#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1q8a s ASN 3 N 0.00 5.23 0.52 0.55 2.20 -1.26 -4.55 114.94 117.63 1q8a s ASN 3 Ca 0.00 -0.59 0.20 0.00 -0.94 0.00 0.00 52.86 51.53 1q8a s ASN 3 Cb 0.00 -0.15 1.36 0.00 -2.00 0.00 0.00 41.25 40.46 1q8a s ASN 3 CO 0.00 -1.18 2.13 0.08 -2.94 0.00 0.00 177.10 175.20 1q8a h ARG 4 N 0.26 0.00 -0.24 3.55 0.11 -1.13 -1.67 114.38 115.26 1q8a h ARG 4 Ca -0.35 0.00 -0.11 0.00 0.10 0.00 0.00 59.98 59.62 1q8a h ARG 4 Cb 1.28 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.36 1q8a h ARG 4 CO 0.43 0.05 -0.27 -0.09 0.10 0.00 0.00 179.97 180.19 1q8a h ARG 5 N 0.00 0.61 -0.52 0.08 2.43 -1.95 -1.73 114.38 113.31 1q8a h ARG 5 Ca -0.00 -0.34 -0.03 0.00 -0.81 0.00 0.00 59.98 58.80 1q8a h ARG 5 Cb 0.10 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.64 1q8a h ARG 5 CO 0.01 0.94 0.19 0.93 -1.51 0.00 0.00 179.97 180.52 1q8a h GLU 6 N 0.32 0.78 -0.60 0.20 5.08 -1.83 -1.24 114.58 117.30 1q8a h GLU 6 Ca 0.04 -0.15 -0.06 0.00 -1.00 0.00 0.00 59.36 58.18 1q8a h GLU 6 Cb 0.84 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.94 1q8a h GLU 6 CO 0.07 0.70 0.15 0.28 -1.00 0.00 0.00 179.01 179.21 1q8a h VAL 7 N 0.70 1.25 -0.95 3.13 2.07 -1.32 -1.54 116.25 119.58 1q8a h VAL 7 Ca 0.17 -0.91 0.01 0.00 0.82 0.00 0.00 66.70 66.79 1q8a h VAL 7 Cb 0.23 0.69 -0.05 0.00 -1.52 0.00 0.00 31.29 30.63 1q8a h VAL 7 CO -0.01 0.34 0.63 0.28 0.02 0.00 0.00 177.57 178.83 1q8a h SER 8 N 0.88 1.10 -0.30 0.57 0.02 -1.13 0.11 113.55 114.79 1q8a h SER 8 Ca 0.19 -0.03 -0.03 0.00 -0.84 0.00 0.00 61.79 61.08 1q8a h SER 8 Cb 0.35 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.60 1q8a h SER 8 CO 0.00 0.80 0.08 0.50 -1.14 0.00 0.00 176.83 177.06 1q8a h LYS 9 N 1.30 0.48 -0.80 3.45 3.64 -0.94 -1.04 116.57 122.66 1q8a h LYS 9 Ca 0.35 -0.11 -0.00 0.00 -1.27 0.00 0.00 60.65 59.62 1q8a h LYS 9 Cb -0.15 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 31.57 1q8a h LYS 9 CO -0.08 0.55 0.50 1.25 -2.27 0.00 0.00 179.45 179.40 1q8a h LEU 10 N 0.32 0.94 -1.09 5.20 5.85 -0.78 -2.37 115.31 123.39 1q8a h LEU 10 Ca 0.09 -0.05 -0.09 0.00 0.84 0.00 0.00 57.88 58.68 1q8a h LEU 10 Cb 0.29 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.07 1q8a h LEU 10 CO 0.00 0.72 -0.29 -0.07 -0.34 0.00 0.00 178.44 178.45 1q8a h LEU 11 N 1.09 0.28 -1.51 2.25 3.38 -0.72 -1.41 115.31 118.66 1q8a h LEU 11 Ca 0.29 -0.09 -0.05 0.00 0.09 0.00 0.00 57.88 58.11 1q8a h LEU 11 Cb -0.07 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 1q8a h LEU 11 CO -0.06 0.57 -0.25 0.77 0.09 0.00 0.00 178.44 179.56 1q8a h SER 12 N 0.24 0.00 0.48 -0.43 4.64 -0.69 -3.04 113.55 114.75 1q8a h SER 12 Ca 0.03 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 61.06 1q8a h SER 12 Cb 0.65 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.70 1q8a h SER 12 CO 0.05 0.25 -1.68 -0.33 -0.87 0.00 0.00 176.83 174.25 1q8a h GLU 13 N 0.00 0.06 -2.21 4.77 5.08 -1.03 -3.40 114.58 117.85 1q8a h GLU 13 Ca -0.00 -0.10 -0.07 0.00 -1.00 0.00 0.00 59.36 58.19 1q8a h GLU 13 Cb 0.52 0.04 -0.19 0.00 0.50 0.00 0.00 28.75 29.62 1q8a h GLU 13 CO 0.03 0.69 0.12 -0.98 -1.00 0.00 0.00 179.01 177.87 1q8a s ARG 14 N -2.60 1.01 0.06 2.33 1.70 -0.58 -4.23 118.95 116.62 1q8a s ARG 14 Ca -0.07 0.16 -0.30 0.00 -0.47 0.00 0.00 55.73 55.04 1q8a s ARG 14 Cb 0.08 0.47 -0.05 0.00 -0.57 0.00 0.00 34.95 34.88 1q8a s ARG 14 CO 0.82 -0.32 1.11 0.08 -1.08 0.00 0.00 175.30 175.91 1q8a s VAL 15 N -1.32 4.30 0.20 4.99 1.01 -0.20 -4.35 120.40 125.03 1q8a s VAL 15 Ca -0.11 1.68 0.05 0.00 0.00 0.00 0.00 61.98 63.61 1q8a s VAL 15 Cb -0.01 -4.08 -0.04 0.00 0.00 0.00 0.00 36.38 32.26 1q8a s VAL 15 CO 0.08 0.15 0.22 -0.76 0.00 0.00 0.00 175.10 174.79 1q8a s LEU 16 N 0.86 3.99 -0.22 3.92 1.43 -0.36 -4.74 118.68 123.56 1q8a s LEU 16 Ca 0.55 -0.09 -0.09 0.00 -1.03 0.00 0.00 54.13 53.47 1q8a s LEU 16 Cb -0.27 -2.55 -0.04 0.00 0.03 0.00 0.00 46.19 43.36 1q8a s LEU 16 CO 0.29 0.01 0.12 -0.22 0.23 0.00 0.00 176.35 176.78 1q8a s LEU 17 N -3.52 3.96 0.00 1.79 2.96 -1.26 -1.05 118.68 121.56 1q8a s LEU 17 Ca 0.33 0.08 0.00 0.00 -0.22 0.00 0.00 54.13 54.32 1q8a s LEU 17 Cb -0.09 -2.04 0.00 0.00 0.50 0.00 0.00 46.19 44.56 1q8a s LEU 17 CO 0.26 0.10 0.00 0.18 -1.32 0.00 0.00 176.35 175.57 1q8a n LEU 18 N 4.04 0.00 0.00 -0.68 4.77 0.19 -0.43 117.00 124.89 1q8a n LEU 18 Ca -0.16 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.74 1q8a n LEU 18 Cb 0.52 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.62 1q8a n LEU 18 CO 0.35 -0.10 0.06 -0.90 -1.33 0.00 0.00 177.39 175.47 1q8a n ASP 19 N -0.57 1.30 -0.27 -1.43 3.85 -1.18 -4.58 116.55 113.68 1q8a n ASP 19 Ca 0.00 -1.60 0.00 0.00 -0.71 0.00 0.00 54.79 52.48 1q8a n ASP 19 Cb 0.00 -0.06 0.00 0.00 -1.35 0.00 0.00 41.12 39.71 1q8a n ASP 19 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1q8a n GLY 20 N 2.72 1.81 3.90 6.12 0.00 -1.26 -1.89 105.19 116.59 1q8a n GLY 20 Ca 0.01 -1.84 -0.28 0.00 0.00 0.00 0.00 46.02 43.92 1q8a n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q8a s ALA 21 N -3.10 3.40 -0.05 4.61 0.00 -0.85 -4.75 121.76 121.02 1q8a s ALA 21 Ca 0.00 -0.47 -0.03 0.00 0.00 0.00 0.00 51.96 51.46 1q8a s ALA 21 Cb 0.00 -2.60 -0.02 0.00 0.00 0.00 0.00 23.12 20.50 1q8a s ALA 21 CO 0.00 -0.30 -0.08 0.66 0.00 0.00 0.00 175.76 176.04 1q8a n TYR 22 N -2.13 0.00 -0.19 0.00 4.02 -1.26 -4.40 117.16 113.20 1q8a n TYR 22 Ca 0.01 0.00 -0.02 0.00 -0.01 0.00 0.00 57.90 57.87 1q8a n TYR 22 Cb 0.55 -0.21 0.08 0.00 -0.02 0.00 0.00 39.34 39.74 1q8a n TYR 22 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 1q8a h GLY 23 N -0.22 0.79 1.47 2.72 0.00 -1.99 0.74 103.07 106.57 1q8a h GLY 23 Ca -0.14 -0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.03 1q8a h GLY 23 CO -0.08 0.07 0.00 -1.30 0.00 0.00 0.00 176.54 175.23 1q8a n THR 24 N -4.92 0.13 -0.07 4.70 -2.24 -1.26 -3.51 114.28 107.12 1q8a n THR 24 Ca 0.06 0.03 -0.16 0.00 -2.27 0.00 0.00 64.05 61.72 1q8a n THR 24 Cb 0.19 -0.61 -0.14 0.00 -2.10 0.00 0.00 70.33 67.68 1q8a n THR 24 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1q8a n GLU 25 N -1.24 0.69 0.00 -0.78 -0.58 0.13 -4.64 120.64 114.22 1q8a n GLU 25 Ca 0.14 0.17 0.00 0.00 -0.42 0.00 0.00 57.16 57.05 1q8a n GLU 25 Cb 0.19 -1.61 0.00 0.00 -0.57 0.00 0.00 31.44 29.44 1q8a n GLU 25 CO 0.00 0.00 0.00 1.19 -0.48 0.00 0.00 177.13 177.84 1q8a n PHE 26 N -3.20 0.00 0.00 -0.32 0.99 -0.44 -3.57 117.46 110.92 1q8a n PHE 26 Ca -0.35 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.10 1q8a n PHE 26 Cb 1.05 -0.17 0.00 0.00 -1.00 0.00 0.00 39.48 39.35 1q8a n PHE 26 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.76 178.39 1q8a n LYS 28 N 1.58 0.00 0.00 -1.08 5.02 -1.26 -2.34 118.16 120.08 1q8a n LYS 28 Ca 0.00 0.00 0.12 0.00 -2.02 0.00 0.00 58.31 56.41 1q8a n LYS 28 Cb 0.00 0.00 0.21 0.00 -0.02 0.00 0.00 35.03 35.22 1q8a n LYS 28 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1q8a n TYR 29 N 0.00 0.00 -0.20 2.13 4.02 -1.23 -4.93 117.16 116.94 1q8a n TYR 29 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 1q8a n TYR 29 Cb 0.00 -0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.32 1q8a n TYR 29 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1q8a n GLY 30 N 1.31 0.90 3.12 2.72 0.00 -1.15 -5.06 105.19 107.03 1q8a n GLY 30 Ca 0.15 -0.02 -0.34 0.00 0.00 0.00 0.00 46.02 45.81 1q8a n GLY 30 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1q8a s TYR 31 N -2.00 3.36 -0.60 1.61 1.51 -0.99 -4.95 117.35 115.29 1q8a s TYR 31 Ca 0.00 -2.21 0.15 0.00 -1.01 0.00 0.00 57.07 54.00 1q8a s TYR 31 Cb 0.00 -2.25 0.50 0.00 -0.11 0.00 0.00 41.96 40.10 1q8a s TYR 31 CO 0.00 -0.86 1.42 -0.40 -1.11 0.00 0.00 175.55 174.59 1q8a n ASP 32 N 4.51 3.80 -4.64 2.29 5.75 -1.26 -4.68 116.55 122.32 1q8a n ASP 32 Ca -0.10 -2.57 -0.30 0.00 -0.01 0.00 0.00 54.79 51.81 1q8a n ASP 32 Cb 0.43 -0.45 0.18 0.00 -1.03 0.00 0.00 41.12 40.24 1q8a n ASP 32 CO 0.00 0.00 0.00 -1.81 -0.11 0.00 0.00 177.20 175.28 1q8a s ASP 33 N -1.39 2.58 0.19 -1.12 1.01 -1.26 -4.90 116.67 111.78 1q8a s ASP 33 Ca 0.38 1.72 -0.33 0.00 0.71 0.00 0.00 52.55 55.03 1q8a s ASP 33 Cb 0.27 -2.35 -0.13 0.00 1.01 0.00 0.00 42.92 41.72 1q8a s ASP 33 CO 0.14 -3.24 1.57 0.18 0.21 0.00 0.00 175.17 174.03 1q8a n LEU 34 N -4.29 3.35 -0.24 1.23 4.77 -1.26 -4.84 117.00 115.71 1q8a n LEU 34 Ca 0.07 1.10 0.05 0.00 -0.03 0.00 0.00 56.01 57.19 1q8a n LEU 34 Cb 0.54 -1.46 0.16 0.00 -2.33 0.00 0.00 43.42 40.32 1q8a n LEU 34 CO 0.54 -0.22 0.87 -0.65 -1.33 0.00 0.00 177.39 176.61 1q8a h PRO 35 N 5.63 0.17 -0.34 3.23 0.11 -1.96 -1.21 132.00 137.63 1q8a h PRO 35 Ca -0.45 -0.01 0.03 0.00 0.11 0.00 0.00 66.00 65.68 1q8a h PRO 35 Cb 1.25 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 32.30 1q8a h PRO 35 CO 0.87 0.11 0.23 0.93 -0.21 0.00 0.00 178.00 179.93 1q8a h GLU 36 N 0.17 0.34 0.00 1.05 3.07 -1.89 -1.41 114.58 115.92 1q8a h GLU 36 Ca 0.40 -0.02 -0.04 0.00 -0.50 0.00 0.00 59.36 59.19 1q8a h GLU 36 Cb 0.68 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 28.51 1q8a h GLU 36 CO -0.57 0.23 -0.20 1.49 -1.40 0.00 0.00 179.01 178.56 1q8a h GLU 37 N 0.35 0.00 0.00 2.33 4.57 -1.57 -2.57 114.58 117.69 1q8a h GLU 37 Ca 0.14 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.31 1q8a h GLU 37 Cb 0.12 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.71 1q8a h GLU 37 CO -0.03 0.20 -0.04 -0.07 -1.18 0.00 0.00 179.01 177.89 1q8a h LEU 38 N 0.00 0.00 -2.25 1.64 3.38 -1.27 -0.36 115.31 116.46 1q8a h LEU 38 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1q8a h LEU 38 Cb 0.53 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.28 1q8a h LEU 38 CO 0.03 0.04 -0.05 0.78 0.09 0.00 0.00 178.44 179.32 1q8a h ASN 39 N 0.00 0.00 0.00 -0.43 2.35 -1.58 -0.43 115.58 115.49 1q8a h ASN 39 Ca -0.00 0.00 -0.35 0.00 -0.55 0.00 0.00 56.30 55.39 1q8a h ASN 39 Cb 0.26 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 38.57 1q8a h ASN 39 CO 0.01 0.05 -2.24 -0.38 -1.65 0.00 0.00 177.43 173.22 1q8a n ILE 40 N -3.60 1.23 0.15 2.81 5.41 -0.30 -4.44 119.36 120.61 1q8a n ILE 40 Ca -0.02 -0.37 0.04 0.00 1.00 0.00 0.00 62.75 63.39 1q8a n ILE 40 Cb 0.16 -1.58 0.04 0.00 -0.71 0.00 0.00 39.64 37.55 1q8a n ILE 40 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 176.55 176.62 1q8a h LYS 41 N -0.48 0.00 -0.61 0.38 2.10 -1.13 -3.40 116.57 113.42 1q8a h LYS 41 Ca -0.53 0.00 -0.32 0.00 -2.00 0.00 0.00 60.65 57.80 1q8a h LYS 41 Cb 1.59 0.00 -0.22 0.00 -0.90 0.00 0.00 32.23 32.70 1q8a h LYS 41 CO -0.24 0.43 -0.67 0.00 -2.00 0.00 0.00 179.45 176.97 1q8a n ALA 42 N -2.22 -0.09 0.26 0.07 0.00 -0.24 -4.98 120.51 113.32 1q8a n ALA 42 Ca 0.02 -2.03 0.15 0.00 0.00 0.00 0.00 53.44 51.58 1q8a n ALA 42 Cb 0.71 -1.13 0.86 0.00 0.00 0.00 0.00 19.45 19.89 1q8a n ALA 42 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1q8a h PRO 43 N 3.48 0.00 -0.67 0.00 0.13 -1.59 -0.92 132.00 132.43 1q8a h PRO 43 Ca -0.06 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.06 1q8a h PRO 43 Cb 1.02 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.12 1q8a h PRO 43 CO 0.30 0.00 0.38 0.38 -0.23 0.00 0.00 178.00 178.83 1q8a h ASP 44 N 0.00 0.81 -0.30 1.44 2.03 -1.94 -1.25 116.42 117.21 1q8a h ASP 44 Ca 0.04 -0.05 -0.12 0.00 -0.73 0.00 0.00 57.03 56.16 1q8a h ASP 44 Cb 0.20 -0.20 -0.01 0.00 -0.83 0.00 0.00 39.33 38.48 1q8a h ASP 44 CO -0.00 0.64 -0.24 0.58 -1.03 0.00 0.00 179.24 179.18 1q8a h VAL 45 N 0.92 1.27 -0.41 4.15 2.07 -1.51 -1.44 116.25 121.30 1q8a h VAL 45 Ca 0.24 -1.37 -0.07 0.00 0.82 0.00 0.00 66.70 66.32 1q8a h VAL 45 Cb -0.00 1.