYS 206 CO 0.93 0.00 -0.13 1.04 -3.45 0.00 0.00 179.45 177.84 1x8l n GLN 207 N -2.56 0.70 -3.24 1.90 1.13 -1.26 -4.86 117.38 109.19 1x8l n GLN 207 Ca -0.01 -0.27 -0.34 0.00 -1.94 0.00 0.00 57.00 54.44 1x8l n GLN 207 Cb 0.13 -1.49 -0.06 0.00 0.11 0.00 0.00 30.24 28.92 1x8l n GLN 207 CO 0.00 0.00 0.00 -1.12 -1.44 0.00 0.00 177.06 174.50 1x8l s SER 208 N -2.49 6.86 0.44 1.08 0.01 -0.15 -5.11 113.70 114.34 1x8l s SER 208 Ca 0.28 1.20 0.04 0.00 1.31 0.00 0.00 55.95 58.78 1x8l s SER 208 Cb 0.20 -2.34 0.04 0.00 0.21 0.00 0.00 66.02 64.13 1x8l s SER 208 CO 0.48 -0.01 0.33 -0.46 0.41 0.00 0.00 173.24 173.99 1x8l n ASN 209 N 0.39 2.38 -0.07 2.44 0.23 -1.26 -4.95 115.26 114.41 1x8l n ASN 209 Ca -0.02 -2.50 -0.05 0.00 -0.53 0.00 0.00 54.58 51.49 1x8l n ASN 209 Cb 0.52 -0.04 0.16 0.00 -2.08 0.00 0.00 39.78 38.34 1x8l n ASN 209 CO 0.00 0.00 0.00 0.15 -0.93 0.00 0.00 177.26 176.48 1x8l h PHE 210 N 0.62 0.78 -0.58 -2.53 3.57 -1.99 -2.60 116.94 114.21 1x8l h PHE 210 Ca -0.28 -0.14 0.01 0.00 3.53 0.00 0.00 57.97 61.10 1x8l h PHE 210 Cb 1.01 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 39.52 1x8l h PHE 210 CO 0.00 0.79 0.37 -0.22 -2.23 0.00 0.00 178.31 177.02 1x8l h LYS 211 N 0.65 0.73 -0.65 1.11 3.64 -1.96 0.32 116.57 120.41 1x8l h LYS 211 Ca 0.11 -0.04 0.05 0.00 -1.27 0.00 0.00 60.65 59.50 1x8l h LYS 211 Cb 0.56 -0.17 -0.05 0.00 -0.41 0.00 0.00 32.23 32.17 1x8l h LYS 211 CO 0.04 0.49 0.38 -0.44 -2.27 0.00 0.00 179.45 177.64 1x8l h ASP 212 N 0.76 0.58 -0.43 4.20 3.32 -1.93 0.71 116.42 123.62 1x8l h ASP 212 Ca 0.22 0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.28 1x8l h ASP 212 Cb -0.06 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.38 1x8l h ASP 212 CO -0.06 0.38 0.25 0.15 -1.72 0.00 0.00 179.24 178.24 1x8l h PHE 213 N 0.71 0.58 -0.43 4.55 3.57 -0.84 -2.57 116.94 122.51 1x8l h PHE 213 Ca 0.28 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.78 1x8l h PHE 213 Cb 0.13 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 38.66 1x8l h PHE 213 CO -0.07 0.42 0.26 2.35 -2.23 0.00 0.00 178.31 179.03 1x8l h TRP 214 N 0.57 0.56 -0.41 0.41 2.91 0.18 0.61 115.95 120.78 1x8l h TRP 214 Ca 0.15 -0.00 0.09 0.00 1.13 0.00 0.00 58.89 60.26 1x8l h TRP 214 Cb 0.01 -0.18 -0.09 0.00 -0.51 0.00 0.00 29.16 28.39 1x8l h TRP 214 CO -0.03 0.40 -0.21 0.93 -1.03 0.00 0.00 178.44 178.49 1x8l h GLU 215 N 0.56 -0.13 -0.34 2.65 4.39 -0.72 -0.27 114.58 120.72 1x8l h GLU 215 Ca 0.15 0.01 -0.03 0.00 0.34 0.00 0.00 59.36 59.83 1x8l h GLU 215 Cb -0.00 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.66 1x8l h GLU 215 CO -0.03 -0.09 0.10 1.98 -1.16 0.00 0.00 179.01 179.82 1x8l h MET 216 N -0.14 0.54 0.08 2.33 4.05 -1.09 -2.91 114.93 117.79 1x8l h MET 216 Ca 0.20 -0.12 -0.00 0.00 -0.28 0.00 0.00 59.70 59.50 1x8l h MET 216 Cb 0.45 -0.08 0.00 0.00 -0.80 0.00 0.00 31.60 31.17 1x8l h MET 216 CO -0.50 0.57 -0.04 0.35 0.23 0.00 0.00 176.91 177.52 1x8l h PHE 217 N 0.40 -0.10 0.00 1.39 3.57 -0.23 -1.48 116.94 120.49 1x8l h PHE 217 Ca 0.11 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.61 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 0.01 0.12 0.00 1.12 -2.23 0.00 0.00 178.31 177.33 1x8l h HIS 218 N -0.30 0.00 -0.26 0.41 2.07 -1.15 -2.77 115.15 113.14 1x8l h HIS 218 Ca -0.01 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.51 1x8l h HIS 218 Cb 0.26 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.24 1x8l h HIS 218 CO -0.01 0.00 0.00 0.54 -3.07 0.00 0.00 177.93 175.39 1x8l n ARG 219 N -2.34 1.90 -2.35 5.12 1.74 -1.10 -4.97 116.66 114.66 1x8l n ARG 219 Ca 0.04 -1.37 -0.00 0.00 -0.77 0.00 0.00 57.85 55.75 1x8l n ARG 219 Cb 0.37 -1.39 0.00 0.00 -1.02 0.00 0.00 32.46 30.42 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 1.19 0.77 0.13 -0.13 0.00 -1.05 -4.97 105.19 101.13 1x8l n GLY 220 Ca 0.16 -0.74 0.02 0.00 0.00 0.00 0.00 46.02 45.46 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 -0.38 1.02 -4.79 0.99 4.77 -0.57 -4.46 117.00 113.59 1x8l n LEU 221 Ca -0.00 -1.42 -0.23 0.00 -0.03 0.00 0.00 56.01 54.33 1x8l n LEU 221 Cb 0.50 -0.09 -0.06 0.00 -2.33 0.00 0.00 43.42 41.44 1x8l n LEU 221 CO 0.00 0.34 -0.11 -0.47 -1.33 0.00 0.00 177.39 175.82 1x8l s TYR 222 N -0.88 2.67 -0.25 -1.77 5.04 -1.23 -4.85 117.35 116.09 1x8l s TYR 222 Ca 0.07 -0.51 -0.40 0.00 -2.44 0.00 0.00 57.07 53.79 1x8l s TYR 222 Cb 0.06 -1.96 -0.16 0.00 0.35 0.00 0.00 41.96 40.24 1x8l s TYR 222 CO 0.01 0.11 1.66 2.41 -1.34 0.00 0.00 175.55 178.40 1x8l n THR 223 N -1.33 0.23 -0.99 4.34 -1.04 -1.26 -2.20 114.28 112.03 1x8l n THR 223 Ca 0.00 -0.04 0.00 0.00 -2.04 0.00 0.00 64.05 61.97 1x8l n THR 223 Cb 0.63 -1.08 0.00 0.00 -1.82 0.00 0.00 70.33 68.06 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 4.79 0.85 -4.82 -4.42 7.99 0.11 -4.95 117.00 116.56 1x8l n LEU 224 Ca 0.26 0.00 -0.29 0.00 -0.01 0.00 0.00 