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.98 1q8a h VAL 45 CO -0.04 0.46 -0.00 0.58 0.02 0.00 0.00 177.57 178.58 1q8a h VAL 46 N 0.69 1.26 -0.69 2.57 2.07 -1.42 -2.12 116.25 118.61 1q8a h VAL 46 Ca 0.09 -1.03 -0.01 0.00 0.82 0.00 0.00 66.70 66.57 1q8a h VAL 46 Cb 0.77 1.11 -0.03 0.00 -1.52 0.00 0.00 31.29 31.61 1q8a h VAL 46 CO 0.06 0.35 0.38 0.25 0.02 0.00 0.00 177.57 178.63 1q8a h LEU 47 N 0.56 0.87 -0.81 2.57 5.85 -1.06 -1.69 115.31 121.60 1q8a h LEU 47 Ca 0.12 -0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.72 1q8a h LEU 47 Cb 0.49 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.26 1q8a h LEU 47 CO 0.02 0.71 0.43 0.11 -0.34 0.00 0.00 178.44 179.37 1q8a h LYS 48 N 0.95 1.14 -0.31 1.25 1.57 -1.01 0.07 116.57 120.23 1q8a h LYS 48 Ca 0.24 -0.14 -0.07 0.00 -1.87 0.00 0.00 60.65 58.81 1q8a h LYS 48 Cb 0.04 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.12 1q8a h LYS 48 CO -0.04 0.85 -0.08 0.28 -0.57 0.00 0.00 179.45 179.90 1q8a h VAL 49 N 1.13 1.28 -0.36 0.50 2.07 -1.01 0.02 116.25 119.88 1q8a h VAL 49 Ca 0.28 -1.12 0.03 0.00 0.82 0.00 0.00 66.70 66.71 1q8a h VAL 49 Cb 0.05 1.37 -0.03 0.00 -1.52 0.00 0.00 31.29 31.16 1q8a h VAL 49 CO -0.04 0.36 0.18 0.45 0.02 0.00 0.00 177.57 178.54 1q8a h HIS 50 N 0.37 0.33 -0.48 1.57 3.86 -1.02 -2.16 115.15 117.63 1q8a h HIS 50 Ca 0.08 0.01 0.02 0.00 -1.16 0.00 0.00 60.37 59.33 1q8a h HIS 50 Cb 0.57 -0.10 -0.03 0.00 1.06 0.00 0.00 27.41 28.91 1q8a h HIS 50 CO 0.05 0.17 0.32 0.00 0.86 0.00 0.00 177.93 179.33 1q8a h ARG 51 N 0.37 0.56 -0.29 2.45 3.08 -0.78 -0.28 114.38 119.49 1q8a h ARG 51 Ca 0.15 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 60.14 1q8a h ARG 51 Cb 0.06 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 29.97 1q8a h ARG 51 CO -0.11 0.37 0.06 0.66 -1.07 0.00 0.00 179.97 179.88 1q8a h SER 52 N 0.58 0.37 0.44 7.04 4.64 -0.33 0.16 113.55 126.45 1q8a h SER 52 Ca 0.19 -0.04 -0.31 0.00 -0.47 0.00 0.00 61.79 61.15 1q8a h SER 52 Cb 0.05 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 62.04 1q8a h SER 52 CO -0.05 0.39 -1.52 1.88 -0.87 0.00 0.00 176.83 176.67 1q8a h TYR 53 N 0.41 0.50 -0.58 4.77 0.99 -1.04 -2.96 116.97 119.06 1q8a h TYR 53 Ca 0.10 -0.37 -0.03 0.00 2.00 0.00 0.00 58.73 60.43 1q8a h TYR 53 Cb 0.18 -0.02 -0.03 0.00 1.00 0.00 0.00 36.73 37.86 1q8a h TYR 53 CO 0.01 1.41 0.24 0.82 -0.00 0.00 0.00 178.16 180.63 1q8a h ILE 54 N 0.08 1.22 0.00 -2.88 1.08 -0.72 -1.15 117.51 115.13 1q8a h ILE 54 Ca -0.24 -0.68 0.00 0.00 -0.39 0.00 0.00 64.86 63.55 1q8a h ILE 54 Cb 2.03 0.60 0.00 0.00 -3.07 0.00 0.00 36.82 36.37 1q8a h ILE 54 CO 0.17 0.27 0.00 -0.62 -0.69 0.00 0.00 178.15 177.28 1q8a n GLU 55 N -4.49 0.04 0.00 2.37 1.02 0.53 -1.74 120.64 118.37 1q8a n GLU 55 Ca 0.03 0.24 0.13 0.00 -0.02 0.00 0.00 57.16 57.55 1q8a n GLU 55 Cb 0.16 -1.58 0.36 0.00 -0.02 0.00 0.00 31.44 30.36 1q8a n GLU 55 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1q8a n SER 56 N -1.66 1.67 0.00 1.62 7.64 -0.49 -4.95 113.62 117.45 1q8a n SER 56 Ca 0.04 -1.42 0.00 0.00 1.01 0.00 0.00 58.87 58.50 1q8a n SER 56 Cb 0.21 0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.50 1q8a n SER 56 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1q8a n GLY 57 N 1.27 0.69 3.71 0.23 0.00 -0.71 -3.89 105.19 106.49 1q8a n GLY 57 Ca 0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.75 1q8a n GLY 57 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1q8a n SER 58 N 0.00 2.97 0.08 1.61 7.64 -0.85 -4.86 113.62 120.21 1q8a n SER 58 Ca 0.00 1.20 0.09 0.00 1.01 0.00 0.00 58.87 61.16 1q8a n SER 58 Cb 0.00 -1.50 -0.03 0.00 -1.01 0.00 0.00 64.21 61.67 1q8a n SER 58 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1q8a n ASP 59 N 0.99 0.81 -3.86 6.43 8.00 0.42 -4.77 116.55 124.58 1q8a n ASP 59 Ca 0.05 0.32 -0.12 0.00 0.71 0.00 0.00 54.79 55.76 1q8a n ASP 59 Cb 0.36 0.45 -0.14 0.00 -0.02 0.00 0.00 41.12 41.77 1q8a n ASP 59 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1q8a s VAL 60 N -3.26 0.00 0.14 2.53 1.01 -0.96 -1.55 120.40 118.31 1q8a s VAL 60 Ca -0.01 -0.01 0.08 0.00 0.00 0.00 0.00 61.98 62.03 1q8a s VAL 60 Cb 0.09 -0.05 -0.04 0.00 0.00 0.00 0.00 36.38 36.39 1q8a s VAL 60 CO 0.80 -0.01 -0.17 0.27 0.00 0.00 0.00 175.10 175.99 1q8a s ILE 61 N -0.01 1.67 -0.08 2.22 -4.36 -0.32 -3.09 121.20 117.24 1q8a s ILE 61 Ca -0.00 -1.80 -0.06 0.00 -0.26 0.00 0.00 60.65 58.53 1q8a s ILE 61 Cb -0.00 -1.71 -0.04 0.00 1.25 0.00 0.00 42.46 41.96 1q8a s ILE 61 CO 0.00 -0.30 0.17 -0.76 0.24 0.00 0.00 174.94 174.28 1q8a s LEU 62 N -2.49 4.39 0.62 0.37 1.43 -1.26 -1.14 118.68 120.60 1q8a s LEU 62 Ca 0.12 0.45 -0.15 0.00 -1.03 0.00 0.00 54.13 53.52 1q8a s LEU 62 Cb -0.06 -2.28 -0.02 0.00 0.03 0.00 0.00 46.19 43.86 1q8a s LEU 62 CO 0.05 0.35 1.08 0.42 0.23 0.00 0.00 176.35 178.49 1q8a s THR 63 N -1.14 3.58 -1.43 5.49 -4.23 -0.72 -4.89 115.64 112.30 1q8a s THR 63 Ca 0.20 0.74 -0.09 0.00 -1.18 0.00 0.00 61.69 61.35 1q8a s THR 63 Cb -0.12 -3.27 0.05 0.00 1.34 0.00 0.00 72.50 70.50 1q8a s THR 63 CO 0.09 -0.45 2.41 -3.20 -0.54 0.00 0.00 174.62 172.94 1q8a n ASN 64 N -2.21 6.74 -0.28 3.99 5.15 -1.26 -4.25 115.26 123.14 1q8a n ASN 64 Ca 0.09 -2.90 0.03 0.00 -0.60 0.00 0.00 54.58 51.20 1q8a n ASN 64 Cb 0.52 -1.51 0.04 0.00 -0.53 0.00 0.00 39.78 38.31 1q8a n ASN 64 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1q8a n THR 65 N 3.33 0.66 -0.25 -0.44 -2.24 -1.26 -4.49 114.28 109.59 1q8a n THR 65 Ca 0.60 -0.79 0.05 0.00 -2.27 0.00 0.00 64.05 61.65 1q8a n THR 65 Cb 0.30 0.31 0.17 0.00 -2.10 0.00 0.00 70.33 69.01 1q8a n THR 65 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 1q8a h PHE 66 N 0.00 0.21 -0.59 4.78 3.04 -1.75 0.91 116.94 123.54 1q8a h PHE 66 Ca 0.00 0.04 0.00 0.00 3.98 0.00 0.00 57.97 61.99 1q8a h PHE 66 Cb 1.18 0.02 0.00 0.00 2.56 0.00 0.00 35.95 39.71 1q8a h PHE 66 CO 0.05 -0.11 0.00 0.41 -2.02 0.00 0.00 178.31 176.64 1q8a n GLY 67 N -1.36 2.98 2.54 2.40 0.00 -1.26 -0.86 105.19 109.63 1q8a n GLY 67 Ca 0.14 -0.92 -0.40 0.00 0.00 0.00 0.00 46.02 44.84 1q8a n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q8a n ALA 68 N 0.71 6.58 -2.47 4.61 0.00 0.31 -3.92 120.51 126.34 1q8a n ALA 68 Ca 0.27 -3.99 -0.19 0.00 0.00 0.00 0.00 53.44 49.54 1q8a n ALA 68 Cb 1.12 -3.02 -0.11 0.00 0.00 0.00 0.00 19.45 17.44 1q8a n ALA 68 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1q8a s THR 69 N 0.32 1.44 -0.17 0.00 -4.23 -1.26 -4.84 115.64 106.91 1q8a s THR 69 Ca 0.54 -1.79 0.00 0.00 -1.18 0.00 0.00 61.69 59.26 1q8a s THR 69 Cb 0.16 -1.63 0.00 0.00 1.34 0.00 0.00 72.50 72.38 1q8a s THR 69 CO -0.07 -0.41 0.00 0.54 -0.54 0.00 0.00 174.62 174.14 1q8a n ARG 70 N 0.43 0.00 0.00 3.99 1.74 -1.26 -0.72 116.66 120.83 1q8a n ARG 70 Ca -0.15 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.93 1q8a n ARG 70 Cb 0.57 -1.10 0.00 0.00 -1.02 0.00 0.00 32.46 30.92 1q8a n ARG 70 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 1q8a n LYS 72 N 0.72 0.00 0.16 5.56 3.00 -1.26 -1.22 118.16 125.12 1q8a n LYS 72 Ca 0.00 0.00 0.06 0.00 -0.00 0.00 0.00 58.31 58.37 1q8a n LYS 72 Cb 0.00 0.00 0.53 0.00 0.00 0.00 0.00 35.03 35.56 1q8a n LYS 72 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.40 177.33 1q8a h LEU 73 N 0.00 0.17 -1.48 3.14 3.38 -1.04 -1.75 115.31 117.72 1q8a h LEU 73 Ca 0.00 -0.01 0.03 0.00 0.09 0.00 0.00 57.88 57.99 1q8a h LEU 73 Cb 0.00 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 1q8a h LEU 73 CO 0.00 0.17 0.38 -0.09 0.09 0.00 0.00 178.44 178.99 1q8a h ARG 74 N 0.19 0.67 0.00 1.13 2.43 -1.40 -0.28 114.38 117.12 1q8a h ARG 74 Ca 0.05 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 1q8a h ARG 74 Cb 0.07 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.46 1q8a h ARG 74 CO -0.00 0.44 0.00 1.63 -1.51 0.00 0.00 179.97 180.53 1q8a n LYS 75 N -4.46 0.12 -0.05 0.20 5.02 -0.66 -2.43 118.16 115.90 1q8a n LYS 75 Ca 0.06 0.19 0.03 0.00 -2.02 0.00 0.00 58.31 56.57 1q8a n LYS 75 Cb 0.12 -1.50 0.04 0.00 -0.02 0.00 0.00 35.03 33.67 1q8a n LYS 75 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1q8a n HIS 76 N -1.38 0.00 -2.27 2.13 8.25 -0.25 -4.99 115.22 116.71 1q8a n HIS 76 Ca 0.05 -0.54 -0.14 0.00 -0.26 0.00 0.00 57.72 56.83 1q8a n HIS 76 Cb 0.14 -0.07 -0.01 0.00 1.12 0.00 0.00 29.99 31.17 1q8a n HIS 76 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1q8a n GLY 77 N -0.66 -0.22 0.06 -1.41 0.00 -1.02 -4.91 105.19 97.04 1q8a n GLY 77 Ca 0.04 -0.28 0.03 0.00 0.00 0.00 0.00 46.02 45.82 1q8a n GLY 77 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1q8a n LEU 78 N -2.08 1.75 -0.02 0.99 4.77 -0.43 -4.79 117.00 117.19 1q8a n LEU 78 Ca -0.17 -2.07 0.15 0.00 -0.03 0.00 0.00 56.01 53.89 1q8a n LEU 78 Cb 0.63 -0.15 0.59 0.00 -2.33 0.00 0.00 43.42 42.17 1q8a n LEU 78 CO 0.20 0.50 1.18 -0.08 -1.33 0.00 0.00 177.39 177.85 1q8a h GLU 79 N 0.00 0.19 0.00 3.23 4.81 -1.85 -0.13 114.58 120.83 1q8a h GLU 79 Ca 0.00 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1q8a h GLU 79 Cb 0.79 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.13 1q8a h GLU 79 CO 0.00 0.13 0.00 -0.40 -0.73 0.00 0.00 179.01 178.01 1q8a n ASP 80 N -4.44 0.00 -0.71 1.04 3.85 -1.26 -2.83 116.55 112.21 1q8a n ASP 80 Ca 0.09 -1.04 0.07 0.00 -0.71 0.00 0.00 54.79 53.19 1q8a n ASP 80 Cb 0.45 0.00 0.15 0.00 -1.35 0.00 0.00 41.12 40.37 1q8a n ASP 80 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 1q8a n LYS 81 N -0.95 2.38 -0.21 0.11 4.76 -0.06 -4.68 118.16 119.51 1q8a n LYS 81 Ca 0.20 -1.95 -0.03 0.00 -2.87 0.00 0.00 58.31 53.67 1q8a n LYS 81 Cb 0.09 -1.30 0.04 0.00 -1.84 0.00 0.00 35.03 32.02 1q8a n LYS 81 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 1q8a h LEU 82 N 2.45 -0.85 0.75 -0.35 5.85 -1.57 -0.83 115.31 120.76 1q8a h LEU 82 Ca 0.00 0.21 -0.04 0.00 0.84 0.00 0.00 57.88 58.89 1q8a h LEU 82 Cb 0.72 0.48 0.01 0.00 0.37 0.00 0.00 40.66 42.24 1q8a h LEU 82 CO 0.00 -0.26 -0.36 -0.78 -0.34 0.00 0.00 178.44 176.70 1q8a h ASP 83 N -0.08 -0.85 -0.76 1.25 1.82 -1.87 -1.13 116.42 114.80 1q8a h ASP 83 Ca 0.27 0.03 -0.01 0.00 -0.39 0.00 0.00 57.03 56.93 1q8a h ASP 83 Cb 0.51 0.22 -0.04 0.00 0.68 0.00 0.00 39.33 40.71 1q8a h ASP 83 CO -0.67 -0.60 0.42 1.55 -1.61 0.00 0.00 179.24 178.33 1q8a h PRO 84 N -1.01 1.07 -0.13 0.28 0.13 -1.88 -0.18 132.00 130.28 1q8a h PRO 84 Ca -0.10 -0.12 0.02 0.00 -0.87 0.00 0.00 66.00 64.93 1q8a h PRO 84 Cb 0.77 -0.21 -0.02 0.00 0.13 0.00 0.00 31.00 31.67 1q8a h PRO 84 CO 0.17 0.78 -0.01 0.82 -0.23 0.00 0.00 178.00 179.53 1q8a h ILE 85 N 1.08 0.90 -0.07 -3.56 2.04 -1.01 0.62 117.51 117.50 1q8a h ILE 85 Ca 0.27 -0.01 -0.10 0.00 1.00 0.00 0.00 64.86 66.02 1q8a h ILE 85 Cb 0.03 0.86 0.00 0.00 -0.74 0.00 0.00 36.82 36.97 1q8a h ILE 85 CO -0.04 0.01 -0.34 0.58 0.00 0.00 0.00 178.15 178.35 1q8a h VAL 86 N 0.03 1.42 -0.36 1.67 2.07 -0.94 -2.22 116.25 117.92 1q8a h VAL 86 Ca 0.06 -1.75 0.00 0.00 0.82 0.00 0.00 66.70 65.83 1q8a h VAL 86 Cb 0.08 2.34 -0.02 0.00 -1.52 0.00 0.00 31.29 32.18 1q8a h VAL 86 CO -0.11 0.50 0.24 0.03 0.02 0.00 0.00 177.57 178.25 1q8a h ARG 87 N -0.15 0.48 -0.78 1.57 3.08 -1.02 -2.14 114.38 115.42 1q8a h ARG 87 Ca -0.02 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 59.99 1q8a h ARG 87 Cb 0.99 -0.11 -0.04 0.00 0.08 0.00 0.00 29.97 30.90 1q8a h ARG 87 CO 0.07 0.32 0.47 -0.91 -1.07 0.00 0.00 179.97 178.86 1q8a h ASN 88 N 0.49 0.94 -0.84 7.04 4.21 -0.92 -1.82 115.58 124.68 1q8a h ASN 88 Ca 0.13 -0.06 0.01 0.00 1.21 0.00 0.00 56.30 57.58 1q8a h ASN 88 Cb -0.05 -0.24 -0.04 0.00 -1.12 0.00 0.00 38.32 36.87 1q8a h ASN 88 CO -0.03 0.73 0.55 0.00 -1.29 0.00 0.00 177.43 177.39 1q8a h ALA 89 N 1.25 1.06 -0.29 -0.83 0.00 -1.01 0.47 119.26 119.91 1q8a h ALA 89 Ca 0.28 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 55.04 1q8a h ALA 89 Cb -0.04 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.40 1q8a h ALA 89 CO -0.05 0.48 -0.16 0.28 0.00 0.00 0.00 179.25 179.80 1q8a h VAL 90 N 1.14 1.30 -0.71 0.00 2.07 -1.01 -1.07 116.25 117.97 1q8a h VAL 90 Ca 0.31 -1.27 -0.02 0.00 0.82 0.00 0.00 66.70 66.55 1q8a h VAL 90 Cb -0.12 1.49 -0.03 0.00 -1.52 0.00 0.00 31.29 31.11 1q8a h VAL 90 CO -0.07 0.40 0.39 0.03 0.02 0.00 0.00 177.57 178.34 1q8a h ARG 91 N 0.37 1.00 -0.27 1.57 3.08 -1.03 0.92 114.38 120.01 1q8a h ARG 91 Ca 0.06 -0.12 -0.02 0.00 0.07 0.00 0.00 59.98 59.97 1q8a h ARG 91 Cb 0.68 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.53 1q8a h ARG 91 CO 0.05 0.75 0.08 0.82 -1.07 0.00 0.00 179.97 180.59 1q8a h ILE 92 N 0.98 1.21 -0.76 2.04 2.04 -0.77 -1.65 117.51 120.59 1q8a h ILE 92 Ca 0.25 -0.67 -0.02 0.00 1.00 0.00 0.00 64.86 65.42 1q8a h ILE 92 Cb 0.05 1.13 -0.04 0.00 -0.74 0.00 0.00 36.82 37.23 1q8a h ILE 92 CO -0.04 0.22 0.39 0.00 0.00 0.00 0.00 178.15 178.72 1q8a h ALA 93 N 0.90 0.98 -0.69 1.87 0.00 -0.90 -1.46 119.26 119.96 1q8a h ALA 93 Ca 0.09 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 1q8a h ALA 93 Cb 0.26 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1q8a h ALA 93 CO -0.00 0.52 0.28 0.00 0.00 0.00 0.00 179.25 180.05 1q8a h ARG 94 N 1.07 1.02 -0.44 0.00 2.47 -0.63 0.49 114.38 118.35 1q8a h ARG 94 Ca 0.27 -0.17 -0.04 0.00 -1.26 0.00 0.00 59.98 58.78 1q8a h ARG 94 Cb 0.08 -0.17 -0.02 0.00 -1.65 0.00 0.00 29.97 28.21 1q8a h ARG 94 CO -0.04 0.82 0.11 -0.09 0.56 0.00 0.00 179.97 181.34 1q8a h ARG 95 N 1.00 0.70 -0.33 0.04 2.43 -0.89 -2.45 114.38 114.87 1q8a h ARG 95 Ca 0.23 -0.17 -0.11 0.00 -0.81 0.00 0.00 59.98 59.13 1q8a h ARG 95 Cb 0.18 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.63 1q8a h ARG 95 CO -0.02 0.70 -0.25 0.00 -1.51 0.00 0.00 179.97 178.89 1q8a h ALA 96 N 0.97 0.95 -0.02 2.80 0.00 -0.76 -3.31 119.26 119.90 1q8a h ALA 96 Ca 0.14 -0.37 -0.15 0.00 0.00 0.00 0.00 54.91 54.53 1q8a h ALA 96 Cb 0.31 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1q8a h ALA 96 CO 0.00 0.61 -0.67 0.00 0.00 0.00 0.00 179.25 179.19 1q8a h ALA 97 N 1.15 0.84 -0.69 0.00 0.00 -0.68 -3.46 119.26 116.42 1q8a h ALA 97 Ca 0.08 -0.60 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1q8a h ALA 97 Cb 0.73 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1q8a h ALA 97 CO 0.06 0.80 0.00 0.41 0.00 0.00 0.00 179.25 180.52 1q8a n GLY 98 N 0.40 3.27 0.91 0.00 0.00 -0.94 -1.34 105.19 107.49 1q8a n GLY 98 Ca -0.02 0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.14 1q8a n GLY 98 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1q8a n GLU 99 N 10.68 2.24 -1.50 1.61 0.00 -1.26 -4.94 120.64 127.46 1q8a n GLU 99 Ca 0.00 -1.82 -0.29 0.00 0.00 0.00 0.00 57.16 55.05 1q8a n GLU 99 Cb 0.00 -1.47 0.14 0.00 0.00 0.00 0.00 31.44 30.11 1q8a n GLU 99 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.13 177.28 1q8a s LYS 100 N -1.85 1.08 0.23 3.44 -0.14 -0.45 -5.00 119.74 117.04 1q8a s LYS 100 Ca 0.33 0.31 -0.22 0.00 -1.36 0.00 0.00 55.97 55.02 1q8a s LYS 100 Cb 0.21 -1.83 -0.08 0.00 -1.68 0.00 0.00 37.83 34.44 1q8a s LYS 100 CO 0.31 -2.24 0.78 -0.51 -0.76 0.00 0.00 175.35 172.92 1q8a s LEU 101 N -6.07 4.40 -0.18 3.17 1.43 -0.60 -4.90 118.68 115.93 1q8a s LEU 101 Ca 0.64 1.55 0.01 0.00 -1.03 0.00 0.00 54.13 55.29 1q8a s LEU 101 Cb -0.15 -3.60 0.02 0.00 0.03 0.00 0.00 46.19 42.49 1q8a s LEU 101 CO 0.54 0.06 -0.19 -0.69 0.23 0.00 0.00 176.35 176.29 1q8a s VAL 102 N -1.45 2.11 -0.13 -1.59 1.01 -1.26 -1.17 120.40 117.91 1q8a s VAL 102 Ca 0.43 -0.92 -0.04 0.00 0.00 0.00 0.00 61.98 61.44 1q8a s VAL 102 Cb -0.18 -1.88 -0.03 0.00 0.00 0.00 0.00 36.38 34.28 1q8a s VAL 102 CO 0.23 0.54 0.01 -0.36 0.00 0.00 0.00 175.10 175.51 1q8a s PHE 103 N 1.29 3.15 0.17 5.22 2.99 -0.29 -0.68 117.98 129.82 1q8a s PHE 103 Ca 0.05 0.00 -0.30 0.00 0.00 0.00 0.00 56.93 56.68 1q8a s PHE 103 Cb -0.13 -1.92 -0.08 0.00 0.00 0.00 0.00 43.02 40.89 1q8a s PHE 103 CO -0.12 0.22 1.24 0.20 -0.00 0.00 0.00 175.22 176.75 1q8a s GLY 104 N -0.14 2.55 -0.23 4.36 0.00 0.11 -1.76 107.32 112.22 1q8a s GLY 104 Ca 0.05 0.99 -0.06 0.00 0.00 0.00 0.00 44.72 45.70 1q8a s GLY 104 CO 0.02 1.96 0.01 -0.35 0.00 0.00 0.00 173.10 174.74 1q8a s ASP 105 N 0.34 4.75 -0.09 1.64 2.15 -1.26 -0.70 116.67 123.49 1q8a s ASP 105 Ca 0.55 -0.28 0.01 0.00 0.43 0.00 0.00 52.55 53.26 1q8a s ASP 105 Cb -0.33 -1.83 0.02 0.00 -0.30 0.00 0.00 42.92 40.47 1q8a s ASP 105 CO 0.36 -0.02 -0.12 -0.63 -0.17 0.00 0.00 175.17 174.60 1q8a s ILE 106 N 1.48 1.22 0.56 4.11 1.01 -0.34 -3.44 121.20 125.79 1q8a s ILE 106 Ca 0.05 -0.47 0.08 0.00 0.00 0.00 0.00 60.65 60.32 1q8a s ILE 106 Cb -0.15 -1.15 0.07 0.00 0.01 0.00 0.00 42.46 41.24 1q8a s ILE 106 CO 0.01 0.39 0.67 -0.83 0.00 0.00 0.00 174.94 175.18 1q8a s GLY 107 N 1.09 1.91 0.84 6.18 0.00 -0.04 -0.94 107.32 116.37 1q8a s GLY 107 Ca -0.06 -1.89 -0.12 0.00 0.00 0.00 0.00 44.72 42.65 1q8a s GLY 107 CO -0.02 -1.74 1.11 2.56 0.00 0.00 0.00 173.10 175.01 1q8a s PRO 108 N -4.54 1.71 0.20 2.90 0.04 -1.26 -4.91 135.00 129.14 1q8a s PRO 108 Ca 0.54 0.54 0.25 0.00 0.04 0.00 0.00 61.00 62.37 1q8a s PRO 108 Cb -0.05 -1.88 0.57 0.00 0.04 0.00 0.00 34.50 33.17 1q8a s PRO 108 CO 0.34 -1.86 1.57 1.79 0.04 0.00 0.00 177.00 178.87 1q8a h THR 109 N -1.26 0.00 0.00 1.26 1.35 -1.98 -3.47 112.91 108.80 1q8a h THR 109 Ca -0.48 -0.55 0.00 0.00 -0.55 0.00 0.00 66.41 64.83 1q8a h THR 109 Cb 1.29 1.37 0.00 0.00 -1.73 0.00 0.00 68.15 69.08 1q8a h THR 109 CO 0.60 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.48 1q8a n GLY 110 N 1.30 0.88 3.58 5.82 0.00 -1.26 -4.49 105.19 111.01 1q8a n GLY 110 Ca 0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.72 1q8a n GLY 110 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1q8a s GLU 111 N -0.20 3.85 0.39 1.61 0.41 -1.26 -5.11 118.70 118.38 1q8a s GLU 111 Ca 0.00 -0.42 -0.17 0.00 -0.41 0.00 0.00 54.97 53.97 1q8a s GLU 111 Cb 0.00 -3.09 -0.09 0.00 -1.78 0.00 0.00 34.13 29.17 1q8a s GLU 111 CO 0.00 0.26 0.84 -0.51 -0.49 0.00 0.00 175.26 175.36 1q8a s LEU 112 N 0.37 3.95 0.48 1.80 1.43 -1.26 -5.00 118.68 120.45 1q8a s LEU 112 Ca 0.00 1.44 -0.22 0.00 -1.03 0.00 0.00 54.13 54.32 1q8a s LEU 112 Cb -0.13 -4.28 -0.07 0.00 0.03 0.00 0.00 46.19 41.73 1q8a s LEU 112 CO 0.01 -0.32 1.14 -2.16 0.23 0.00 0.00 176.35 175.26 1q8a s PRO 113 N -3.24 3.70 0.44 1.29 0.04 -1.26 -3.27 135.00 132.69 1q8a s PRO 113 Ca 0.57 1.69 -0.24 0.00 0.04 0.00 0.00 61.00 63.06 1q8a s PRO 113 Cb -0.10 -2.31 -0.10 0.00 0.04 0.00 0.00 34.50 32.04 1q8a s PRO 113 CO 0.18 -0.58 1.15 0.98 0.04 0.00 0.00 177.00 178.77 1q8a n TYR 114 N -0.67 1.68 1.30 0.56 9.36 0.29 -0.83 117.16 128.84 1q8a n TYR 114 Ca 0.08 0.52 0.10 0.00 3.32 0.00 0.00 57.90 61.92 1q8a n TYR 114 Cb 0.49 -2.30 0.39 0.00 -0.63 0.00 0.00 39.34 37.29 1q8a n TYR 114 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 1q8a n PRO 115 N -0.03 1.65 0.01 2.98 -0.04 -1.26 -4.60 135.00 133.72 1q8a n PRO 115 Ca 0.08 -0.98 -0.18 0.00 -0.04 0.00 0.00 63.50 62.38 1q8a n PRO 115 Cb 0.40 -1.38 -0.10 0.00 -0.04 0.00 0.00 33.50 32.38 1q8a n PRO 115 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1q8a h LEU 116 N 1.99 0.74 0.00 1.53 3.38 -1.29 -3.46 115.31 118.19 1q8a h LEU 116 Ca 0.00 -0.72 0.00 0.00 0.09 0.00 0.00 57.88 57.25 1q8a h LEU 116 Cb 0.44 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1q8a h LEU 116 CO 0.00 1.35 0.00 0.61 0.09 0.00 0.00 178.44 180.49 1q8a n GLY 117 N 0.97 5.91 0.44 0.83 0.00 -0.51 -4.93 105.19 107.91 1q8a n GLY 117 Ca -0.10 -1.97 0.05 0.00 0.00 0.00 0.00 46.02 44.00 1q8a n GLY 117 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1q8a n SER 118 N 0.00 2.13 -4.71 1.61 3.41 -1.25 -3.64 113.62 111.16 1q8a n SER 118 Ca 0.00 -1.60 -0.38 0.00 -0.26 0.00 0.00 58.87 56.63 1q8a n SER 118 Cb 0.00 -0.07 -0.06 0.00 -0.26 0.00 0.00 64.21 63.83 1q8a n SER 118 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1q8a