56.01 55.97 1x8l n LEU 224 Cb 0.12 -2.19 0.13 0.00 -0.11 0.00 0.00 43.42 41.38 1x8l n LEU 224 CO 0.79 -0.84 0.75 0.42 -1.51 0.00 0.00 177.39 176.99 1x8l s THR 225 N -1.15 1.98 0.15 -5.08 -4.23 -0.94 -4.65 115.64 101.71 1x8l s THR 225 Ca 0.00 0.00 -0.31 0.00 -1.18 0.00 0.00 61.69 60.20 1x8l s THR 225 Cb 0.00 -2.83 -0.10 0.00 1.34 0.00 0.00 72.50 70.91 1x8l s THR 225 CO 0.00 0.00 1.73 -2.84 -0.54 0.00 0.00 174.62 172.97 1x8l s PRO 226 N -5.42 4.15 0.13 3.99 0.02 -1.26 -1.30 135.00 135.31 1x8l s PRO 226 Ca 0.65 2.52 -0.28 0.00 0.02 0.00 0.00 61.00 63.91 1x8l s PRO 226 Cb -0.12 -3.38 -0.04 0.00 0.02 0.00 0.00 34.50 30.97 1x8l s PRO 226 CO 0.52 -0.76 1.58 -0.92 -0.33 0.00 0.00 177.00 177.09 1x8l h TYR 227 N 7.76 -1.17 -0.26 6.54 3.20 -1.86 -2.51 116.97 128.68 1x8l h TYR 227 Ca -0.44 0.05 -0.08 0.00 3.14 0.00 0.00 58.73 61.40 1x8l h TYR 227 Cb 1.21 0.53 -0.01 0.00 1.54 0.00 0.00 36.73 40.00 1x8l h TYR 227 CO 0.72 -0.46 -0.19 0.74 -1.64 0.00 0.00 178.16 177.34 1x8l h PHE 228 N -0.46 0.52 -0.34 -3.82 -1.00 -1.98 -2.48 116.94 107.38 1x8l h PHE 228 Ca 0.09 -0.09 -0.02 0.00 2.81 0.00 0.00 57.97 60.76 1x8l h PHE 228 Cb 0.61 -0.13 -0.02 0.00 3.61 0.00 0.00 35.95 40.02 1x8l h PHE 228 CO -0.49 0.63 0.15 0.93 -1.61 0.00 0.00 178.31 177.92 1x8l h GLU 229 N 0.43 0.50 -0.49 1.51 4.39 -1.92 0.89 114.58 119.88 1x8l h GLU 229 Ca 0.07 -0.08 0.09 0.00 0.34 0.00 0.00 59.36 59.78 1x8l h GLU 229 Cb 0.57 -0.08 -0.08 0.00 -0.10 0.00 0.00 28.75 29.06 1x8l h GLU 229 CO 0.04 0.48 0.04 1.25 -1.16 0.00 0.00 179.01 179.65 1x8l h HIS 230 N 0.40 0.04 -0.30 4.33 2.76 -1.26 -2.23 115.15 118.89 1x8l h HIS 230 Ca 0.11 0.03 -0.18 0.00 -2.20 0.00 0.00 60.37 58.14 1x8l h HIS 230 Cb 0.16 0.06 -0.00 0.00 1.55 0.00 0.00 27.41 29.17 1x8l h HIS 230 CO -0.01 -0.07 -0.52 0.28 -1.30 0.00 0.00 177.93 176.30 1x8l h VAL 231 N 0.16 1.27 -0.38 5.26 2.07 -1.12 -3.22 116.25 120.30 1x8l h VAL 231 Ca 0.25 -1.71 -0.04 0.00 0.82 0.00 0.00 66.70 66.02 1x8l h VAL 231 Cb 0.36 1.59 -0.02 0.00 -1.52 0.00 0.00 31.29 31.70 1x8l h VAL 231 CO -0.38 0.56 0.05 0.11 0.02 0.00 0.00 177.57 177.93 1x8l h LYS 232 N 0.68 0.57 0.13 1.57 1.57 -0.69 0.32 116.57 120.72 1x8l h LYS 232 Ca 0.02 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 1x8l h LYS 232 Cb 1.13 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 33.34 1x8l h LYS 232 CO 0.12 0.57 -0.12 0.93 -0.57 0.00 0.00 179.45 180.37 1x8l h GLU 233 N 0.56 -0.26 -0.69 3.15 5.08 -1.41 -1.66 114.58 119.34 1x8l h GLU 233 Ca 0.12 0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.44 1x8l h GLU 233 Cb 0.29 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.57 1x8l h GLU 233 CO 0.00 -0.18 0.19 0.00 -1.00 0.00 0.00 179.01 178.03 1x8l h ALA 234 N 0.58 1.05 -0.49 3.43 0.00 -1.48 -3.06 119.26 119.27 1x8l h ALA 234 Ca 0.00 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.65 1x8l h ALA 234 Cb 0.26 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1x8l h ALA 234 CO -0.03 0.64 0.15 2.35 0.00 0.00 0.00 179.25 182.35 1x8l h TRP 235 N 1.02 0.74 0.00 0.00 2.91 -0.77 -1.46 115.95 118.40 1x8l h TRP 235 Ca 0.22 -0.05 -0.01 0.00 1.13 0.00 0.00 58.89 60.18 1x8l h TRP 235 Cb 0.32 -0.22 -0.00 0.00 -0.51 0.00 0.00 29.16 28.74 1x8l h TRP 235 CO 0.02 0.61 -0.06 0.00 -1.03 0.00 0.00 178.44 177.99 1x8l h ALA 236 N 1.45 1.09 -0.64 2.65 0.00 -1.20 -2.37 119.26 120.24 1x8l h ALA 236 Ca 0.17 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1x8l h ALA 236 Cb 0.22 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1x8l h ALA 236 CO -0.01 0.07 0.00 1.63 0.00 0.00 0.00 179.25 180.95 1x8l n LYS 237 N -3.29 2.67 0.00 0.00 4.76 -0.56 -4.69 118.16 117.05 1x8l n LYS 237 Ca -0.01 -2.38 0.10 0.00 -2.87 0.00 0.00 58.31 53.15 1x8l n LYS 237 Cb 0.24 -1.56 0.42 0.00 -1.84 0.00 0.00 35.03 32.29 1x8l n LYS 237 CO 0.00 0.00 0.00 2.89 -1.37 0.00 0.00 177.40 178.92 1x8l n ARG 238 N 1.33 0.00 0.00 1.97 1.85 -0.89 -1.83 116.66 119.09 1x8l n ARG 238 Ca 0.22 0.16 0.11 0.00 -1.00 0.00 0.00 57.85 57.34 1x8l n ARG 238 Cb 0.59 -1.50 0.02 0.00 -1.05 0.00 0.00 32.46 30.52 1x8l n ARG 238 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 1x8l n HIS 239 N -1.51 0.00 -1.83 2.89 8.25 -1.26 -4.74 115.22 117.02 1x8l n HIS 239 Ca 0.05 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.09 1x8l n HIS 239 Cb 0.23 -0.08 -0.03 0.00 1.12 0.00 0.00 29.99 31.23 1x8l n HIS 239 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1x8l s ASP 240 N -2.95 6.48 0.60 0.41 -1.08 -0.76 -4.91 116.67 114.46 1x8l s ASP 240 Ca 0.10 2.75 0.34 0.00 -0.52 0.00 0.00 52.55 55.23 1x8l s ASP 240 Cb 0.17 -2.60 1.86 0.00 -1.46 0.00 0.00 42.92 40.89 1x8l s ASP 240 CO 0.79 -0.90 2.04 -0.65 0.52 0.00 0.00 175.17 176.97 1x8l h PRO 241 N 6.69 0.00 -0.47 4.34 0.11 -1.91 -2.02 132.00 138.74 1x8l h PRO 241 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1x8l h PRO 241 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1x8l h PRO 241 CO 0.93 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 178.81 1x8l n ASN 242 N -2.83 3.92 -4.17 -2.05 3.02 -1.26 -4.88 115.26 107.02 1x8l n ASN 242 Ca -0.02 -2.41 -0.32 0.00 -0.03 0.00 0.00 54.58 51.80 1x8l n ASN 242 Cb 0.19 -0.45 -0.17 0.00 -0.61 0.00 0.00 39.78 38.75 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 -1.75 2.95 -0.37 3.52 -2.45 -0.76 -0.76 119.30 119.69 1x8l s MET 243 Ca 0.40 -0.83 -0.04 0.00 -1.25 0.00 0.00 55.69 53.97 1x8l s MET 243 Cb 0.26 -2.37 0.08 0.00 1.25 0.00 0.00 34.83 34.05 1x8l s MET 243 CO 0.19 0.01 0.13 -1.17 1.05 0.00 0.00 175.02 175.22 1x8l s LEU 244 N 0.77 4.69 -0.35 4.11 2.96 -0.10 -4.71 118.68 126.04 1x8l s LEU 244 Ca -0.09 -1.62 -0.22 0.00 -0.22 0.00 0.00 54.13 51.99 1x8l s LEU 244 Cb -0.16 -1.81 0.00 0.00 0.50 0.00 0.00 46.19 44.72 1x8l s LEU 244 CO -0.01 -0.42 0.71 0.12 -1.32 0.00 0.00 176.35 175.43 1x8l s PHE 245 N 1.24 3.14 0.24 5.38 5.36 -1.26 -1.63 117.98 130.45 1x8l s PHE 245 Ca 0.02 0.49 0.12 0.00 -0.96 0.00 0.00 56.93 56.60 1x8l s PHE 245 Cb -0.21 -3.25 -0.05 0.00 -0.34 0.00 0.00 43.02 39.17 1x8l s PHE 245 CO -0.02 -0.66 -0.22 -0.51 -1.46 0.00 0.00 175.22 172.36 1x8l s LEU 246 N 2.89 2.52 -0.11 6.12 1.43 -0.23 -4.99 118.68 126.31 1x8l s LEU 246 Ca 0.28 -0.95 -0.03 0.00 -1.03 0.00 0.00 54.13 52.40 1x8l s LEU 246 Cb -0.14 -1.12 -0.03 0.00 0.03 0.00 0.00 46.19 44.92 1x8l s LEU 246 CO 0.15 0.07 0.01 -0.36 0.23 0.00 0.00 176.35 176.46 1x8l s PHE 247 N -2.12 3.17 0.27 0.29 0.40 -1.26 -1.50 117.98 117.23 1x8l s PHE 247 Ca 0.26 0.13 -0.00 0.00 -0.60 0.00 0.00 56.93 56.71 1x8l s PHE 247 Cb -0.06 -1.85 0.54 0.00 0.51 0.00 0.00 43.02 42.16 1x8l s PHE 247 CO 0.12 0.38 1.78 -0.92 0.70 0.00 0.00 175.22 177.28 1x8l h TYR 248 N 5.54 0.87 -0.15 0.36 3.20 -1.26 -2.08 116.97 123.45 1x8l h TYR 248 Ca -0.47 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.41 1x8l h TYR 248 Cb 1.19 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 39.20 1x8l h TYR 248 CO 0.62 0.25 -0.01 0.93 -1.64 0.00 0.00 178.16 178.31 1x8l h GLU 249 N 0.71 0.21 0.00 1.82 3.07 -1.92 -0.98 114.58 117.49 1x8l h GLU 249 Ca 0.47 -0.03 -0.05 0.00 -0.50 0.00 0.00 59.36 59.25 1x8l h GLU 249 Cb 0.63 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.49 1x8l h GLU 249 CO -0.34 0.24 -0.25 -0.44 -1.40 0.00 0.00 179.01 176.82 1x8l h ASP 250 N 0.21 0.00 -0.62 1.42 3.32 -1.76 -1.56 116.42 117.44 1x8l h ASP 250 Ca 0.05 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.09 1x8l h ASP 250 Cb 0.16 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.68 1x8l h ASP 250 CO 0.00 0.25 0.34 1.88 -1.72 0.00 0.00 179.24 180.00 1x8l h TYR 251 N 0.00 0.86 0.05 4.55 0.99 -1.20 -0.38 116.97 121.84 1x8l h TYR 251 Ca -0.00 -0.01 -0.28 0.00 2.00 0.00 0.00 58.73 60.43 1x8l h TYR 251 Cb 0.48 -0.28 0.02 0.00 1.00 0.00 0.00 36.73 37.96 1x8l h TYR 251 CO 0.00 0.61 -1.13 -0.07 -0.00 0.00 0.00 178.16 177.56 1x8l h LEU 252 N 0.89 0.88 -0.03 3.88 3.38 -1.41 -3.06 115.31 119.84 1x8l h LEU 252 Ca 0.23 -0.76 -0.22 0.00 0.09 0.00 0.00 57.88 57.22 1x8l h LEU 252 Cb 0.03 -0.27 0.02 0.00 0.09 0.00 0.00 40.66 40.53 1x8l h LEU 252 CO -0.04 1.56 -0.83 0.11 0.09 0.00 0.00 178.44 179.33 1x8l h LYS 253 N 0.34 0.61 -0.97 1.13 1.57 -1.28 -3.42 116.57 114.54 1x8l h LYS 253 Ca -0.15 -0.62 -0.33 0.00 -1.87 0.00 0.00 60.65 57.68 1x8l h LYS 253 Cb 1.79 0.17 -0.23 0.00 0.08 0.00 0.00 32.23 34.04 1x8l h LYS 253 CO 0.22 1.23 -0.70 -3.47 -0.57 0.00 0.00 179.45 176.16 1x8l n ASP 254 N -4.01 -2.01 -0.04 0.86 2.03 -0.16 -5.01 116.55 108.22 1x8l n ASP 254 Ca -0.10 -2.97 -0.11 0.00 0.52 0.00 0.00 54.79 52.13 1x8l n ASP 254 Cb 0.78 0.95 -0.05 0.00 -0.72 0.00 0.00 41.12 42.07 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 4.41 0.21 -0.99 -2.67 5.85 -1.62 -1.85 115.31 118.65 1x8l h LEU 255 Ca -0.00 -0.19 0.17 0.00 0.84 0.00 0.00 57.88 58.70 1x8l h LEU 255 Cb 1.00 -0.05 -0.10 0.00 0.37 0.00 0.00 40.66 41.87 1x8l h LEU 255 CO 0.30 0.34 0.60 -0.65 -0.34 0.00 0.00 178.44 178.69 1x8l h PRO 256 N 0.06 0.79 -0.40 5.25 0.11 -1.90 -0.65 132.00 135.26 1x8l h PRO 256 Ca 0.05 -0.05 -0.09 0.00 0.11 0.00 0.00 66.00 66.02 1x8l h PRO 256 Cb 0.20 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.12 1x8l h PRO 256 CO -0.00 0.52 -0.09 0.78 -0.21 0.00 0.00 178.00 179.00 1x8l h GLY 257 N 0.81 0.83 0.97 -0.55 0.00 -1.85 -1.66 103.07 101.62 1x8l h GLY 257 Ca 0.55 -0.69 -0.00 0.00 0.00 0.00 0.00 47.33 47.19 1x8l h GLY 257 CO -0.35 0.63 0.13 1.76 0.00 0.00 0.00 176.54 178.70 1x8l h SER 258 N 0.58 0.26 -0.75 0.19 0.02 -0.76 -1.49 113.55 111.60 1x8l h SER 258 Ca 0.10 -0.05 0.07 0.00 -0.84 0.00 0.00 61.79 61.07 1x8l h SER 258 Cb 0.61 -0.06 -0.06 0.00 0.14 0.00 0.00 62.40 63.03 1x8l h SER 258 CO 0.04 0.23 0.43 0.40 -1.14 0.00 0.00 176.83 176.79 1x8l h ILE 259 N 0.26 0.96 -0.70 3.27 2.04 -1.03 -1.01 117.51 121.30 1x8l h ILE 259 Ca 0.08 -0.26 -0.01 0.00 1.00 0.00 0.00 64.86 65.67 1x8l h ILE 259 Cb 0.02 0.13 -0.03 0.00 -0.74 0.00 0.00 36.82 36.19 1x8l h ILE 259 CO -0.01 0.14 0.41 0.00 0.00 0.00 0.00 178.15 178.68 1x8l h ALA 260 N 1.39 1.40 -0.47 1.87 0.00 -0.89 -0.68 119.26 121.88 1x8l h ALA 260 Ca 0.34 -0.09 -0.13 0.00 0.00 0.00 0.00 54.91 55.03 1x8l h ALA 260 Cb 0.24 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1x8l h ALA 260 CO -0.20 0.51 -0.23 0.00 0.00 0.00 0.00 179.25 179.33 1x8l h ARG 261 N 0.97 0.99 -0.15 0.00 3.08 -0.41 -1.72 114.38 117.14 1x8l h ARG 261 Ca 0.25 -0.43 -0.02 0.00 0.07 0.00 0.00 59.98 59.85 1x8l h ARG 261 Cb -0.02 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.00 1x8l h ARG 261 CO -0.05 1.11 0.02 0.82 -1.07 0.00 0.00 179.97 180.81 1x8l h ILE 262 N 0.84 1.22 -0.50 2.04 2.04 -0.81 -2.11 117.51 120.23 1x8l h ILE 262 Ca 0.11 -0.70 0.00 0.00 1.00 0.00 0.00 64.86 65.27 1x8l h ILE 262 Cb 0.81 1.41 -0.02 0.00 -0.74 0.00 0.00 36.82 38.27 1x8l h ILE 262 CO 0.07 0.21 0.33 0.00 0.00 0.00 0.00 178.15 178.76 1x8l h ALA 263 N 0.81 0.64 -0.60 1.87 0.00 -1.05 -1.87 119.26 119.05 1x8l h ALA 263 Ca 0.04 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1x8l h ALA 263 Cb 0.30 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 1x8l h ALA 263 CO 0.00 0.09 0.28 0.22 0.00 0.00 0.00 179.25 179.84 1x8l h ASP 264 N 0.68 0.80 -0.78 0.00 3.58 -1.33 -1.05 116.42 118.32 1x8l h ASP 264 Ca 0.18 -0.14 0.02 0.00 0.42 0.00 0.00 57.03 57.52 1x8l h ASP 264 Cb -0.07 -0.20 -0.04 0.00 1.72 0.00 0.00 39.33 40.73 1x8l h ASP 264 CO -0.04 0.71 0.51 0.15 -2.88 0.00 0.00 179.24 177.69 1x8l h PHE 265 N 0.83 0.94 -0.03 0.28 3.57 -1.04 -1.46 116.94 120.02 1x8l h PHE 265 Ca 0.21 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.73 1x8l h PHE 265 Cb 0.13 -0.32 0.00 0.00 2.79 0.00 0.00 35.95 38.55 1x8l h PHE 265 CO 0.00 0.57 0.00 1.28 -2.23 0.00 0.00 178.31 177.93 1x8l n LEU 266 N -4.44 0.74 0.00 0.59 4.77 -0.73 -4.94 117.00 112.99 1x8l n LEU 266 Ca 0.09 -0.27 0.00 0.00 -0.03 0.00 0.00 56.01 55.80 1x8l n LEU 266 Cb 0.08 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 1x8l n LEU 266 CO 0.35 0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 1x8l n GLY 267 N 1.03 0.63 3.39 -0.72 0.00 -0.55 -5.05 105.19 103.93 1x8l n GLY 267 Ca 0.19 -0.77 -0.31 0.00 0.00 0.00 0.00 46.02 45.14 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 -2.58 2.03 -0.59 1.61 -0.14 -0.44 -5.03 119.74 114.60 1x8l s LYS 268 Ca 0.00 -0.99 -0.04 0.00 -1.36 0.00 0.00 55.97 53.58 1x8l s LYS 268 Cb 0.00 -2.11 0.15 0.00 -1.68 0.00 0.00 37.83 34.20 1x8l s LYS 268 CO 0.00 0.54 0.42 0.21 -0.76 0.00 0.00 175.35 175.76 1x8l s LYS 269 N -1.14 2.53 0.35 1.68 2.47 -1.26 -3.67 119.74 120.71 1x8l s LYS 269 Ca 0.12 -2.36 -0.18 0.00 -1.56 0.00 0.00 55.97 51.99 1x8l s LYS 269 Cb -0.10 -3.76 -0.10 0.00 -1.46 0.00 0.00 37.83 32.41 1x8l s LYS 269 CO 0.02 -1.17 0.83 -0.51 0.16 0.00 0.00 175.35 174.68 1x8l s LEU 270 N 0.23 4.06 0.71 5.43 1.43 -1.26 -5.08 118.68 124.20 1x8l s LEU 270 Ca 0.15 1.48 -0.10 0.00 -1.03 0.00 0.00 54.13 54.63 1x8l s LEU 270 Cb -0.20 -4.19 0.03 0.00 0.03 0.00 0.00 46.19 41.85 1x8l s LEU 270 CO -0.04 -0.23 1.07 -0.94 0.23 0.00 0.00 176.35 176.45 1x8l s SER 271 N -2.14 5.21 0.20 2.29 1.04 -1.26 -4.92 113.70 114.12 1x8l s SER 271 Ca 0.56 0.91 -0.11 0.00 0.48 0.00 0.00 55.95 57.79 1x8l s SER 271 Cb -0.11 -1.67 0.26 0.00 0.10 0.00 0.00 66.02 64.61 1x8l s SER 271 CO 0.17 -1.44 1.71 -0.08 0.98 0.00 0.00 173.24 174.58 1x8l h GLU 272 N -0.65 0.27 -0.89 4.02 4.57 -2.00 -2.37 114.58 117.53 1x8l h GLU 272 Ca -0.45 -0.02 0.01 0.00 -1.18 0.00 0.00 59.36 57.72 1x8l h GLU 272 Cb 1.28 -0.06 -0.05 0.00 -0.16 0.00 0.00 28.75 29.76 1x8l h GLU 272 CO 0.63 0.18 0.59 0.93 -1.18 0.00 0.00 179.01 180.16 1x8l h GLU 273 N 0.28 1.16 -0.22 1.92 3.07 -1.99 -1.77 114.58 117.03 1x8l h GLU 273 Ca 0.29 -0.07 -0.15 0.00 -0.50 0.00 0.00 59.36 58.94 1x8l h GLU 273 Cb 0.41 -0.26 0.00 0.00 -0.84 0.00 0.00 28.75 28.06 1x8l h GLU 273 CO -0.36 0.77 -0.44 1.96 -1.40 0.00 0.00 179.01 179.53 1x8l h GLN 274 N 1.20 0.69 -0.92 2.33 4.20 -1.85 -2.23 115.11 118.53 1x8l h GLN 274 Ca 0.33 -0.45 0.01 0.00 0.06 0.00 0.00 58.65 58.60 1x8l h GLN 274 Cb -0.12 0.06 -0.05 0.00 0.30 0.00 0.00 27.48 27.67 1x8l h GLN 274 CO -0.08 1.07 0.61 0.82 -0.67 0.00 0.00 178.83 180.58 1x8l h ILE 275 N 0.40 1.23 -0.40 2.54 2.04 -1.24 -1.86 117.51 120.22 1x8l h ILE 275 Ca 0.01 -0.43 -0.11 0.00 1.00 0.00 0.00 64.86 65.34 1x8l h ILE 275 Cb 1.05 -0.12 -0.02 0.00 -0.74 0.00 0.00 36.82 36.99 1x8l h ILE 275 CO 0.10 0.23 -0.18 1.56 0.00 0.00 0.00 178.15 179.86 1x8l h GLN 276 N 1.24 0.76 -0.27 2.37 1.08 -1.22 -0.90 115.11 118.18 1x8l h GLN 276 Ca 0.34 -0.28 -0.01 0.00 -1.45 0.00 0.00 58.65 57.25 1x8l h GLN 276 Cb -0.13 