s THR 119 N -0.87 5.16 0.29 6.66 2.01 -1.24 -4.63 115.64 123.02 1q8a s THR 119 Ca 0.14 1.01 -0.10 0.00 0.31 0.00 0.00 61.69 63.05 1q8a s THR 119 Cb 0.09 -3.85 -0.07 0.00 0.01 0.00 0.00 72.50 68.68 1q8a s THR 119 CO 0.13 0.30 0.62 -0.76 -0.69 0.00 0.00 174.62 174.21 1q8a s LEU 120 N 0.78 4.07 0.29 4.42 1.43 -1.26 -0.55 118.68 127.86 1q8a s LEU 120 Ca 0.27 0.97 0.01 0.00 -1.03 0.00 0.00 54.13 54.35 1q8a s LEU 120 Cb -0.15 -3.77 0.70 0.00 0.03 0.00 0.00 46.19 42.99 1q8a s LEU 120 CO 0.11 -0.18 1.60 0.15 0.23 0.00 0.00 176.35 178.26 1q8a h PHE 121 N 2.09 0.05 -0.69 0.29 3.57 -1.94 -0.76 116.94 119.55 1q8a h PHE 121 Ca -0.47 0.06 0.06 0.00 3.53 0.00 0.00 57.97 61.15 1q8a h PHE 121 Cb 1.18 0.13 -0.04 0.00 2.79 0.00 0.00 35.95 40.00 1q8a h PHE 121 CO 0.61 -0.35 0.46 1.05 -2.23 0.00 0.00 178.31 177.84 1q8a h GLU 122 N 0.07 0.71 -0.05 1.11 4.11 -1.99 -0.64 114.58 117.89 1q8a h GLU 122 Ca 0.56 -0.04 -0.25 0.00 0.07 0.00 0.00 59.36 59.70 1q8a h GLU 122 Cb 1.14 -0.16 0.02 0.00 0.50 0.00 0.00 28.75 30.24 1q8a h GLU 122 CO -0.82 0.47 -0.94 1.49 0.07 0.00 0.00 179.01 179.28 1q8a h GLU 123 N 0.73 0.70 -0.61 1.06 4.81 -1.53 -2.30 114.58 117.44 1q8a h GLU 123 Ca 0.30 -0.68 -0.02 0.00 -0.13 0.00 0.00 59.36 58.82 1q8a h GLU 123 Cb 0.24 0.18 -0.03 0.00 0.63 0.00 0.00 28.75 29.77 1q8a h GLU 123 CO -0.09 1.28 0.30 0.74 -0.73 0.00 0.00 179.01 180.50 1q8a h PHE 124 N 0.43 0.87 -0.11 0.92 0.05 -1.16 -1.06 116.94 116.88 1q8a h PHE 124 Ca -0.10 -0.04 0.01 0.00 3.82 0.00 0.00 57.97 61.67 1q8a h PHE 124 Cb 1.58 -0.27 -0.01 0.00 2.00 0.00 0.00 35.95 39.25 1q8a h PHE 124 CO 0.09 0.65 0.02 -0.92 -0.18 0.00 0.00 178.31 177.98 1q8a h TYR 125 N 0.83 0.03 -0.69 -0.55 5.03 -1.08 -1.27 116.97 119.27 1q8a h TYR 125 Ca 0.21 0.01 -0.06 0.00 2.58 0.00 0.00 58.73 61.47 1q8a h TYR 125 Cb 0.11 0.00 -0.03 0.00 1.55 0.00 0.00 36.73 38.36 1q8a h TYR 125 CO -0.00 0.01 0.19 1.49 -1.32 0.00 0.00 178.16 178.53 1q8a h GLU 126 N 0.07 1.08 -0.29 1.82 4.57 -1.30 -0.91 114.58 119.62 1q8a h GLU 126 Ca 0.05 -0.24 0.05 0.00 -1.18 0.00 0.00 59.36 58.04 1q8a h GLU 126 Cb 0.04 -0.15 -0.05 0.00 -0.16 0.00 0.00 28.75 28.43 1q8a h GLU 126 CO -0.07 0.94 -0.02 -0.97 -1.18 0.00 0.00 179.01 177.71 1q8a h ASN 127 N 1.04 -0.15 0.35 1.04 -1.24 -0.66 -2.65 115.58 113.30 1q8a h ASN 127 Ca 0.22 0.07 -0.18 0.00 0.71 0.00 0.00 56.30 57.13 1q8a h ASN 127 Cb 0.32 0.13 -0.01 0.00 0.73 0.00 0.00 38.32 39.50 1q8a h ASN 127 CO -0.00 -0.04 -0.73 -0.26 -1.29 0.00 0.00 177.43 175.10 1q8a h PHE 128 N 0.06 0.43 -0.85 0.67 -1.00 -1.04 -3.17 116.94 112.04 1q8a h PHE 128 Ca 0.14 -0.19 0.09 0.00 2.81 0.00 0.00 57.97 60.81 1q8a h PHE 128 Cb 0.19 -0.07 -0.07 0.00 3.61 0.00 0.00 35.95 39.62 1q8a h PHE 128 CO -0.23 0.94 0.50 -0.09 -1.61 0.00 0.00 178.31 177.82 1q8a h ARG 129 N 0.21 0.84 -0.42 1.51 2.43 -0.90 -1.70 114.38 116.36 1q8a h ARG 129 Ca -0.03 -0.05 -0.11 0.00 -0.81 0.00 0.00 59.98 58.99 1q8a h ARG 129 Cb 1.30 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 30.64 1q8a h ARG 129 CO 0.12 0.55 -0.17 0.93 -1.51 0.00 0.00 179.97 179.90 1q8a h GLU 130 N 0.86 0.79 -0.24 0.20 5.08 -1.45 -0.56 114.58 119.26 1q8a h GLU 130 Ca 0.40 -0.29 -0.19 0.00 -1.00 0.00 0.00 59.36 58.27 1q8a h GLU 130 Cb 0.32 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.52 1q8a h GLU 130 CO -0.23 0.91 -0.61 1.15 -1.00 0.00 0.00 179.01 179.23 1q8a h THR 131 N 0.70 1.28 -0.73 1.13 2.02 -1.53 -3.13 112.91 112.66 1q8a h THR 131 Ca 0.11 -1.80 -0.05 0.00 0.77 0.00 0.00 66.41 65.43 1q8a h THR 131 Cb 0.67 1.74 -0.03 0.00 -1.74 0.00 0.00 68.15 68.78 1q8a h THR 131 CO 0.05 0.58 0.26 0.58 0.37 0.00 0.00 175.52 177.36 1q8a h VAL 132 N 0.60 1.25 -0.65 3.16 2.07 -0.99 -2.71 116.25 119.00 1q8a h VAL 132 Ca -0.00 -0.84 0.09 0.00 0.82 0.00 0.00 66.70 66.76 1q8a h VAL 132 Cb 1.21 0.41 -0.07 0.00 -1.52 0.00 0.00 31.29 31.33 1q8a h VAL 132 CO 0.13 0.34 0.28 -0.33 0.02 0.00 0.00 177.57 178.01 1q8a h GLU 133 N 1.08 0.48 -0.96 1.57 5.08 -1.06 0.01 114.58 120.78 1q8a h GLU 133 Ca 0.24 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 1q8a h GLU 133 Cb 0.26 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.40 1q8a h GLU 133 CO -0.01 0.32 0.00 -0.89 -1.00 0.00 0.00 179.01 177.42 1q8a n ILE 134 N -4.93 0.13 0.00 3.13 5.41 -1.02 -1.66 119.36 120.42 1q8a n ILE 134 Ca 0.09 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.84 1q8a n ILE 134 Cb 0.27 -0.38 0.00 0.00 -0.71 0.00 0.00 39.64 38.82 1q8a n ILE 134 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 1q8a n VAL 136 N 0.60 0.00 -0.12 1.39 0.31 -0.01 -1.43 118.33 119.07 1q8a n VAL 136 Ca 0.00 0.00 0.02 0.00 -0.01 0.00 0.00 64.34 64.35 1q8a n VAL 136 Cb 0.10 0.00 0.31 0.00 -0.91 0.00 0.00 33.84 33.35 1q8a n VAL 136 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1q8a h GLU 137 N 0.00 0.78 -0.00 5.55 5.08 -1.56 -2.41 114.58 122.02 1q8a h GLU 137 Ca 0.00 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1q8a h GLU 137 Cb 0.00 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.08 1q8a h GLU 137 CO 0.00 0.54 -0.10 0.39 -1.00 0.00 0.00 179.01 178.84 1q8a n GLU 138 N -4.43 0.65 -1.13 2.33 -0.58 -0.51 -4.96 120.64 112.01 1q8a n GLU 138 Ca 0.06 -0.19 0.00 0.00 -0.42 0.00 0.00 57.16 56.60 1q8a n GLU 138 Cb 0.06 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.44 1q8a n GLU 138 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1q8a n GLY 139 N 1.28 1.05 3.77 0.62 0.00 -0.91 -4.89 105.19 106.12 1q8a n GLY 139 Ca 0.14 -0.36 -0.32 0.00 0.00 0.00 0.00 46.02 45.49 1q8a n GLY 139 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1q8a s VAL 140 N -2.33 3.33 -2.50 1.61 -7.23 -1.26 -4.81 120.40 107.20 1q8a s VAL 140 Ca 0.00 0.50 0.23 0.00 -1.81 0.00 0.00 61.98 60.91 1q8a s VAL 140 Cb 0.00 -3.01 0.42 0.00 0.56 0.00 0.00 36.38 34.35 1q8a s VAL 140 CO 0.00 -0.49 1.49 0.47 -0.31 0.00 0.00 175.10 176.26 1q8a n ASP 141 N -3.06 2.35 0.00 4.85 10.43 0.14 -4.54 116.55 126.73 1q8a n ASP 141 Ca 0.09 -1.80 0.00 0.00 2.57 0.00 0.00 54.79 55.66 1q8a n ASP 141 Cb 0.53 -0.11 0.00 0.00 1.84 0.00 0.00 41.12 43.38 1q8a n ASP 141 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1q8a n GLY 142 N 1.28 1.32 2.97 0.44 0.00 -1.23 -4.44 105.19 105.53 1q8a n GLY 142 Ca 0.17 -0.92 -0.21 0.00 0.00 0.00 0.00 46.02 45.06 1q8a n GLY 142 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1q8a s ILE 143 N -2.00 0.80 -0.12 -0.61 1.01 -0.16 0.06 121.20 120.18 1q8a s ILE 143 Ca 0.00 -0.31 0.03 0.00 0.00 0.00 0.00 60.65 60.37 1q8a s ILE 143 Cb 0.00 -0.75 0.00 0.00 0.01 0.00 0.00 42.46 41.72 1q8a s ILE 143 CO 0.00 0.27 -0.22 -0.51 0.00 0.00 0.00 174.94 174.48 1q8a s ILE 144 N 0.57 2.19 -0.49 2.92 2.07 0.13 -0.74 121.20 127.85 1q8a s ILE 144 Ca -0.10 -0.95 -0.16 0.00 -1.41 0.00 0.00 60.65 58.03 1q8a s ILE 144 Cb -0.13 -1.87 0.08 0.00 0.13 0.00 0.00 42.46 40.67 1q8a s ILE 144 CO 0.01 0.55 0.47 -0.36 -1.91 0.00 0.00 174.94 173.70 1q8a s PHE 145 N 0.56 3.20 0.05 3.50 0.40 -0.07 -1.20 117.98 124.41 1q8a s PHE 145 Ca -0.13 -0.89 -0.03 0.00 -0.60 0.00 0.00 56.93 55.28 1q8a s PHE 145 Cb -0.17 -3.35 -0.04 0.00 0.51 0.00 0.00 43.02 39.97 1q8a s PHE 145 CO 0.04 -0.89 0.25 -1.21 0.70 0.00 0.00 175.22 174.11 1q8a s GLU 146 N 1.87 3.51 -1.35 0.44 2.02 -0.11 -0.91 118.70 124.17 1q8a s GLU 146 Ca 0.06 -0.25 -0.01 0.00 0.02 0.00 0.00 54.97 54.79 1q8a s GLU 146 Cb -0.24 -3.02 0.00 0.00 0.10 0.00 0.00 34.13 30.97 1q8a s GLU 146 CO 0.07 0.60 0.16 2.41 0.02 0.00 0.00 175.26 178.52 1q8a n THR 147 N 0.59 -1.05 -2.70 3.63 -1.04 -1.26 -4.14 114.28 108.31 1q8a n THR 147 Ca -0.07 0.00 -0.39 0.00 -2.04 0.00 0.00 64.05 61.55 1q8a n THR 147 Cb 0.52 -2.63 -0.06 0.00 -1.82 0.00 0.00 70.33 66.34 1q8a n THR 147 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 1q8a s PHE 148 N -2.90 3.80 -0.44 -1.42 0.40 -1.16 -4.62 117.98 111.64 1q8a s PHE 148 Ca 0.08 1.83 0.09 0.00 -0.60 0.00 0.00 56.93 58.33 1q8a s PHE 148 Cb -0.03 -3.02 -0.10 0.00 0.51 0.00 0.00 43.02 40.37 1q8a s PHE 148 CO 0.10 0.16 0.40 0.43 0.70 0.00 0.00 175.22 177.01 1q8a n SER 149 N 1.10 0.48 -3.87 1.36 7.64 -1.26 -0.71 113.62 118.35 1q8a n SER 149 Ca -0.00 -0.71 -0.18 0.00 1.01 0.00 0.00 58.87 58.98 1q8a n SER 149 Cb 0.48 1.01 -0.16 0.00 -1.01 0.00 0.00 64.21 64.52 1q8a n SER 149 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1q8a s ASP 150 N -1.91 0.70 0.38 6.43 2.15 -1.26 -2.87 116.67 120.29 1q8a s ASP 150 Ca 0.03 -0.09 0.12 0.00 0.43 0.00 0.00 52.55 53.05 1q8a s ASP 150 Cb 0.07 -0.34 0.77 0.00 -0.30 0.00 0.00 42.92 43.12 1q8a s ASP 150 CO 0.39 -0.06 1.87 0.16 -0.17 0.00 0.00 175.17 177.35 1q8a h ILE 151 N 6.12 1.22 -0.31 4.11 3.07 -1.94 -1.82 117.51 127.96 1q8a h ILE 151 Ca -0.40 -1.06 -0.16 0.00 1.55 0.00 0.00 64.86 64.80 1q8a h ILE 151 Cb 1.15 1.52 -0.00 0.00 -0.27 0.00 0.00 36.82 39.21 1q8a h ILE 151 CO 0.48 0.31 -0.42 0.25 -1.05 0.00 0.00 178.15 177.72 1q8a h LEU 152 N 0.06 0.90 -0.59 0.16 5.85 -1.93 0.58 115.31 120.35 1q8a h LEU 152 Ca 0.01 -0.50 -0.07 0.00 0.84 0.00 0.00 57.88 58.16 1q8a h LEU 152 Cb 0.54 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.30 1q8a h LEU 152 CO 0.04 1.23 0.09 -0.08 -0.34 0.00 0.00 178.44 179.38 1q8a h GLU 153 N 0.60 0.98 -0.37 1.25 4.81 -1.93 -0.88 114.58 119.04 1q8a h GLU 153 Ca 0.03 -0.27 -0.13 0.00 -0.13 0.00 0.00 59.36 58.87 1q8a h GLU 153 Cb 1.02 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.27 1q8a h GLU 153 CO 0.10 0.93 -0.29 1.25 -0.73 0.00 0.00 179.01 180.27 1q8a h LEU 154 N 0.88 0.82 -0.81 1.64 5.85 -1.18 -1.61 115.31 120.91 1q8a h LEU 154 Ca 0.18 -0.33 -0.04 0.00 0.84 0.00 0.00 57.88 58.53 1q8a h LEU 154 Cb 0.43 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.19 1q8a h LEU 154 CO 0.01 1.06 0.34 0.50 -0.34 0.00 0.00 178.44 180.01 1q8a h LYS 155 N 0.67 1.19 -0.71 1.25 3.64 -0.64 -0.65 116.57 121.34 1q8a h LYS 155 Ca 0.08 -0.20 -0.05 0.00 -1.27 0.00 0.00 60.65 59.20 1q8a h LYS 155 Cb 0.83 -0.20 -0.03 0.00 -0.41 0.00 0.00 32.23 32.42 1q8a h LYS 155 CO 0.07 0.95 0.24 0.00 -2.27 0.00 0.00 179.45 178.44 1q8a h ALA 156 N 1.18 1.08 -0.06 5.00 0.00 -0.85 -1.16 119.26 124.45 1q8a h ALA 156 Ca 0.27 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1q8a h ALA 156 Cb 0.19 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 1q8a h ALA 156 CO -0.03 0.63 0.01 0.00 0.00 0.00 0.00 179.25 179.87 1q8a h ALA 157 N 1.21 0.08 -0.25 0.00 0.00 -0.77 -0.85 119.26 118.69 1q8a h ALA 157 Ca 0.23 -0.13 -0.12 0.00 0.00 0.00 