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.24 1x8l h GLN 276 CO -0.08 0.89 0.14 -0.09 -0.95 0.00 0.00 178.83 178.73 1x8l h ARG 277 N 0.67 0.38 -0.89 1.46 2.43 -0.93 -1.08 114.38 116.42 1x8l h ARG 277 Ca 0.10 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.22 1x8l h ARG 277 Cb 0.67 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 30.11 1x8l h ARG 277 CO 0.05 0.36 0.54 -0.07 -1.51 0.00 0.00 179.97 179.34 1x8l h LEU 278 N 0.31 1.06 -0.40 3.80 3.38 -1.24 -1.94 115.31 120.28 1x8l h LEU 278 Ca 0.09 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 1x8l h LEU 278 Cb 0.10 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1x8l h LEU 278 CO -0.01 0.81 0.19 -1.28 0.09 0.00 0.00 178.44 178.24 1x8l h SER 279 N 1.22 0.52 -0.73 -0.43 0.87 -0.89 -2.54 113.55 111.56 1x8l h SER 279 Ca 0.32 -0.13 -0.04 0.00 -1.23 0.00 0.00 61.79 60.71 1x8l h SER 279 Cb -0.06 -0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 61.73 1x8l h SER 279 CO -0.06 0.50 0.30 -0.33 -0.53 0.00 0.00 176.83 176.71 1x8l h GLU 280 N 0.50 1.11 0.00 2.24 5.08 -0.98 -2.30 114.58 120.23 1x8l h GLU 280 Ca 0.14 -0.19 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 1x8l h GLU 280 Cb 0.12 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 29.18 1x8l h GLU 280 CO -0.02 0.90 -0.08 1.25 -1.00 0.00 0.00 179.01 180.06 1x8l h HIS 281 N 1.08 0.00 -0.08 4.33 2.76 -1.10 -2.25 115.15 119.89 1x8l h HIS 281 Ca 0.25 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.42 1x8l h HIS 281 Cb 0.20 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.16 1x8l h HIS 281 CO 0.02 0.08 0.00 1.28 -1.30 0.00 0.00 177.93 178.01 1x8l n LEU 282 N -4.23 2.50 -4.52 0.26 7.99 -0.90 -4.39 117.00 113.70 1x8l n LEU 282 Ca -0.03 -0.88 -0.57 0.00 -0.01 0.00 0.00 56.01 54.52 1x8l n LEU 282 Cb 0.16 -0.04 -0.07 0.00 -0.11 0.00 0.00 43.42 43.36 1x8l n LEU 282 CO 0.33 0.44 0.63 -3.20 -1.51 0.00 0.00 177.39 174.09 1x8l n ASN 283 N 0.93 0.37 0.07 -1.43 2.85 -0.85 -4.79 115.26 112.41 1x8l n ASN 283 Ca 0.16 1.15 -0.11 0.00 -0.11 0.00 0.00 54.58 55.67 1x8l n ASN 283 Cb 0.51 -0.99 -0.05 0.00 1.24 0.00 0.00 39.78 40.49 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 3.32 -0.51 -0.19 1.20 3.57 -1.92 -1.18 116.94 121.23 1x8l h PHE 284 Ca -0.49 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.02 1x8l h PHE 284 Cb 1.41 0.22 -0.01 0.00 2.79 0.00 0.00 35.95 40.36 1x8l h PHE 284 CO 0.57 -0.28 0.11 0.93 -2.23 0.00 0.00 178.31 177.41 1x8l h GLU 285 N -0.33 0.27 -0.32 1.11 4.39 -1.98 0.26 114.58 117.97 1x8l h GLU 285 Ca 0.05 -0.03 0.06 0.00 0.34 0.00 0.00 59.36 59.78 1x8l h GLU 285 Cb 0.39 -0.05 -0.05 0.00 -0.10 0.00 0.00 28.75 28.93 1x8l h GLU 285 CO -0.16 0.23 0.00 -0.22 -1.16 0.00 0.00 179.01 177.71 1x8l h LYS 286 N 0.22 0.09 -0.58 2.33 3.64 -1.90 -2.35 116.57 118.03 1x8l h LYS 286 Ca 0.07 -0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.36 1x8l h LYS 286 Cb 0.04 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.82 1x8l h LYS 286 CO -0.01 0.06 0.04 0.35 -2.27 0.00 0.00 179.45 177.62 1x8l h PHE 287 N 0.10 1.05 -0.43 1.91 3.57 -0.80 -0.80 116.94 121.54 1x8l h PHE 287 Ca 0.15 -0.16 -0.02 0.00 3.53 0.00 0.00 57.97 61.47 1x8l h PHE 287 Cb 0.21 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 38.64 1x8l h PHE 287 CO -0.23 0.92 0.17 -0.22 -2.23 0.00 0.00 178.31 176.72 1x8l h LYS 288 N 0.91 0.62 -0.38 1.11 3.64 -0.36 -1.87 116.57 120.24 1x8l h LYS 288 Ca 0.17 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 1x8l h LYS 288 Cb 0.48 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.18 1x8l h LYS 288 CO 0.02 0.52 0.00 0.09 -2.27 0.00 0.00 179.45 177.81 1x8l n ASN 289 N -4.36 2.41 -4.48 4.20 3.02 -0.90 -4.76 115.26 110.39 1x8l n ASN 289 Ca 0.03 -1.92 -0.43 0.00 -0.03 0.00 0.00 54.58 52.24 1x8l n ASN 289 Cb 0.15 -0.25 -0.03 0.00 -0.61 0.00 0.00 39.78 39.04 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 -1.22 6.32 0.62 6.41 3.84 -0.35 -4.89 114.94 125.66 1x8l s ASN 290 Ca 0.33 -1.21 0.30 0.00 0.21 0.00 0.00 52.86 52.49 1x8l s ASN 290 Cb 0.18 -2.46 1.64 0.00 -0.55 0.00 0.00 41.25 40.06 1x8l s ASN 290 CO 0.24 -1.43 1.99 1.23 -2.79 0.00 0.00 177.10 176.35 1x8l h GLY 291 N 11.60 0.00 2.00 1.21 0.00 -1.86 -0.43 103.07 115.60 1x8l h GLY 291 Ca -0.12 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.20 1x8l h GLY 291 CO 1.21 0.00 -0.04 0.00 0.00 0.00 0.00 176.54 177.71 1x8l h ALA 292 N 1.54 1.06 0.00 3.60 0.00 -1.89 -3.36 119.26 120.21 1x8l h ALA 292 Ca 0.09 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1x8l h ALA 292 Cb 0.73 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1x8l h ALA 292 CO -0.00 0.05 -0.01 1.33 0.00 0.00 0.00 179.25 180.62 1x8l n VAL 293 N -3.23 0.00 1.34 0.00 0.24 -0.29 -1.28 118.33 115.11 1x8l n VAL 293 Ca -0.01 -0.27 0.11 0.00 -2.04 0.00 0.00 64.34 62.13 1x8l n VAL 293 Cb 0.24 0.98 0.42 0.00 -1.47 0.00 