0.00 54.91 54.89 1q8a h ALA 157 Cb 0.27 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1q8a h ALA 157 CO -0.01 -0.29 -0.36 -0.39 0.00 0.00 0.00 179.25 178.20 1q8a h VAL 158 N -0.12 1.29 -0.49 0.00 -1.51 -1.02 -1.08 116.25 113.33 1q8a h VAL 158 Ca 0.02 -1.50 -0.11 0.00 -1.23 0.00 0.00 66.70 63.88 1q8a h VAL 158 Cb 0.25 1.50 -0.01 0.00 -2.13 0.00 0.00 31.29 30.89 1q8a h VAL 158 CO 0.00 0.47 -0.13 -0.07 -1.23 0.00 0.00 177.57 176.61 1q8a h LEU 159 N 0.46 0.96 -0.68 4.19 3.38 -1.19 -1.12 115.31 121.32 1q8a h LEU 159 Ca 0.05 -0.37 -0.02 0.00 0.09 0.00 0.00 57.88 57.63 1q8a h LEU 159 Cb 0.84 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.30 1q8a h LEU 159 CO 0.07 1.11 0.35 0.00 0.09 0.00 0.00 178.44 180.06 1q8a h ALA 160 N 0.89 0.87 -0.39 1.53 0.00 -0.97 -1.25 119.26 119.93 1q8a h ALA 160 Ca 0.12 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1q8a h ALA 160 Cb 0.70 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1q8a h ALA 160 CO 0.05 0.41 0.19 0.00 0.00 0.00 0.00 179.25 179.89 1q8a h ALA 161 N 1.17 0.50 -0.13 0.00 0.00 -0.94 -2.26 119.26 117.61 1q8a h ALA 161 Ca 0.24 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 1q8a h ALA 161 Cb 0.08 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1q8a h ALA 161 CO -0.03 0.06 -0.29 -0.09 0.00 0.00 0.00 179.25 178.90 1q8a h ARG 162 N 0.49 0.24 -0.31 0.00 9.65 -1.03 -1.48 114.38 121.94 1q8a h ARG 162 Ca 0.13 -0.09 -0.09 0.00 -1.10 0.00 0.00 59.98 58.83 1q8a h ARG 162 Cb 0.12 -0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 28.67 1q8a h ARG 162 CO -0.02 0.51 -0.20 1.49 2.80 0.00 0.00 179.97 184.55 1q8a h GLU 163 N 0.21 0.58 -0.10 0.20 4.22 -0.91 -3.04 114.58 115.76 1q8a h GLU 163 Ca 0.03 -0.21 -0.04 0.00 0.08 0.00 0.00 59.36 59.22 1q8a h GLU 163 Cb 0.63 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.84 1q8a h GLU 163 CO 0.05 0.75 -0.09 0.28 -2.18 0.00 0.00 179.01 177.82 1q8a h VAL 164 N 0.52 1.36 -3.19 0.32 2.07 -0.87 -3.44 116.25 113.02 1q8a h VAL 164 Ca 0.08 -1.23 -0.30 0.00 0.82 0.00 0.00 66.70 66.07 1q8a h VAL 164 Cb 0.64 1.96 -0.36 0.00 -1.52 0.00 0.00 31.29 32.01 1q8a h VAL 164 CO 0.05 0.35 -0.66 -0.55 0.02 0.00 0.00 177.57 176.78 1q8a s SER 165 N -5.97 0.64 0.02 0.57 0.15 -0.61 -4.98 113.70 103.53 1q8a s SER 165 Ca -0.15 0.26 0.28 0.00 0.70 0.00 0.00 55.95 57.05 1q8a s SER 165 Cb 0.04 0.16 1.12 0.00 -1.71 0.00 0.00 66.02 65.63 1q8a s SER 165 CO 0.73 -0.22 1.86 0.54 1.20 0.00 0.00 173.24 177.35 1q8a n ARG 166 N 5.06 0.03 -0.00 5.44 3.00 -1.22 -3.80 116.66 125.17 1q8a n ARG 166 Ca -0.09 0.02 0.10 0.00 -0.01 0.00 0.00 57.85 57.87 1q8a n ARG 166 Cb 0.50 -1.53 -0.11 0.00 0.00 0.00 0.00 32.46 31.32 1q8a n ARG 166 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1q8a n ASP 167 N -1.58 0.91 -4.79 0.55 10.43 -1.26 -4.98 116.55 115.84 1q8a n ASP 167 Ca 0.07 -0.90 -0.38 0.00 2.57 0.00 0.00 54.79 56.15 1q8a n ASP 167 Cb 0.35 1.04 -0.06 0.00 1.84 0.00 0.00 41.12 44.29 1q8a n ASP 167 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 1q8a s VAL 168 N -3.04 4.41 0.03 2.53 0.11 -1.25 -0.60 120.40 122.59 1q8a s VAL 168 Ca 0.07 1.59 -0.30 0.00 -2.93 0.00 0.00 61.98 60.40 1q8a s VAL 168 Cb 0.16 -4.04 -0.06 0.00 -1.53 0.00 0.00 36.38 30.91 1q8a s VAL 168 CO 0.87 0.38 1.34 0.12 -3.33 0.00 0.00 175.10 174.48 1q8a s PHE 169 N -1.32 3.07 -0.07 1.54 5.36 -1.26 -4.69 117.98 120.61 1q8a s PHE 169 Ca 0.40 0.98 0.05 0.00 -0.96 0.00 0.00 56.93 57.39 1q8a s PHE 169 Cb -0.21 -3.60 -0.01 0.00 -0.34 0.00 0.00 43.02 38.87 1q8a s PHE 169 CO 0.24 -2.10 -0.24 -0.51 -1.46 0.00 0.00 175.22 171.16 1q8a s LEU 170 N 1.89 2.06 -0.09 6.12 1.43 -1.26 -0.99 118.68 127.84 1q8a s LEU 170 Ca 0.62 -0.52 0.03 0.00 -1.03 0.00 0.00 54.13 53.23 1q8a s LEU 170 Cb -0.31 -1.36 0.01 0.00 0.03 0.00 0.00 46.19 44.55 1q8a s LEU 170 CO 0.27 0.21 -0.19 -0.63 0.23 0.00 0.00 176.35 176.23 1q8a s ILE 171 N 0.03 1.72 -0.13 -0.59 1.01 0.08 -1.11 121.20 122.22 1q8a s ILE 171 Ca -0.09 -0.82 0.00 0.00 0.00 0.00 0.00 60.65 59.74 1q8a s ILE 171 Cb -0.15 -1.51 -0.01 0.00 0.01 0.00 0.00 42.46 40.79 1q8a s ILE 171 CO 0.05 0.48 -0.13 0.00 0.00 0.00 0.00 174.94 175.35 1q8a s ALA 172 N 0.50 2.61 0.00 9.38 0.00 -0.58 -0.89 121.76 132.78 1q8a s ALA 172 Ca -0.16 -0.89 0.00 0.00 0.00 0.00 0.00 51.96 50.90 1q8a s ALA 172 Cb -0.17 -1.19 0.00 0.00 0.00 0.00 0.00 23.12 21.76 1q8a s ALA 172 CO 0.06 0.27 0.00 0.72 0.00 0.00 0.00 175.76 176.81 1q8a n HIS 173 N 3.46 0.00 -3.79 0.00 8.25 -0.09 -1.51 115.22 121.55 1q8a n HIS 173 Ca -0.18 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.15 1q8a n HIS 173 Cb 0.53 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.52 1q8a n HIS 173 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 1q8a s THR 175 N -0.89 -0.00 0.07 1.59 -1.32 0.11 -2.98 115.64 112.22 1q8a s THR 175 Ca 0.00 0.00 0.09 0.00 -1.21 0.00 0.00 61.69 60.57 1q8a s THR 175 Cb 0.00 -0.33 -0.03 0.00 -1.51 0.00 0.00 72.50 70.63 1q8a s THR 175 CO 0.00 0.00 -0.26 -0.36 -2.21 0.00 0.00 174.62 171.79 1q8a s PHE 176 N 0.13 2.25 0.95 9.09 0.40 -1.26 -4.41 117.98 125.13 1q8a s PHE 176 Ca -0.00 -0.40 -0.15 0.00 -0.60 0.00 0.00 56.93 55.78 1q8a s PHE 176 Cb -0.02 -1.31 0.22 0.00 0.51 0.00 0.00 43.02 42.42 1q8a s PHE 176 CO 0.00 0.17 1.30 -0.40 0.70 0.00 0.00 175.22 176.99 1q8a n ASP 177 N 1.57 0.27 0.16 1.36 5.68 -0.36 -4.59 116.55 120.65 1q8a n ASP 177 Ca -0.17 -1.57 0.17 0.00 -0.50 0.00 0.00 54.79 52.71 1q8a n ASP 177 Cb 0.52 -0.98 0.77 0.00 -1.14 0.00 0.00 41.12 40.30 1q8a n ASP 177 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 1q8a h GLU 178 N 0.00 0.00 -0.05 0.11 4.11 -1.93 0.11 114.58 116.94 1q8a h GLU 178 Ca -0.42 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.01 1q8a h GLU 178 Cb 1.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.45 1q8a h GLU 178 CO 0.31 0.00 0.00 0.36 0.07 0.00 0.00 179.01 179.75 1q8a n LYS 179 N -4.02 1.34 -2.09 1.06 2.85 -1.26 -4.90 118.16 111.14 1q8a n LYS 179 Ca 0.03 -0.51 -0.01 0.00 -1.05 0.00 0.00 58.31 56.77 1q8a n LYS 179 Cb 0.37 -1.41 -0.00 0.00 -0.65 0.00 0.00 35.03 33.35 1q8a n LYS 179 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1q8a n GLY 180 N 1.01 0.37 3.19 2.58 0.00 0.40 -5.06 105.19 107.68 1q8a n GLY 180 Ca 0.18 -0.81 -0.22 0.00 0.00 0.00 0.00 46.02 45.18 1q8a n GLY 180 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1q8a s ARG 181 N -4.18 1.06 0.86 1.61 1.81 -1.26 -4.00 118.95 114.85 1q8a s ARG 181 Ca 0.00 -0.86 -0.13 0.00 -1.72 0.00 0.00 55.73 53.02 1q8a s ARG 181 Cb -0.00 -1.13 0.13 0.00 -0.45 0.00 0.00 34.95 33.50 1q8a s ARG 181 CO 0.01 0.28 1.23 -1.54 -0.68 0.00 0.00 175.30 174.59 1q8a s SER 182 N -1.28 3.98 0.30 0.23 1.04 0.10 -1.22 113.70 116.86 1q8a s SER 182 Ca 0.03 0.56 0.04 0.00 0.48 0.00 0.00 55.95 57.07 1q8a s SER 182 Cb -0.08 -0.89 0.66 0.00 0.10 0.00 0.00 66.02 65.80 1q8a s SER 182 CO 0.02 -2.21 1.82 0.25 0.98 0.00 0.00 173.24 174.10 1q8a h LEU 183 N -1.26 0.84 -3.21 2.42 5.85 -1.78 -1.37 115.31 116.80 1q8a h LEU 183 Ca -0.45 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.33 1q8a h LEU 183 Cb 1.29 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.22 1q8a h LEU 183 CO 0.55 0.40 0.00 0.35 -0.34 0.00 0.00 178.44 179.40 1q8a n THR 184 N -4.65 2.04 0.00 1.05 -2.24 -1.19 -4.95 114.28 104.35 1q8a n THR 184 Ca 0.20 -1.23 0.00 0.00 -2.27 0.00 0.00 64.05 60.75 1q8a n THR 184 Cb 0.44 0.02 0.00 0.00 -2.10 0.00 0.00 70.33 68.69 1q8a n THR 184 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1q8a n GLY 185 N 1.04 0.88 3.72 3.38 0.00 -0.52 -3.68 105.19 110.01 1q8a n GLY 185 Ca 0.26 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.87 1q8a n GLY 185 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1q8a s THR 186 N -2.00 4.89 0.44 2.61 2.01 -0.50 -4.24 115.64 118.84 1q8a s THR 186 Ca 0.00 1.82 0.05 0.00 0.31 0.00 0.00 61.69 63.87 1q8a s THR 186 Cb 0.00 -4.21 0.01 0.00 0.01 0.00 0.00 72.50 68.31 1q8a s THR 186 CO 0.00 0.22 0.61 1.51 -0.69 0.00 0.00 174.62 176.27 1q8a s ASP 187 N 0.76 5.66 0.30 3.53 3.84 -1.26 -0.72 116.67 128.77 1q8a s ASP 187 Ca 0.46 -0.19 0.01 0.00 -0.00 0.00 0.00 52.55 52.83 1q8a s ASP 187 Cb -0.20 -0.94 0.53 0.00 -1.38 0.00 0.00 42.92 40.93 1q8a s ASP 187 CO 0.24 -0.77 1.89 -0.65 -0.00 0.00 0.00 175.17 175.88 1q8a h PRO 188 N 0.53 0.99 -0.45 2.11 0.11 -1.90 -1.13 132.00 132.27 1q8a h PRO 188 Ca -0.43 -0.06 -0.04 0.00 0.11 0.00 0.00 66.00 65.59 1q8a h PRO 188 Cb 1.28 -0.22 -0.02 0.00 0.11 0.00 0.00 31.00 32.14 1q8a h PRO 188 CO 0.50 0.66 0.13 0.00 -0.21 0.00 0.00 178.00 179.07 1q8a h ALA 189 N 1.51 0.60 -0.19 -0.75 0.00 -1.93 -0.38 119.26 118.12 1q8a h ALA 189 Ca 0.42 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 1q8a h ALA 189 Cb 0.27 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1q8a h ALA 189 CO -0.17 0.26 0.11 -0.97 0.00 0.00 0.00 179.25 178.48 1q8a h ASN 190 N 0.60 0.23 -0.18 0.00 -0.73 -1.86 -0.22 115.58 113.42 1q8a h ASN 190 Ca 0.14 -0.07 0.04 0.00 1.87 0.00 0.00 56.30 58.29 1q8a h ASN 190 Cb 0.29 -0.06 -0.04 0.00 0.27 0.00 0.00 38.32 38.78 1q8a h ASN 190 CO -0.00 0.23 -0.10 0.15 -0.37 0.00 0.00 177.43 177.34 1q8a h PHE 191 N 0.21 -0.24 -0.37 0.67 3.57 -1.10 0.57 116.94 120.25 1q8a h PHE 191 Ca 0.07 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.54 1q8a h PHE 191 Cb 0.05 0.13 -0.01 0.00 2.79 0.00 0.00 35.95 38.91 1q8a h PHE 191 CO -0.04 -0.15 0.05 0.00 -2.23 0.00 0.00 178.31 175.93 1q8a h ALA 192 N 1.06 0.49 -0.56 2.41 0.00 -0.91 -1.10 119.26 120.64 1q8a h ALA 192 Ca 0.10 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 1q8a h ALA 192 Cb 0.24 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 1q8a h ALA 192 CO -0.23 0.20 0.12 0.82 0.00 0.00 0.00 179.25 180.16 1q8a h ILE 193 N 0.45 1.24 -0.11 0.00 2.04 -0.82 0.31 117.51 120.62 1q8a h ILE 193 Ca 0.11 -0.88 -0.10 0.00 1.00 0.00 0.00 64.86 64.99 1q8a h ILE 193 Cb 0.38 0.68 0.00 0.00 -0.74 0.00 0.00 36.82 37.14 1q8a h ILE 193 CO 0.01 0.33 -0.33 0.74 0.00 0.00 0.00 178.15 178.90 1q8a h THR 194 N 0.85 1.39 0.00 -0.27 2.02 -0.79 -3.36 112.91 112.75 1q8a h THR 194 Ca 0.18 -1.65 -0.06 0.00 0.77 0.00 0.00 66.41 65.65 1q8a h THR 194 Cb 0.34 2.17 -0.01 0.00 -1.74 0.00 0.00 68.15 68.90 1q8a h THR 194 CO 0.00 0.49 -0.95 -0.26 0.37 0.00 0.00 175.52 175.17 1q8a h PHE 195 N -0.03 0.00 -0.46 3.16 -1.00 -1.13 -3.35 116.94 114.14 1q8a h PHE 195 Ca -0.01 0.00 0.09 0.00 2.81 0.00 0.00 57.97 60.86 1q8a h PHE 195 Cb 0.95 