0.00 33.84 34.01 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 -0.56 1.47 -1.23 -1.34 0.23 -0.51 -4.93 115.26 108.38 1x8l n ASN 294 Ca 0.00 -1.65 -0.16 0.00 -0.53 0.00 0.00 54.58 52.24 1x8l n ASN 294 Cb 0.00 -0.08 -0.07 0.00 -2.08 0.00 0.00 39.78 37.55 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 0.18 -1.58 0.14 -3.83 2.81 -1.26 -4.35 117.12 109.23 1x8l n MET 295 Ca 0.16 1.06 0.12 0.00 -1.81 0.00 0.00 57.70 57.23 1x8l n MET 295 Cb 0.30 -5.46 0.50 0.00 -0.71 0.00 0.00 33.22 27.85 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 -0.03 0.03 4.39 -1.92 -2.39 114.58 114.66 1x8l h GLU 296 Ca -0.33 0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.38 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 0.48 0.00 0.04 0.38 -1.16 0.00 0.00 179.01 178.75 1x8l h ASP 297 N 0.00 0.00 1.34 1.42 2.03 -1.88 -2.15 116.42 117.18 1x8l h ASP 297 Ca 0.00 0.00 -0.14 0.00 -0.73 0.00 0.00 57.03 56.16 1x8l h ASP 297 Cb 0.41 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 38.89 1x8l h ASP 297 CO 0.00 0.00 -0.64 1.88 -1.03 0.00 0.00 179.24 179.45 1x8l h TYR 298 N 0.00 0.00 -0.31 4.15 -1.99 -1.83 -3.09 116.97 113.90 1x8l h TYR 298 Ca 0.02 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.73 1x8l h TYR 298 Cb 0.09 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 38.80 1x8l h TYR 298 CO 0.00 0.64 0.10 -0.09 -0.00 0.00 0.00 178.16 178.82 1x8l h ARG 299 N 0.00 0.43 -0.55 4.88 2.43 -1.53 -1.56 114.38 118.49 1x8l h ARG 299 Ca -0.01 -0.06 -0.07 0.00 -0.81 0.00 0.00 59.98 59.04 1x8l h ARG 299 Cb 1.49 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 30.93 1x8l h ARG 299 CO 0.08 0.38 0.07 0.93 -1.51 0.00 0.00 179.97 179.93 1x8l h GLU 300 N 0.43 0.89 -0.42 0.20 5.08 -1.57 -2.59 114.58 116.61 1x8l h GLU 300 Ca 0.11 -0.22 -0.06 0.00 -1.00 0.00 0.00 59.36 58.19 1x8l h GLU 300 Cb 0.13 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 1x8l h GLU 300 CO -0.01 0.84 0.03 0.82 -1.00 0.00 0.00 179.01 179.69 1x8l h ILE 301 N 0.84 1.22 0.00 3.13 2.04 -1.32 -3.41 117.51 120.01 1x8l h ILE 301 Ca 0.17 -0.85 0.00 0.00 1.00 0.00 0.00 64.86 65.18 1x8l h ILE 301 Cb 0.40 0.87 0.00 0.00 -0.74 0.00 0.00 36.82 37.35 1x8l h ILE 301 CO 0.01 0.30 0.00 0.61 0.00 0.00 0.00 178.15 179.07 1x8l n GLY 302 N -0.81 1.93 0.00 5.37 0.00 -0.87 -2.14 105.19 108.67 1x8l n GLY 302 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 -0.86 0.86 -4.59 -0.61 -5.35 -1.22 -4.85 119.36 102.74 1x8l n ILE 303 Ca 0.00 -0.88 -0.34 0.00 -0.27 0.00 0.00 62.75 61.26 1x8l n ILE 303 Cb 0.00 0.57 -0.11 0.00 -1.74 0.00 0.00 39.64 38.36 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 -0.86 3.18 0.34 7.28 1.43 -1.26 -4.66 118.68 124.13 1x8l s LEU 304 Ca 0.00 -0.05 -0.27 0.00 -1.03 0.00 0.00 54.13 52.78 1x8l s LEU 304 Cb 0.00 -1.71 -0.09 0.00 0.03 0.00 0.00 46.19 44.42 1x8l s LEU 304 CO 0.00 0.32 1.10 0.00 0.23 0.00 0.00 176.35 178.00 1x8l s ALA 305 N -0.56 3.26 0.49 4.21 0.00 -0.13 -4.96 121.76 124.06 1x8l s ALA 305 Ca 0.08 0.86 -0.23 0.00 0.00 0.00 0.00 51.96 52.67 1x8l s ALA 305 Cb -0.12 -3.32 -0.07 0.00 0.00 0.00 0.00 23.12 19.60 1x8l s ALA 305 CO 0.02 -0.26 1.26 -0.25 0.00 0.00 0.00 175.76 176.53 1x8l n ASP 306 N 0.56 2.37 -0.60 0.00 8.00 -1.26 -2.92 116.55 122.70 1x8l n ASP 306 Ca 0.02 1.02 -0.08 0.00 0.71 0.00 0.00 54.79 56.46 1x8l n ASP 306 Cb 0.47 -1.51 -0.03 0.00 -0.02 0.00 0.00 41.12 40.02 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 0.85 0.97 3.20 0.44 0.00 -1.26 -5.02 105.19 104.37 1x8l n GLY 307 Ca 0.09 -0.49 -0.17 0.00 0.00 0.00 0.00 46.02 45.44 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 -2.47 0.90 -0.04 1.61 0.41 -1.15 -5.07 118.70 112.88 1x8l s GLU 308 Ca 0.00 -1.10 -0.05 0.00 -0.41 0.00 0.00 54.97 53.41 1x8l s GLU 308 Cb 0.00 -0.78 0.01 0.00 -1.78 0.00 0.00 34.13 31.58 1x8l s GLU 308 CO 0.00 0.16 0.14 -1.01 -0.49 0.00 0.00 175.26 174.05 1x8l s HIS 309 N -1.84 -0.11 0.25 1.61 3.76 -1.26 -4.85 115.29 112.85 1x8l s HIS 309 Ca 0.03 0.26 -0.05 0.00 -0.15 0.00 0.00 55.06 55.16 1x8l s HIS 309 Cb -0.07 0.03 0.29 0.00 1.11 0.00 0.00 32.58 33.94 1x8l s HIS 309 CO 0.02 -0.12 1.85 0.35 -0.85 0.00 0.00 174.74 175.99 1x8l h PHE 310 N 5.57 1.10 -3.60 1.40 3.57 -1.95 -3.35 116.94 119.68 1x8l h PHE 310 Ca -0.26 -0.05 -0.70 0.00 3.53 0.00 0.00 57.97 60.49 1x8l h PHE 310 Cb 1.20 -0.34 -0.21 0.00 2.79 0.00 0.00 35.95 39.38 1x8l h PHE 310 CO 0.45 0.80 -0.48 0.42 -2.23 0.00 0.00 178.31 177.27 1x8l s ILE 311 N -5.62 5.02 0.00 1.41 -1.09 -1.26 -5.01 121.20 114.64 1x8l s ILE 311 Ca -0.12 -0.54 0.00 0.00 -2.23 0.00 0.00 60.65 57.76 1x8l s ILE 311 Cb 0.16 -3.70 0.00 0.00 -1.58 0.00 0.00 42.46 37.34 1x8l s ILE 311 CO 0.82 -0.15 0.00 -1.14 -1.23 0.00 0.00 174.94 173.24 1x8l n ARG 312 N 5.08 0.00 0.00 2.79 0.63 -1.26 -4.96 116.66 118.95 1x8l n ARG 312 Ca -0.12 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.81 