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 40.48 1q8a h PHE 195 CO 0.11 0.22 0.32 0.22 -1.61 0.00 0.00 178.31 177.57 1q8a h ASP 196 N 0.00 0.22 -0.09 2.17 3.58 -0.52 -1.04 116.42 120.74 1q8a h ASP 196 Ca -0.05 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.41 1q8a h ASP 196 Cb 1.21 -0.04 0.00 0.00 1.72 0.00 0.00 39.33 42.22 1q8a h ASP 196 CO 0.02 0.14 0.00 -1.84 -2.88 0.00 0.00 179.24 174.67 1q8a n GLU 197 N -4.46 1.82 -2.47 0.28 0.28 -1.26 -4.86 120.64 109.98 1q8a n GLU 197 Ca 0.07 -1.21 -0.28 0.00 -0.16 0.00 0.00 57.16 55.58 1q8a n GLU 197 Cb 0.36 -1.45 0.01 0.00 1.43 0.00 0.00 31.44 31.78 1q8a n GLU 197 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 1q8a s LEU 198 N -1.84 3.48 -0.23 -1.84 1.43 -0.39 -4.73 118.68 114.56 1q8a s LEU 198 Ca 0.35 0.95 -0.06 0.00 -1.03 0.00 0.00 54.13 54.35 1q8a s LEU 198 Cb 0.20 -3.89 -0.20 0.00 0.03 0.00 0.00 46.19 42.33 1q8a s LEU 198 CO 0.31 -0.73 3.02 -0.67 0.23 0.00 0.00 176.35 178.51 1q8a n ASP 199 N -2.40 4.87 -4.97 2.29 2.03 -1.26 -4.85 116.55 112.26 1q8a n ASP 199 Ca 0.02 -2.34 -0.18 0.00 0.52 0.00 0.00 54.79 52.81 1q8a n ASP 199 Cb 0.55 -1.22 -0.00 0.00 -0.72 0.00 0.00 41.12 39.74 1q8a n ASP 199 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 1q8a s ILE 200 N 1.56 2.84 -0.10 5.18 -4.36 -1.26 -4.93 121.20 120.13 1q8a s ILE 200 Ca 0.56 -1.11 0.16 0.00 -0.26 0.00 0.00 60.65 60.00 1q8a s ILE 200 Cb 0.25 -2.95 -0.24 0.00 1.25 0.00 0.00 42.46 40.77 1q8a s ILE 200 CO -0.01 0.00 0.21 0.47 0.24 0.00 0.00 174.94 175.86 1q8a n ASP 201 N -1.77 0.97 -3.70 4.36 9.92 -0.26 -4.97 116.55 121.09 1q8a n ASP 201 Ca 0.07 0.00 -0.11 0.00 -0.53 0.00 0.00 54.79 54.21 1q8a n ASP 201 Cb 0.60 1.33 -0.06 0.00 -0.64 0.00 0.00 41.12 42.35 1q8a n ASP 201 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1q8a s ALA 202 N -2.79 -0.83 0.18 2.24 0.00 -0.90 -2.32 121.76 117.34 1q8a s ALA 202 Ca -0.07 0.06 0.08 0.00 0.00 0.00 0.00 51.96 52.03 1q8a s ALA 202 Cb 0.08 0.44 -0.04 0.00 0.00 0.00 0.00 23.12 23.59 1q8a s ALA 202 CO 0.70 -0.49 -0.16 -0.51 0.00 0.00 0.00 175.76 175.29 1q8a s LEU 203 N -2.29 2.48 0.00 0.00 1.43 0.22 -1.52 118.68 119.00 1q8a s LEU 203 Ca -0.02 -0.92 -0.09 0.00 -1.03 0.00 0.00 54.13 52.06 1q8a s LEU 203 Cb 0.00 -0.74 0.03 0.00 0.03 0.00 0.00 46.19 45.51 1q8a s LEU 203 CO -0.06 -0.10 0.44 0.61 0.23 0.00 0.00 176.35 177.48 1q8a n GLY 204 N 0.03 0.91 2.93 -3.19 0.00 -0.57 -1.49 105.19 103.81 1q8a n GLY 204 Ca -0.11 -1.00 -0.15 0.00 0.00 0.00 0.00 46.02 44.77 1q8a n GLY 204 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1q8a s ILE 205 N -2.31 0.28 0.05 -0.61 1.01 -0.95 -4.25 121.20 114.41 1q8a s ILE 205 Ca 0.10 -0.14 -0.12 0.00 0.00 0.00 0.00 60.65 60.49 1q8a s ILE 205 Cb -0.01 -0.24 0.01 0.00 0.01 0.00 0.00 42.46 42.23 1q8a s ILE 205 CO 0.02 0.08 0.27 0.54 0.00 0.00 0.00 174.94 175.84 1q8a s ASN 206 N -0.05 -0.05 0.30 3.58 4.22 -1.26 -1.37 114.94 120.30 1q8a s ASN 206 Ca 0.01 -0.31 0.00 0.00 -2.14 0.00 0.00 52.86 50.42 1q8a s ASN 206 Cb -0.02 0.35 0.00 0.00 1.28 0.00 0.00 41.25 42.86 1q8a s ASN 206 CO -0.00 -0.63 0.00 0.00 -2.04 0.00 0.00 177.10 174.42 1q8a n SER 208 N -2.04 0.00 -4.26 0.00 7.64 -1.26 -4.64 113.62 109.06 1q8a n SER 208 Ca 0.00 0.00 -0.14 0.00 1.01 0.00 0.00 58.87 59.74 1q8a n SER 208 Cb 0.21 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.31 1q8a n SER 208 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1q8a s LEU 209 N 0.00 1.77 0.86 -3.43 1.43 -1.26 -4.62 118.68 113.43 1q8a s LEU 209 Ca 0.00 -1.29 -0.08 0.00 -1.03 0.00 0.00 54.13 51.73 1q8a s LEU 209 Cb 0.00 0.06 0.18 0.00 0.03 0.00 0.00 46.19 46.46 1q8a s LEU 209 CO 0.00 -0.68 1.17 -0.83 0.23 0.00 0.00 176.35 176.24 1q8a s GLY 210 N -3.22 1.78 0.39 -3.19 0.00 -1.26 -0.96 107.32 100.86 1q8a s GLY 210 Ca 0.31 -1.62 0.09 0.00 0.00 0.00 0.00 44.72 43.50 1q8a s GLY 210 CO 0.09 -0.91 1.96 -0.56 0.00 0.00 0.00 173.10 173.68 1q8a h PRO 211 N -1.12 0.34 -0.28 2.90 0.13 -1.90 -1.96 132.00 130.11 1q8a h PRO 211 Ca -0.39 -0.06 -0.10 0.00 -0.87 0.00 0.00 66.00 64.59 1q8a h PRO 211 Cb 1.24 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 1q8a h PRO 211 CO 0.35 0.37 -0.21 1.49 -0.23 0.00 0.00 178.00 179.77 1q8a h GLU 212 N 0.33 0.64 -0.12 0.86 4.57 -1.94 -2.92 114.58 116.00 1q8a h GLU 212 Ca 0.08 -0.31 -0.16 0.00 -1.18 0.00 0.00 59.36 57.79 1q8a h GLU 212 Cb 0.23 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.82 1q8a h GLU 212 CO 0.01 0.90 -0.59 0.93 -1.18 0.00 0.00 179.01 179.08 1q8a h GLU 213 N 0.37 0.40 0.00 1.92 3.07 -1.91 -3.21 114.58 115.23 1q8a h GLU 213 Ca 0.05 -0.27 -0.09 0.00 -0.50 0.00 0.00 59.36 58.55 1q8a h GLU 213 Cb 0.76 0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.69 1q8a h GLU 213 CO 0.06 0.88 -0.42 0.82 -1.40 0.00 0.00 179.01 178.94 1q8a h ILE 214 N 0.30 1.05 -0.58 3.13 2.04 -1.37 -3.36 117.51 118.72 1q8a h ILE 214 Ca -0.00 -1.58 0.10 0.00 1.00 0.00 0.00 64.86 64.37 1q8a h ILE 214 Cb 1.12 1.92 -0.11 0.00 -0.74 0.00 0.00 36.82 39.01 1q8a h ILE 214 CO 0.10 0.41 -0.37 0.25 0.00 0.00 0.00 178.15 178.54 1q8a h LEU 215 N 0.00 -1.28 -1.39 1.44 7.12 -1.51 0.65 115.31 120.34 1q8a h LEU 215 Ca -0.00 0.23 -0.06 0.00 0.13 0.00 0.00 57.88 58.18 1q8a h LEU 215 Cb 0.89 0.61 -0.01 0.00 -0.53 0.00 0.00 40.66 41.62 1q8a h LEU 215 CO 0.05 -0.32 -0.20 1.55 -0.13 0.00 0.00 178.44 179.40 1q8a h PRO 216 N -0.19 0.15 -0.30 5.25 0.13 -1.79 0.14 132.00 135.40 1q8a h PRO 216 Ca 0.21 -0.04 -0.11 0.00 -0.87 0.00 0.00 66.00 65.19 1q8a h PRO 216 Cb 0.56 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 31.66 1q8a h PRO 216 CO -0.68 0.35 -0.25 0.82 -0.23 0.00 0.00 178.00 178.01 1q8a h ILE 217 N 0.14 1.30 -0.35 -3.56 2.04 -1.17 -2.12 117.51 113.79 1q8a h ILE 217 Ca 0.03 -1.41 -0.09 0.00 1.00 0.00 0.00 64.86 64.38 1q8a h ILE 217 Cb 0.44 1.54 -0.02 0.00 -0.74 0.00 0.00 36.82 38.04 1q8a h ILE 217 CO 0.03 0.45 -0.17 0.15 0.00 0.00 0.00 178.15 178.61 1q8a h PHE 218 N 0.45 0.72 -0.55 1.37 3.57 0.64 -1.80 116.94 121.34 1q8a h PHE 218 Ca 0.05 -0.14 -0.02 0.00 3.53 0.00 0.00 57.97 61.39 1q8a h PHE 218 Cb 0.81 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 39.35 1q8a h PHE 218 CO 0.07 0.78 0.26 0.37 -2.23 0.00 0.00 178.31 177.56 1q8a h GLN 219 N 0.58 0.79 -0.68 1.11 4.15 -0.52 0.21 115.11 120.75 1q8a h GLN 219 Ca 0.09 -0.12 -0.05 0.00 0.77 0.00 0.00 58.65 59.35 1q8a h GLN 219 Cb 0.62 -0.14 -0.03 0.00 0.21 0.00 0.00 27.48 28.14 1q8a h GLN 219 CO 0.04 0.65 0.23 1.49 -1.93 0.00 0.00 178.83 179.31 1q8a h GLU 220 N 0.74 1.04 -0.50 1.69 4.81 -1.09 -1.69 114.58 119.58 1q8a h GLU 220 Ca 0.19 -0.21 -0.04 0.00 -0.13 0.00 0.00 59.36 59.17 1q8a h GLU 220 Cb 0.12 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.32 1q8a h GLU 220 CO -0.02 0.89 0.18 1.25 -0.73 0.00 0.00 179.01 180.58 1q8a h LEU 221 N 0.98 0.72 -1.54 1.64 5.85 -0.94 -2.87 115.31 119.16 1q8a h LEU 221 Ca 0.22 -0.19 -0.03 0.00 0.84 0.00 0.00 57.88 58.72 1q8a h LEU 221 Cb 0.27 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 1q8a h LEU 221 CO -0.01 0.72 -0.01 0.77 -0.34 0.00 0.00 178.44 179.56 1q8a h SER 222 N 0.68 0.25 0.81 1.25 4.64 0.03 -2.28 113.55 118.93 1q8a h SER 222 Ca 0.16 -0.03 -0.02 0.00 -0.47 0.00 0.00 61.79 61.43 1q8a h SER 222 Cb 0.24 -0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 62.27 1q8a h SER 222 CO -0.01 0.31 -0.08 1.56 -0.87 0.00 0.00 176.83 177.74 1q8a h GLN 223 N 0.27 0.00 -0.34 4.77 4.20 -1.09 -3.22 115.11 119.70 1q8a h GLN 223 Ca 0.06 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.77 1q8a h GLN 223 Cb 0.21 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.99 1q8a h GLN 223 CO 0.01 0.08 0.00 0.66 -0.67 0.00 0.00 178.83 178.91 1q8a n TYR 224 N -3.26 0.44 -4.06 2.96 4.01 -0.86 -0.86 117.16 115.54 1q8a n TYR 224 Ca -0.00 -0.33 -0.10 0.00 -0.16 0.00 0.00 57.90 57.30 1q8a n TYR 224 Cb 0.31 -0.01 -0.11 0.00 -0.31 0.00 0.00 39.34 39.22 1q8a n TYR 224 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 1q8a s THR 225 N -1.12 0.37 -1.11 -0.72 -1.32 -1.21 -4.48 115.64 106.05 1q8a s THR 225 Ca 0.28 -1.27 0.12 0.00 -1.21 0.00 0.00 61.69 59.61 1q8a s THR 225 Cb 0.16 -0.80 0.28 0.00 -1.51 0.00 0.00 72.50 70.64 1q8a s THR 225 CO 0.22 -0.59 1.19 -0.90 -2.21 0.00 0.00 174.62 172.33 1q8a n ASP 226 N 1.07 2.79 -4.87 8.08 3.85 -1.26 -4.66 116.55 121.55 1q8a n ASP 226 Ca -0.20 -1.90 -0.27 0.00 -0.71 0.00 0.00 54.79 51.71 1q8a n ASP 226 Cb 0.57 -0.20 0.08 0.00 -1.35 0.00 0.00 41.12 40.22 1q8a n ASP 226 CO 0.00 0.00 0.00 -0.54 -1.01 0.00 0.00 177.20 175.65 1q8a s LYS 227 N -1.00 2.01 0.66 0.11 -0.14 -1.26 -5.02 119.74 115.10 1q8a s LYS 227 Ca 0.23 -0.12 -0.17 0.00 -1.36 0.00 0.00 55.97 54.56 1q8a s LYS 227 Cb 0.12 -2.06 0.00 0.00 -1.68 0.00 0.00 37.83 34.22 1q8a s LYS 227 CO 0.17 -1.46 1.20 -0.06 -0.76 0.00 0.00 175.35 174.43 1q8a s PHE 228 N -3.42 2.27 -0.03 3.18 0.40 -0.98 -4.78 117.98 114.61 1q8a s PHE 228 Ca 0.62 1.56 0.07 0.00 -0.60 0.00 0.00 56.93 58.58 1q8a s PHE 228 Cb -0.10 -3.44 -0.02 0.00 0.51 0.00 0.00 43.02 39.97 1q8a s PHE 228 CO 0.47 -2.33 -0.25 -0.51 0.70 0.00 0.00 175.22 173.30 1q8a s LEU 229 N -4.66 2.09 0.03 -0.37 1.43 -1.26 -0.61 118.68 115.32 1q8a s LEU 229 Ca 0.75 -0.47 0.03 0.00 -1.03 0.00 0.00 54.13 53.41 1q8a s LEU 229 Cb -0.29 -1.36 -0.02 0.00 0.03 0.00 0.00 46.19 44.56 1q8a s LEU 229 CO 0.40 0.30 -0.09 -0.69 0.23 0.00 0.00 176.35 176.49 1q8a s VAL 230 N -0.49 0.72 -0.05 -1.59 1.01 -0.56 -0.24 120.40 119.20 1q8a s VAL 230 Ca 0.06 -0.79 -0.05 0.00 0.00 0.00 0.00 61.98 61.21 1q8a s VAL 230 Cb -0.11 -0.69 0.02 0.00 0.00 0.00 0.00 36.38 35.60 1q8a s VAL 230 CO 0.00 -0.08 0.14 0.54 0.00 0.00 0.00 175.10 175.71 1q8a s VAL 231 N -0.79 -0.00 -0.41 2.92 0.11 -0.90 -2.25 120.40 119.07 1q8a s VAL 231 Ca -0.02 0.01 0.04 0.00 -2.93 0.00 0.00 61.98 59.08 1q8a s VAL 231 Cb -0.07 -0.21 0.17 0.00 -1.53 0.00 0.00 36.38 34.74 1q8a s VAL 231 CO 0.00 0.00 0.37 -1.61 -3.33 0.00 0.00 175.10 170.54 1q8a s GLU 232 N 0.15 0.86 0.68 1.54 2.02 -0.47 -1.46 118.70 122.02 1q8a s GLU 232 Ca -0.01 -1.81 -0.14 0.00 0.02 0.00 0.00 54.97 53.03 1q8a s GLU 232 Cb -0.02 -1.19 0.01 0.00 0.10 0.00 0.00 34.13 33.03 1q8a s GLU 232 CO -0.00 -1.35 1.12 -2.14 0.02 0.00 0.00 175.26 172.90 1q8a s PRO 233 N 0.37 2.67 0.88 0.39 0.02 -1.25 -2.07 135.00 136.00 1q8a s PRO 233 Ca 0.30 1.39 -0.12 0.00 0.02 0.00 0.00 61.00 62.59 1q8a s PRO 233 Cb -0.01 -1.93 0.12 0.00 0.02 0.00 0.00 34.50 32.70 1q8a s PRO 233 CO -0.15 -1.36 1.10 -0.80 -0.33 0.00 0.00 177.00 175.46 1q8a s ASN 234 N -2.64 3.62 -1.45 2.53 0.01 -0.14 -0.92 114.94 115.95 1q8a s ASN 234 Ca 0.67 1.40 -0.12 0.00 -0.71 0.00 0.00 52.86 54.09 1q8a s ASN 234 Cb -0.21 -2.08 0.04 0.00 0.41 0.00 0.00 41.25 39.41 1q8a s ASN 234 CO 0.44 -2.54 2.28 0.00 -1.51 0.00 0.00 177.10 175.77 1q8a n ALA 235 N -3.81 5.84 0.00 0.60 0.00 -1.05 -3.85 120.51 118.25 1q8a n ALA 235 Ca 0.07 -3.91 0.00 0.00 0.00 0.00 0.00 53.44 49.60 1q8a n ALA 235 Cb 0.56 -3.41 0.00 0.00 0.00 0.00 0.00 19.45 16.60 1q8a n ALA 235 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1q8a n GLY 236 N 3.75 -0.68 3.76 0.00 0.00 -1.26 -1.67 105.19 109.10 1q8a n GLY 236 Ca 0.54 -1.65 -0.41 0.00 0.00 0.00 0.00 46.02 44.50 1q8a n GLY 236 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1q8a s LYS 237 N -2.62 4.40 0.26 1.61 1.02 -1.26 -4.26 119.74 118.90 1q8a s LYS 237 Ca 0.00 2.14 -0.31 0.00 0.02 0.00 0.00 55.97 57.82 1q8a s LYS 237 Cb 0.00 -3.10 -0.12 0.00 -0.52 0.00 0.00 37.83 34.09 1q8a s LYS 237 CO 0.00 -0.14 1.62 -2.30 -0.92 0.00 0.00 175.35 173.61 1q8a n PRO 238 N 1.08 2.64 -4.19 -1.68 -0.02 -1.26 -4.64 135.00 126.93 1q8a n PRO 238 Ca 0.01 0.94 -0.16 0.00 -2.02 0.00 0.00 63.50 62.27 1q8a n PRO 238 Cb 0.42 -2.73 -0.13 0.00 -0.02 0.00 0.00 33.50 31.04 1q8a n PRO 238 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 1q8a s ILE 239 N 0.37 0.63 -0.02 4.25 -4.36 -0.54 -4.96 121.20 116.58 1q8a s ILE 239 Ca 0.68 -0.69 -0.18 0.00 -0.26 0.00 0.00 60.65 60.20 1q8a s ILE 239 Cb -0.52 -0.60 -0.05 0.00 1.25 0.00 0.00 42.46 42.54 1q8a s ILE 239 CO 0.43 -0.07 0.51 -0.69 0.24 0.00 0.00 174.94 175.36 1q8a s VAL 240 N -0.71 4.98 0.00 8.37 1.01 -1.26 -0.13 120.40 132.65 1q8a s VAL 240 Ca -0.02 1.05 0.00 0.00 0.00 0.00 0.00 61.98 63.01 1q8a s VAL 240 Cb -0.06 -3.83 0.00 0.00 0.00 0.00 0.00 36.38 32.49 1q8a s VAL 240 CO 0.00 0.47 0.00 -0.62 0.00 0.00 0.00 175.10 174.95 1q8a n GLU 241 N 2.49 0.00 -0.94 2.72 -0.58 -0.89 -4.92 120.64 118.52 1q8a n GLU 241 Ca -0.10 0.00 -0.11 0.00 -0.42 0.00 0.00 57.16 56.53 1q8a n GLU 241 Cb 0.51 0.00 -0.16 0.00 -0.57 0.00 0.00 31.44 31.22 1q8a n GLU 241 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1q8a n ASN 242 N 0.00 4.95 0.00 1.62 5.15 -1.26 -4.38 115.26 121.35 1q8a n ASN 242 Ca 0.00 -2.42 0.00 0.00 -0.60 0.00 0.00 54.58 51.56 1q8a n ASN 242 Cb 0.00 -1.34 0.00 0.00 -0.53 0.00 0.00 39.78 37.91 1q8a n ASN 242 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1q8a n GLY 243 N 2.53 4.04 3.59 8.20 0.00 -1.26 -5.12 105.19 117.18 1q8a n GLY 243 Ca 0.41 -0.82 -0.12 0.00 0.00 0.00 0.00 46.02 45.48 1q8a n GLY 243 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1q8a s LYS 244 N 0.00 1.93 -0.16 1.61 -0.14 -1.26 -5.09 119.74 116.62 1q8a s LYS 244 Ca 0.00 -1.58 -0.39 0.00 -1.36 0.00 0.00 55.97 52.64 1q8a s LYS 244 Cb 0.00 0.50 -0.16 0.00 -1.68 0.00 0.00 37.83 36.48 1q8a s LYS 244 CO 0.00 -0.83 1.58 2.41 -0.76 0.00 0.00 175.35 177.75 1q8a n THR 245 N -0.52 0.18 -4.35 2.17 -1.04 -1.26 -2.09 114.28 107.36 1q8a n THR 245 Ca -0.02 -0.03 -0.19 0.00 -2.04 0.00 0.00 64.05 61.77 1q8a n THR 245 Cb 0.61 -1.01 -0.14 0.00 -1.82 0.00 0.00 70.33 67.98 1q8a n THR 245 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1q8a s VAL 246 N 2.36 0.92 -0.37 12.58 0.11 0.82 -4.93 120.40 131.88 1q8a s VAL 246 Ca 0.94 -0.77 -0.04 0.00 -2.93 0.00 0.00 61.98 59.18 1q8a s VAL 246 Cb -1.06 -0.82 0.08 0.00 -1.53 0.00 0.00 36.38 33.05 1q8a s VAL 246 CO 0.60 0.06 0.15 -0.31 -3.33 0.00 0.00 175.10 172.26 1q8a s TYR 247 N -0.65 3.42 -0.40 1.54 2.02 -1.26 -1.46 117.35 120.56 1q8a s TYR 247 Ca 0.01 -2.00 0.26 0.00 -0.37 0.00 0.00 57.07 54.98 1q8a s TYR 247 Cb -0.06 -2.77 0.79 0.00 -0.40 0.00 0.00 41.96 39.52 1q8a s TYR 247 CO 0.00 -0.88 1.75 -1.00 -1.57 0.00 0.00 175.55 173.86 1q8a h PRO 248 N 8.12 0.00 -6.31 -1.71 0.13 -1.80 -3.47 132.00 126.96 1q8a h PRO 248 Ca -0.18 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.41 1q8a h PRO 248 Cb 1.06 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.20 1q8a h PRO 248 CO 0.65 0.00 1.18 -0.51 -0.23 0.00 0.00 178.00 179.09 1q8a s LEU 249 N -5.52 4.35 0.75 1.56 1.43 -0.67 -4.99 118.68 115.59 1q8a s LEU 249 Ca 0.06 2.45 -0.12 0.00 -1.03 0.00 0.00 54.13 55.49 1q8a s LEU 249 Cb 0.08 -3.53 0.04 0.00 0.03 0.00 0.00 46.19 42.81 1q8a s LEU 249 CO 0.58 -1.03 1.12 -0.54 0.23 0.00 0.00 176.35 176.71 1q8a s LYS 250 N 4.35 2.52 0.16 1.70 1.02 -1.26 -4.82 119.74 123.41 1q8a s LYS 250 Ca 0.82 0.39 -0.23 0.00 0.02 0.00 0.00 55.97 56.98 1q8a s LYS 250 Cb -0.38 -1.99 0.04 0.00 -0.52 0.00 0.00 37.83 34.98 1q8a s LYS 250 CO 0.36 -1.26 1.62 -1.35 -0.92 0.00 0.00 175.35 173.80 1q8a h PRO 251 N -0.82 -0.25 -0.34 -1.68 0.11 -1.94 -1.52 132.00 125.57 1q8a h PRO 251 Ca -0.46 0.02 0.01 0.00 0.11 0.00 0.00 66.00 65.69 1q8a h PRO 251 Cb 1.27 0.06 -0.02 0.00 0.11 0.00 0.00 31.00 32.42 1q8a h PRO 251 CO 0.64 -0.16 0.20 1.25 -0.21 0.00 0.00 178.00 179.71 1q8a h HIS 252 N -0.25 0.37 0.00 0.65 -0.00 -1.95 0.10 115.15 114.07 1q8a h HIS 252 Ca 0.15 0.01 -0.02 0.00 -0.00 0.00 0.00 60.37 60.52 1q8a h HIS 252 Cb 0.49 -0.12 -0.00 0.00 -0.00 0.00 0.00 27.41 27.78 1q8a h HIS 252 CO -0.44 0.22 -0.08 -0.44 -0.00 0.00 0.00 177.93 177.19 1q8a h ASP 253 N 0.40 0.00 0.02 3.26 3.32 -1.85 -2.00 116.42 119.57 1q8a h ASP 253 Ca 0.13 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 57.05 1q8a h ASP 253 Cb 0.00 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 1q8a h ASP 253 CO -0.06 0.08 -0.72 0.15 -1.72 0.00 0.00 179.24 176.96 1q8a h PHE 254 N 0.00 0.08 -0.03 4.55 3.04 -0.52 -3.37 116.94 120.70 1q8a h PHE 254 Ca -0.00 -0.06 0.01 0.00 3.98 0.00 0.00 57.97 61.90 1q8a h PHE 254 Cb 0.26 -0.00 -0.00 0.00 2.56 0.00 0.00 35.95 38.77 1q8a h PHE 254 CO 0.00 1.28 0.02 0.00 -2.02 0.00 0.00 178.31 177.59 1q8a h ALA 255 N -0.20 1.92 0.00 2.41 0.00 -0.58 -2.24 119.26 120.58 1q8a h ALA 255 Ca -0.19 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1q8a h ALA 255 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1q8a h ALA 255 CO -0.07 -0.04 0.00 -0.39 0.00 0.00 0.00 179.25 178.75 1q8a h VAL 256 N 0.00 0.00 0.00 0.00 -1.51 -1.53 -1.99 116.25 111.22 1q8a h VAL 256 Ca 0.01 -0.05 0.00 0.00 -1.23 0.00 0.00 66.70 65.43 1q8a h VAL 256 Cb 0.06 0.72 0.00 0.00 -2.13 0.00 0.00 31.29 29.94 1q8a h VAL 256 CO -0.00 0.00 -0.27 1.41 -1.23 0.00 0.00 177.57 177.48 1q8a n HIS 257 N -2.51 0.55 -0.23 5.19 -0.00 -0.84 -4.11 115.22 113.28 1q8a n HIS 257 Ca -0.01 0.16 0.02 0.00 -0.00 0.00 0.00 57.72 57.89 1q8a n HIS 257 Cb 0.08 -0.70 0.14 0.00 -0.00 0.00 0.00 29.99 29.51 1q8a n HIS 257 CO 0.00 0.00 0.00 0.82 -0.00 0.00 0.00 176.34 177.16 1q8a h ILE 258 N 0.00 0.70 -0.33 1.59 2.04 -1.54 -2.25 117.51 117.72 1q8a h ILE 258 Ca 0.00 -0.14 0.06 0.00 1.00 0.00 0.00 64.86 65.78 1q8a h ILE 258 Cb 0.68 0.26 -0.06 0.00 -0.74 0.00 0.00 36.82 36.96 1q8a h ILE 258 CO 0.00 0.07 -0.03 0.44 0.00 0.00 0.00 178.15 178.63 1q8a h ASP 259 N 0.40 -0.21 -0.57 1.72 3.32 -1.80 -0.19 116.42 119.10 1q8a h ASP 259 Ca 0.35 0.09 0.01 0.00 0.02 0.00 0.00 57.03 57.50 1q8a h ASP 259 Cb 0.49 0.16 -0.03 0.00 0.22 0.00 0.00 39.33 40.18 1q8a h ASP 259 CO -0.36 -0.07 0.38 0.77 -1.72 0.00 0.00 179.24 178.24 1q8a h SER 260 N 0.05 0.64 0.41 6.45 4.64 -1.68 -0.42 113.55 123.64 1q8a h SER 260 Ca 0.16 -0.01 -0.20 0.00 -0.47 0.00 0.00 61.79 61.27 1q8a h SER 260 Cb 0.23 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 62.16 1q8a h SER 260 CO -0.30 0.46 -0.83 1.88 -0.87 0.00 0.00 176.83 177.17 1q8a h TYR 261 N 0.75 0.45 -0.74 4.77 0.05 -0.97 -2.99 116.97 118.29 1q8a h TYR 261 Ca 0.21 -0.22 -0.06 0.00 0.05 0.00 0.00 58.73 58.70 1q8a h TYR 261 Cb -0.06 -0.06 -0.03 0.00 1.01 0.00 0.00 36.73 37.59 1q8a h TYR 261 CO -0.00 1.01 0.21 -0.92 -1.05 0.00 0.00 178.16 177.41 1q8a h TYR 262 N 0.19 1.21 0.00 4.88 5.03 -0.13 -1.87 116.97 126.28 1q8a h TYR 262 Ca -0.05 -0.13 -0.03 0.00 2.58 0.00 0.00 58.73 61.11 1q8a h TYR 262 Cb 1.43 -0.35 -0.00 0.00 1.55 0.00 0.00 36.73 39.36 1q8a h TYR 262 CO 0.04 0.96 -0.12 0.93 -1.32 0.00 0.00 178.16 178.65 1q8a h GLU 263 N 1.10 0.00 -0.46 1.82 5.08 -1.06 -1.77 114.58 119.29 1q8a h GLU 263 Ca 0.23 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 1q8a h GLU 263 Cb 0.34 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1q8a h GLU 263 CO -0.00 0.12 0.00 1.28 -1.00 0.00 0.00 179.01 179.41 1q8a n LEU 264 N -3.44 2.51 0.00 1.33 4.77 -0.83 -4.92 117.00 116.42 1q8a n LEU 264 Ca -0.01 -1.25 0.00 0.00 -0.03 0.00 0.00 56.01 54.72 1q8a n LEU 264 Cb 0.29 -0.31 0.00 0.00 -2.33 0.00 0.00 43.42 41.07 1q8a n LEU 264 CO 0.30 0.62 0.00 0.61 -1.33 0.00 0.00 177.39 177.59 1q8a n GLY 265 N 1.25 0.71 3.73 -0.72 0.00 -0.66 -4.86 105.19 104.63 1q8a n GLY 265 Ca 0.16 -0.34 -0.40 0.00 0.00 0.00 0.00 46.02 45.44 1q8a n GLY 265 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1q8a n VAL 266 N -2.51 2.76 -0.05 1.61 3.14 -0.76 -4.53 118.33 117.98 1q8a n VAL 266 Ca 0.00 -0.50 -0.05 0.00 -2.96 0.00 0.00 64.34 60.83 1q8a n VAL 266 Cb 0.00 -1.72 -0.08 0.00 -1.06 0.00 0.00 33.84 30.98 1q8a n VAL 266 CO 0.00 0.00 0.00 0.59 -6.46 0.00 0.00 176.83 170.96 1q8a n ASN 267 N -0.07 2.42 -3.76 6.55 4.13 0.67 -4.77 115.26 120.42 1q8a n ASN 267 Ca 0.06 -0.00 -0.15 0.00 1.68 0.00 0.00 54.58 56.16 1q8a n ASN 267 Cb 0.41 0.70 -0.16 0.00 -1.54 0.00 0.00 39.78 39.19 1q8a n ASN 267 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1q8a s ILE 268 N -2.26 -0.05 -0.05 2.41 1.01 -0.89 -1.22 121.20 120.15 1q8a s ILE 268 Ca -0.06 0.23 0.06 0.00 0.00 0.00 0.00 60.65 60.87 1q8a s ILE 268 Cb 0.03 -0.09 -0.01 0.00 0.01 0.00 0.00 42.46 42.40 1q8a s ILE 268 CO 0.43 0.10 -0.22 0.12 0.00 0.00 0.00 174.94 175.36 1q8a s PHE 269 N 1.15 2.19 0.00 3.97 2.19 -0.21 -2.11 117.98 125.15 1q8a s PHE 269 Ca -0.08 -0.64 0.00 0.00 0.33 0.00 0.00 56.93 56.54 1q8a s PHE 269 Cb -0.13 -1.44 0.00 0.00 -1.31 0.00 0.00 43.02 40.14 1q8a s PHE 269 CO -0.03 -0.19 0.00 0.41 1.83 0.00 0.00 175.22 177.24 1q8a n GLY 270 N 2.99 3.01 3.15 13.12 0.00 -0.54 0.56 105.19 127.49 1q8a n GLY 270 Ca -0.18 -0.88 -0.12 0.00 0.00 0.00 0.00 46.02 44.85 1q8a n GLY 270 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1q8a s GLY 271 N -0.21 0.73 0.00 -0.02 0.00 -0.79 -3.81 107.32 103.22 1q8a s GLY 271 Ca 0.00 -1.21 0.00 0.00 0.00 0.00 0.00 44.72 43.51 1q8a s GLY 271 CO 0.00 -1.31 0.00 0.00 0.00 0.00 0.00 173.10 171.79 1q8a n GLY 274 N 1.65 3.27 3.73 0.00 