1x8l n ARG 312 Cb 0.48 -0.13 0.00 0.00 0.45 0.00 0.00 32.46 33.26 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 -1.80 0.00 -2.52 -0.14 4.76 -1.26 -5.04 118.16 112.16 1x8l n LYS 313 Ca 0.00 0.00 -0.06 0.00 -2.87 0.00 0.00 58.31 55.38 1x8l n LYS 313 Cb 0.00 -0.73 0.01 0.00 -1.84 0.00 0.00 35.03 32.47 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 2.76 0.40 3.62 0.72 0.00 -1.26 -5.05 105.19 106.38 1x8l n GLY 314 Ca 0.00 -0.52 -0.23 0.00 0.00 0.00 0.00 46.02 45.27 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 -4.93 2.21 -0.04 1.61 -0.14 -1.26 -5.05 119.74 112.15 1x8l s LYS 315 Ca 0.09 -1.46 -0.01 0.00 -1.36 0.00 0.00 55.97 53.24 1x8l s LYS 315 Cb -0.04 -2.11 -0.04 0.00 -1.68 0.00 0.00 37.83 33.96 1x8l s LYS 315 CO 0.12 0.36 0.03 0.00 -0.76 0.00 0.00 175.35 175.10 1x8l s ALA 316 N -2.34 3.40 0.00 5.17 0.00 -1.26 -4.71 121.76 122.02 1x8l s ALA 316 Ca 0.31 -0.86 0.00 0.00 0.00 0.00 0.00 51.96 51.41 1x8l s ALA 316 Cb -0.06 -1.49 0.00 0.00 0.00 0.00 0.00 23.12 21.57 1x8l s ALA 316 CO 0.19 0.64 0.00 0.41 0.00 0.00 0.00 175.76 177.00 1x8l n GLY 317 N 1.64 0.63 0.05 0.00 0.00 -1.26 -4.93 105.19 101.31 1x8l n GLY 317 Ca -0.16 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.02 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 0.24 0.00 -0.03 0.00 5.08 -1.92 -1.62 115.95 117.71 1x8l h TRP 319 Ca 0.00 0.00 0.01 0.00 1.08 0.00 0.00 58.89 59.98 1x8l h TRP 319 Cb 0.11 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 26.27 1x8l h TRP 319 CO 0.00 0.00 0.06 0.00 -1.28 0.00 0.00 178.44 177.22 1x8l h ARG 320 N 0.00 0.00 0.00 0.12 3.08 -1.89 -0.85 114.38 114.84 1x8l h ARG 320 Ca 0.22 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.27 1x8l h ARG 320 Cb 1.05 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.10 1x8l h ARG 320 CO -0.00 0.00 0.00 -0.25 -1.07 0.00 0.00 179.97 178.65 1x8l n ASP 321 N -3.43 0.31 -0.00 7.04 8.00 -0.61 -3.92 116.55 123.93 1x8l n ASP 321 Ca -0.02 0.53 0.05 0.00 0.71 0.00 0.00 54.79 56.06 1x8l n ASP 321 Cb 0.14 -0.61 -0.08 0.00 -0.02 0.00 0.00 41.12 40.55 1x8l n ASP 321 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1x8l n TYR 322 N -1.79 0.00 -4.10 1.24 4.02 -0.35 -5.01 117.16 111.17 1x8l n TYR 322 Ca 0.06 0.00 -0.35 0.00 -0.01 0.00 0.00 57.90 57.61 1x8l n TYR 322 Cb 0.37 -0.14 -0.12 0.00 -0.02 0.00 0.00 39.34 39.43 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 -2.44 3.10 0.85 -0.72 0.40 -1.04 -4.88 117.98 113.26 1x8l s PHE 323 Ca -0.00 -0.25 -0.10 0.00 -0.60 0.00 0.00 56.93 55.97 1x8l s PHE 323 Cb 0.08 -2.07 0.19 0.00 0.51 0.00 0.00 43.02 41.72 1x8l s PHE 323 CO 0.45 -0.09 1.17 -0.40 0.70 0.00 0.00 175.22 177.05 1x8l n ASP 324 N 3.95 0.51 -0.11 1.36 3.85 -1.26 -4.80 116.55 120.05 1x8l n ASP 324 Ca -0.17 -1.68 -0.07 0.00 -0.71 0.00 0.00 54.79 52.16 1x8l n ASP 324 Cb 0.52 -0.85 0.10 0.00 -1.35 0.00 0.00 41.12 39.54 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 0.82 -0.06 0.11 9.09 -1.99 -0.59 114.58 121.96 1x8l h GLU 325 Ca -0.38 -0.28 -0.02 0.00 0.05 0.00 0.00 59.36 58.73 1x8l h GLU 325 Cb 1.15 -0.06 -0.00 0.00 -1.65 0.00 0.00 28.75 28.18 1x8l h GLU 325 CO 0.31 0.90 -0.02 1.49 0.05 0.00 0.00 179.01 181.74 1x8l h GLU 326 N 0.74 0.12 -0.79 1.06 4.57 -2.00 -2.55 114.58 115.73 1x8l h GLU 326 Ca 0.12 -0.05 0.09 0.00 -1.18 0.00 0.00 59.36 58.34 1x8l h GLU 326 Cb 0.62 -0.00 -0.07 0.00 -0.16 0.00 0.00 28.75 29.13 1x8l h GLU 326 CO 0.04 0.48 0.44 0.52 -1.18 0.00 0.00 179.01 179.32 1x8l h MET 327 N -0.25 0.73 -0.55 1.92 2.86 -1.89 -1.31 114.93 116.43 1x8l h MET 327 Ca 0.01 -0.04 0.07 0.00 -2.06 0.00 0.00 59.70 57.68 1x8l h MET 327 Cb 0.44 -0.16 -0.06 0.00 0.06 0.00 0.00 31.60 31.88 1x8l h MET 327 CO 0.01 0.48 0.25 1.15 1.06 0.00 0.00 176.91 179.86 1x8l h THR 328 N 0.75 0.88 -0.02 2.22 2.02 -0.83 0.48 112.91 118.41 1x8l h THR 328 Ca 0.38 -0.16 -0.16 0.00 0.77 0.00 0.00 66.41 67.24 1x8l h THR 328 Cb 0.34 0.37 -0.02 0.00 -1.74 0.00 0.00 68.15 67.11 1x8l h THR 328 CO -0.24 0.09 -0.74 0.11 0.37 0.00 0.00 175.52 175.11 1x8l h LYS 329 N 0.47 0.13 -0.42 6.66 1.79 -1.12 -1.43 116.57 122.65 1x8l h LYS 329 Ca 0.26 -0.12 -0.09 0.00 -2.18 0.00 0.00 60.65 58.53 1x8l h LYS 329 Cb 0.24 0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 30.90 1x8l h LYS 329 CO -0.22 0.81 -0.09 0.37 -1.08 0.00 0.00 179.45 179.23 1x8l h GLN 330 N 0.09 0.74 -0.28 3.15 4.15 -0.75 -0.81 115.11 121.40 1x8l h GLN 330 Ca -0.02 -0.23 -0.10 0.00 0.77 0.00 0.00 58.65 59.07 1x8l h GLN 330 Cb 1.30 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 28.91 1x8l h GLN 330 CO 0.11 0.81 -0.20 0.00 -1.93 0.00 0.00 178.83 177.61 1x8l h ALA 331 N 1.22 0.40 -0.12 3.38 0.00 -0.67 -2.25 119.26 121.22 1x8l h ALA 331 Ca 0.12 -0.36 0.03 0.00 0.00 0.00 0.00 54.91 54.70 1x8l h ALA 331 Cb 0.55 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 1x8l h ALA 331 CO 0.03 0.34 -0.05 0.93 0.00 0.00 0.00 179.25 180.51 1x8l h GLU 332 N 0.37 -0.03 -0.57 0.00 5.08 -1.09 -0.83 114.58 117.50 1x8l h GLU 332 Ca 0.05 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.47 1x8l h GLU 332 Cb 0.75 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.97 1x8l h GLU 332 CO 0.05 -0.02 0.38 -0.22 -1.00 0.00 0.00 179.01 178.20 1x8l h LYS 333 N -0.03 0.56 0.01 2.33 3.64 -1.16 -0.04 116.57 121.88 1x8l h LYS 333 Ca 0.07 -0.03 -0.11 0.00 -1.27 0.00 0.00 60.65 59.31 1x8l h LYS 333 Cb 0.13 -0.13 0.01 0.00 -0.41 0.00 0.00 32.23 31.83 1x8l h LYS 333 CO -0.14 0.37 -0.42 2.35 -2.27 0.00 0.00 179.45 179.33 1x8l h TRP 334 N 0.58 0.40 -0.21 1.91 7.01 -0.87 -1.47 115.95 123.30 1x8l h TRP 334 Ca 0.24 -0.23 -0.02 0.00 2.11 0.00 0.00 58.89 60.99 1x8l h TRP 334 Cb 0.23 -0.04 -0.01 0.00 -2.10 0.00 0.00 29.16 27.24 1x8l h TRP 334 CO -0.00 1.06 0.05 0.82 -2.79 0.00 0.00 178.44 177.58 1x8l h ILE 335 N -0.37 1.20 -0.15 2.65 2.04 -1.13 -2.52 117.51 119.24 1x8l h ILE 335 Ca -0.06 -0.66 0.04 0.00 1.00 0.00 0.00 64.86 65.18 1x8l h ILE 335 Cb 1.18 1.24 -0.04 0.00 -0.74 0.00 0.00 36.82 38.47 1x8l h ILE 335 CO 0.08 0.21 -0.11 0.50 0.00 0.00 0.00 178.15 178.83 1x8l h LYS 336 N 0.16 -0.11 -0.71 2.37 3.64 -1.05 -0.18 116.57 120.69 1x8l h LYS 336 Ca 0.07 0.01 0.07 0.00 -1.27 0.00 0.00 60.65 59.53 1x8l h LYS 336 Cb 0.27 0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.07 1x8l h LYS 336 CO 0.00 -0.07 0.47 -0.44 -2.27 0.00 0.00 179.45 177.14 1x8l h ASP 337 N -0.11 0.62 1.24 4.20 3.45 -1.24 -2.19 116.42 122.39 1x8l h ASP 337 Ca 0.09 0.01 0.00 0.00 0.43 0.00 0.00 57.03 57.56 1x8l h ASP 337 Cb 0.25 -0.13 0.00 0.00 -0.56 0.00 0.00 39.33 38.89 1x8l h ASP 337 CO -0.21 0.39 -0.62 0.78 -1.57 0.00 0.00 179.24 178.01 1x8l h ASN 338 N 0.70 0.00 -0.02 6.45 2.35 -0.94 -3.29 115.58 120.83 1x8l h ASN 338 Ca 0.31 -0.05 0.00 0.00 -0.55 0.00 0.00 56.30 56.01 1x8l h ASN 338 Cb 0.32 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.69 1x8l h ASN 338 CO -0.10 0.02 -0.22 0.18 -1.65 0.00 0.00 177.43 175.65 1x8l n LEU 339 N -2.63 2.47 -4.74 1.61 4.77 -0.14 -4.83 117.00 113.51 1x8l n LEU 339 Ca 0.02 -0.86 -0.41 0.00 -0.03 0.00 0.00 56.01 54.73 1x8l n LEU 339 Cb 0.51 -0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.57 1x8l n LEU 339 CO 0.37 0.43 0.87 -0.75 -1.33 0.00 0.00 177.39 176.98 1x8l s LYS 340 N -2.23 4.51 -1.77 3.23 2.20 -0.86 -3.01 119.74 121.81 1x8l s LYS 340 Ca 0.24 1.85 0.00 0.00 -0.36 0.00 0.00 55.97 57.70 1x8l s LYS 340 Cb 0.19 -3.24 0.00 0.00 -1.51 0.00 0.00 37.83 33.27 1x8l s LYS 340 CO 0.43 -0.06 0.00 -0.25 -0.36 0.00 0.00 175.35 175.11 1x8l n ASP 341 N 2.44 -5.21 -4.19 1.43 8.00 -1.26 -4.99 116.55 112.77 1x8l n ASP 341 Ca 0.04 0.26 -0.13 0.00 0.71 0.00 0.00 54.79 55.67 1x8l n ASP 341 Cb 0.45 -4.29 -0.10 0.00 -0.02 0.00 0.00 41.12 37.16 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 -2.76 0.90 -2.66 -3.53 -4.23 -1.16 -5.05 115.64 97.14 1x8l s THR 342 Ca 0.00 -1.82 0.26 0.00 -1.18 0.00 0.00 61.69 58.95 1x8l s THR 342 Cb 0.00 -1.56 0.42 0.00 1.34 0.00 0.00 72.50 72.70 1x8l s THR 342 CO 0.00 -0.70 1.56 -0.90 -0.54 0.00 0.00 174.62 174.04 1x8l n ASP 343 N 0.20 2.06 -4.67 3.99 5.75 -1.26 -4.92 116.55 117.71 1x8l n ASP 343 Ca -0.14 -1.69 -0.42 0.00 -0.01 0.00 0.00 54.79 52.53 1x8l n ASP 343 Cb 0.59 -0.01 -0.03 0.00 -1.03 0.00 0.00 41.12 40.65 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 -1.97 4.41 0.03 -2.12 2.96 -1.26 -4.99 118.68 115.73 1x8l s LEU 344 Ca 0.34 2.64 0.02 0.00 -0.22 0.00 0.00 54.13 56.91 1x8l s LEU 344 Cb 0.21 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 43.34 1x8l s LEU 344 CO 0.32 -1.02 -0.06 -0.13 -1.32 0.00 0.00 176.35 174.14 1x8l s ARG 345 N 3.90 0.44 -0.03 1.98 1.81 -1.26 -4.92 118.95 120.87 1x8l s ARG 345 Ca 0.84 -0.61 -0.03 0.00 -1.72 0.00 0.00 55.73 54.22 1x8l s ARG 345 Cb -0.42 -0.20 -0.04 0.00 -0.45 0.00 0.00 34.95 33.84 1x8l s ARG 345 CO 0.39 0.03 0.14 0.71 -0.68 0.00 0.00 175.30 175.88 1x8l s TYR 346 N -1.16 3.46 0.20 -0.53 1.51 -1.26 -5.05 117.35 114.52 1x8l s TYR 346 Ca -0.09 0.33 -0.10 0.00 -1.01 0.00 0.00 57.07 56.20 1x8l s TYR 346 Cb -0.08 -1.82 0.18 0.00 -0.11 0.00 0.00 41.96 40.13 1x8l s TYR 346 CO -0.00 0.63 1.84 -1.35 -1.11 0.00 0.00 175.55 175.56 1x8l h PRO 347 N 4.16 0.80 -0.38 -1.71 0.11 -2.00 -3.13 132.00 129.85 1x8l h PRO 347 Ca -0.50 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.56 1x8l h PRO 347 Cb 1.19 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.12 1x8l h PRO 347 CO 0.64 0.53 0.00 0.09 -0.21 0.00 0.00 178.00 179.05 1x8l n ASN 348 N -4.68 2.70 -0.89 -2.05 5.03 -1.26 -5.15 115.26 108.96 1x8l n ASN 348 Ca 0.07 -1.92 0.12 0.00 0.87 0.00 0.00 54.58 53.73 1x8l n ASN 348 Cb 0.09 -0.25 0.17 0.00 -1.02 0.00 0.00 39.78 38.76 1x8l n ASN 348 CO 0.00 0.00 0.00 0.23 -1.83 0.00 0.00 177.26 175.66