0.00 -1.26 -2.52 105.19 110.06 1q8a n GLY 274 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 1q8a n GLY 274 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1q8a s THR 275 N -2.46 3.96 0.44 2.61 2.01 -0.23 -4.70 115.64 117.26 1q8a s THR 275 Ca 0.00 1.61 0.04 0.00 0.31 0.00 0.00 61.69 63.65 1q8a s THR 275 Cb 0.00 -4.03 -0.04 0.00 0.01 0.00 0.00 72.50 68.44 1q8a s THR 275 CO 0.00 0.24 0.03 0.42 -0.69 0.00 0.00 174.62 174.62 1q8a s THR 276 N 0.09 1.31 0.53 -0.82 -4.23 -1.26 -2.00 115.64 109.26 1q8a s THR 276 Ca 0.51 -2.00 0.21 0.00 -1.18 0.00 0.00 61.69 59.23 1q8a s THR 276 Cb -0.29 -2.51 0.29 0.00 1.34 0.00 0.00 72.50 71.33 1q8a s THR 276 CO 0.33 0.00 2.17 -0.65 -0.54 0.00 0.00 174.62 175.93 1q8a h PRO 277 N 1.64 0.00 -0.29 3.99 0.11 -1.94 -0.84 132.00 134.68 1q8a h PRO 277 Ca -0.42 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.59 1q8a h PRO 277 Cb 1.28 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.37 1q8a h PRO 277 CO 0.73 0.02 -0.24 0.93 -0.21 0.00 0.00 178.00 179.23 1q8a h GLU 278 N 0.00 0.55 -0.16 1.05 3.07 -1.95 0.58 114.58 117.72 1q8a h GLU 278 Ca -0.00 -0.21 -0.03 0.00 -0.50 0.00 0.00 59.36 58.61 1q8a h GLU 278 Cb 0.04 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 27.92 1q8a h GLU 278 CO 0.00 0.75 -0.03 0.45 -1.40 0.00 0.00 179.01 178.78 1q8a h HIS 279 N 0.49 0.34 -0.60 4.33 3.86 -1.58 -3.01 115.15 118.98 1q8a h HIS 279 Ca 0.07 -0.07 -0.04 0.00 -1.16 0.00 0.00 60.37 59.16 1q8a h HIS 279 Cb 0.68 -0.08 -0.03 0.00 1.06 0.00 0.00 27.41 29.04 1q8a h HIS 279 CO 0.03 0.57 0.20 0.28 0.86 0.00 0.00 177.93 179.87 1q8a h VAL 280 N 0.02 1.23 -0.64 2.45 2.07 -0.72 -0.75 116.25 119.89 1q8a h VAL 280 Ca 0.04 -0.76 0.04 0.00 0.82 0.00 0.00 66.70 66.83 1q8a h VAL 280 Cb 0.46 0.55 -0.04 0.00 -1.52 0.00 0.00 31.29 30.74 1q8a h VAL 280 CO 0.01 0.30 0.39 0.11 0.02 0.00 0.00 177.57 178.40 1q8a h LYS 281 N 0.88 0.73 -0.11 1.57 1.57 -0.89 -0.76 116.57 119.55 1q8a h LYS 281 Ca 0.20 -0.04 -0.15 0.00 -1.87 0.00 0.00 60.65 58.78 1q8a h LYS 281 Cb 0.24 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 1q8a h LYS 281 CO -0.01 0.48 -0.58 1.25 -0.57 0.00 0.00 179.45 180.02 1q8a h LEU 282 N 0.75 0.41 -1.24 2.94 5.85 -1.31 -2.75 115.31 119.96 1q8a h LEU 282 Ca 0.26 -0.23 0.00 0.00 0.84 0.00 0.00 57.88 58.76 1q8a h LEU 282 Cb 0.06 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 40.94 1q8a h LEU 282 CO -0.12 0.90 0.48 -0.26 -0.34 0.00 0.00 178.44 179.09 1q8a h PHE 283 N 0.27 0.95 -0.26 1.25 0.04 -0.38 -0.22 116.94 118.59 1q8a h PHE 283 Ca -0.00 0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.78 1q8a h PHE 283 Cb 1.10 -0.32 -0.01 0.00 2.20 0.00 0.00 35.95 38.92 1q8a h PHE 283 CO 0.03 0.61 0.14 -0.09 -0.60 0.00 0.00 178.31 178.41 1q8a h ARG 284 N 1.01 0.37 -0.64 1.51 9.65 -0.90 0.34 114.38 125.72 1q8a h ARG 284 Ca 0.27 -0.04 -0.06 0.00 -1.10 0.00 0.00 59.98 59.05 1q8a h ARG 284 Cb -0.09 -0.07 -0.03 0.00 -1.39 0.00 0.00 29.97 28.39 1q8a h ARG 284 CO -0.06 0.32 0.18 0.87 2.80 0.00 0.00 179.97 184.09 1q8a h LYS 285 N 0.31 1.01 -0.05 0.20 1.57 -1.12 -2.20 116.57 116.28 1q8a h LYS 285 Ca 0.09 -0.23 -0.16 0.00 -1.87 0.00 0.00 60.65 58.48 1q8a h LYS 285 Cb 0.06 -0.14 0.01 0.00 0.08 0.00 0.00 32.23 32.25 1q8a h LYS 285 CO -0.01 0.90 -0.59 0.28 -0.57 0.00 0.00 179.45 179.45 1q8a h VAL 286 N 0.93 1.38 0.05 0.50 2.07 -0.83 -3.30 116.25 117.05 1q8a h VAL 286 Ca 0.20 -1.97 -0.00 0.00 0.82 0.00 0.00 66.70 65.75 1q8a h VAL 286 Cb 0.33 2.38 0.00 0.00 -1.52 0.00 0.00 31.29 32.47 1q8a h VAL 286 CO -0.00 0.59 -0.02 0.25 0.02 0.00 0.00 177.57 178.40 1q8a h LEU 287 N 0.05 -0.05 0.00 2.57 5.85 -0.33 -3.48 115.31 119.92 1q8a h LEU 287 Ca -0.06 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.55 1q8a h LEU 287 Cb 1.27 0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.31 1q8a h LEU 287 CO 0.12 0.07 0.00 0.61 -0.34 0.00 0.00 178.44 178.90 1q8a n GLY 288 N -0.81 2.02 3.14 3.75 0.00 -0.83 -4.41 105.19 108.06 1q8a n GLY 288 Ca -0.08 -0.53 -0.35 0.00 0.00 0.00 0.00 46.02 45.07 1q8a n GLY 288 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1q8a s ASN 289 N -4.00 5.01 0.04 1.61 2.47 -1.26 -4.98 114.94 113.83 1q8a s ASN 289 Ca 0.00 -1.60 0.06 0.00 0.42 0.00 0.00 52.86 51.74 1q8a s ASN 289 Cb 0.00 -1.75 -0.02 0.00 -1.45 0.00 0.00 41.25 38.03 1q8a s ASN 289 CO 0.00 -0.37 -0.16 -0.13 -3.72 0.00 0.00 177.10 172.72 1q8a s ARG 290 N 1.19 1.05 -0.07 0.43 0.52 -1.26 -5.06 118.95 115.76 1q8a s ARG 290 Ca 0.01 -0.83 -0.15 0.00 -0.52 0.00 0.00 55.73 54.24 1q8a s ARG 290 Cb -0.21 -1.10 -0.05 0.00 0.52 0.00 0.00 34.95 34.11 1q8a s ARG 290 CO -0.03 0.27 0.39 0.21 0.02 0.00 0.00 175.30 176.17 1q8a s LYS 291 N -1.20 4.08 0.66 3.54 2.20 -1.26 -1.03 119.74 126.73 1q8a s LYS 291 Ca 0.03 0.34 -0.17 0.00 -0.36 0.00 0.00 55.97 55.81 1q8a s LYS 291 Cb -0.08 -3.32 -0.00 0.00 -1.51 0.00 0.00 37.83 32.92 1q8a s LYS 291 CO 0.02 0.46 1.26 -1.25 -0.36 0.00 0.00 175.35 175.48 1q8a s PRO 292 N -0.31 2.52 0.52 4.03 0.04 -1.26 -4.87 135.00 135.67 1q8a s PRO 292 Ca 0.23 1.95 -0.17 0.00 0.04 0.00 0.00 61.00 63.04 1q8a s PRO 292 Cb -0.15 -1.86 -0.07 0.00 0.04 0.00 0.00 34.50 32.46 1q8a s PRO 292 CO 0.10 -1.59 1.01 -0.51 0.04 0.00 0.00 177.00 176.05 1q8a s LEU 293 N -4.51 3.66 0.24 -3.56 1.02 -1.26 -5.06 118.68 109.21 1q8a s LEU 293 Ca 0.80 1.70 -0.15 0.00 0.02 0.00 0.00 54.13 56.49 1q8a s LEU 293 Cb -0.34 -4.53 -0.08 0.00 0.02 0.00 0.00 46.19 41.26 1q8a s LEU 293 CO 0.40 -0.73 0.66 -1.10 0.02 0.00 0.00 176.35 175.59 1q8a s GLN 294 N -3.85 4.02 0.08 1.70 -1.52 -1.26 -4.81 119.66 114.03 1q8a s GLN 294 Ca 0.62 0.61 0.03 0.00 -1.95 0.00 0.00 55.36 54.66 1q8a s GLN 294 Cb -0.12 -2.70 -0.03 0.00 -0.22 0.00 0.00 33.01 29.94 1q8a s GLN 294 CO 0.29 0.32 -0.08 1.03 -0.25 0.00 0.00 175.29 176.60 1q8a s ARG 295 N -2.46 0.75 -0.30 2.91 0.52 -1.26 -4.97 118.95 114.14 1q8a s ARG 295 Ca 0.46 -1.11 0.02 0.00 -0.52 0.00 0.00 55.73 54.58 1q8a s ARG 295 Cb -0.13 -0.34 0.08 0.00 0.52 0.00 0.00 34.95 35.08 1q8a s ARG 295 CO 0.19 0.03 0.01 0.21 0.02 0.00 0.00 175.30 175.77 1q8a s LYS 296 N -2.85 1.48 0.44 3.54 2.36 -1.26 -5.02 119.74 118.43 1q8a s LYS 296 Ca 0.04 -1.42 -0.23 0.00 -2.55 0.00 0.00 55.97 51.80 1q8a s LYS 296 Cb -0.02 -2.77 -0.08 0.00 -1.05 0.00 0.00 37.83 33.91 1q8a s LYS 296 CO -0.02 -0.81 1.16 -1.59 1.55 0.00 0.00 175.35 175.64 1q8a s LYS 297 N 1.19 3.85 0.17 4.03 -2.85 -1.26 -4.99 119.74 119.88 1q8a s LYS 297 Ca 0.04 1.77 -0.30 0.00 -1.00 0.00 0.00 55.97 56.47 1q8a s LYS 297 Cb -0.19 -2.47 -0.08 0.00 -2.06 0.00 0.00 37.83 33.04 1q8a s LYS 297 CO -0.10 -0.48 1.18 0.15 0.10 0.00 0.00 175.35 176.20 1q8a s LYS 298 N -2.61 4.50 0.16 1.78 1.02 -0.04 -5.01 119.74 119.55 1q8a s LYS 298 Ca 0.62 1.83 -0.12 0.00 0.02 0.00 0.00 55.97 58.32 1q8a s LYS 298 Cb -0.28 -3.26 -0.07 0.00 -0.52 0.00 0.00 37.83 33.70 1q8a s LYS 298 CO 0.35 -0.08 0.53 1.03 -0.92 0.00 0.00 175.35 176.26 1q8a s ARG 299 N -0.09 3.89 -0.19 1.68 1.81 -1.26 -4.79 118.95 120.01 1q8a s ARG 299 Ca 0.53 0.38 -0.27 0.00 -1.72 0.00 0.00 55.73 54.65 1q8a s ARG 299 Cb -0.32 -2.85 0.08 0.00 -0.45 0.00 0.00 34.95 31.41 1q8a s ARG 299 CO 0.35 0.44 0.77 -1.50 -0.68 0.00 0.00 175.30 174.68 1q8a s ILE 300 N -1.57 0.00 -0.43 1.52 2.07 -1.26 -5.11 121.20 116.42 1q8a s ILE 300 Ca 0.40 0.00 -0.13 0.00 -1.41 0.00 0.00 60.65 59.51 1q8a s ILE 300 Cb -0.14 -1.00 0.05 0.00 0.13 0.00 0.00 42.46 41.51 1q8a s ILE 300 CO 0.20 0.00 0.30 0.12 -1.91 0.00 0.00 174.94 173.65 1q8a s PHE 301 N -0.29 3.26 0.05 3.50 2.19 -1.26 -5.05 117.98 120.38 1q8a s PHE 301 Ca -0.03 -0.99 -0.11 0.00 0.33 0.00 0.00 56.93 56.12 1q8a s PHE 301 Cb -0.03 -2.84 0.01 0.00 -1.31 0.00 0.00 43.02 38.85 1q8a s PHE 301 CO 0.03 -0.73 0.23 0.00 1.83 0.00 0.00 175.22 176.58 1q8a s ALA 302 N 1.58 -0.45 0.19 11.12 0.00 -1.26 -2.01 121.76 130.93 1q8a s ALA 302 Ca 0.03 -0.24 0.07 0.00 0.00 0.00 0.00 51.96 51.83 1q8a s ALA 302 Cb -0.22 0.33 -0.05 0.00 0.00 0.00 0.00 23.12 23.19 1q8a s ALA 302 CO 0.06 -0.41 -0.14 0.14 0.00 0.00 0.00 175.76 175.42 1q8a s VAL 303 N -2.79 1.67 0.15 0.00 -7.23 -0.48 -4.94 120.40 106.78 1q8a s VAL 303 Ca -0.03 -2.15 -0.08 0.00 -1.81 0.00 0.00 61.98 57.91 1q8a s VAL 303 Cb -0.00 -1.98 -0.01 0.00 0.56 0.00 0.00 36.38 34.94 1q8a s VAL 303 CO -0.05 -0.58 0.24 -0.94 -0.31 0.00 0.00 175.10 173.45 1q8a s SER 304 N -3.21 0.09 0.44 4.85 1.04 0.30 -0.27 113.70 116.94 1q8a s SER 304 Ca 0.21 -0.89 0.03 0.00 0.48 0.00 0.00 55.95 55.78 1q8a s SER 304 Cb -0.01 0.40 -0.02 0.00 0.10 0.00 0.00 66.02 66.49 1q8a s SER 304 CO 0.06 -0.85 0.08 -0.94 0.98 0.00 0.00 173.24 172.58 1q8a s SER 305 N -2.96 3.23 0.36 7.02 1.04 -0.35 -2.79 113.70 119.25 1q8a s SER 305 Ca 0.16 -1.65 0.05 0.00 0.48 0.00 0.00 55.95 55.00 1q8a s SER 305 Cb 0.04 0.46 0.71 0.00 0.10 0.00 0.00 66.02 67.34 1q8a s SER 305 CO -0.01 -0.88 1.97 -0.65 0.98 0.00 0.00 173.24 174.65 1q8a h PRO 306 N 1.66 0.76 -0.01 4.02 0.11 -1.81 -3.14 132.00 133.60 1q8a h PRO 306 Ca -0.39 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1q8a h PRO 306 Cb 1.28 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1q8a h PRO 306 CO 0.64 0.50 -0.26 -1.13 -0.21 0.00 0.00 178.00 177.54 1q8a n SER 307 N -4.47 1.41 -3.89 -2.05 3.41 -1.24 -1.41 113.62 105.37 1q8a n SER 307 Ca 0.10 -1.20 -0.20 0.00 -0.26 0.00 0.00 58.87 57.31 1q8a n SER 307 Cb 0.18 0.46 -0.16 0.00 -0.26 0.00 0.00 64.21 64.43 1q8a n SER 307 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1q8a s LYS 308 N -1.59 0.81 -0.23 4.33 -0.14 -1.19 -4.84 119.74 116.88 1q8a s LYS 308 Ca 0.11 -0.10 -0.05 0.00 -1.36 0.00 0.00 55.97 54.56 1q8a s LYS 308 Cb 0.10 -0.81 -0.01 0.00 -1.68 0.00 0.00 37.83 35.43 1q8a s LYS 308 CO 0.32 -0.08 0.00 -1.17 -0.76 0.00 0.00 175.35 173.67 1q8a s LEU 309 N 0.88 3.14 -0.33 3.17 2.96 -1.26 -1.21 118.68 126.03 1q8a s LEU 309 Ca -0.12 -0.34 -0.07 0.00 -0.22 0.00 0.00 54.13 53.38 1q8a s LEU 309 Cb -0.14 -1.81 0.03 0.00 0.50 0.00 0.00 46.19 44.76 1q8a s LEU 309 CO 0.00 -0.03 0.10 -0.69 -1.32 0.00 0.00 176.35 174.41 1q8a s VAL 310 N 1.53 3.90 -0.13 1.68 1.01 0.63 -4.97 120.40 124.06 1q8a s VAL 310 Ca 0.06 -0.95 -0.11 0.00 0.00 0.00 0.00 61.98 60.97 1q8a s VAL 310 Cb -0.15 -3.14 -0.05 0.00 0.00 0.00 0.00 36.38 33.05 1q8a s VAL 310 CO -0.00 -0.09 0.24 -0.89 0.00 0.00 0.00 175.10 174.35 1q8a s THR 311 N 1.45 5.34 -1.56 3.92 2.01 -1.26 -1.38 115.64 124.16 1q8a s THR 311 Ca 0.00 0.43 -0.10 0.00 0.31 0.00 0.00 61.69 62.33 1q8a s THR 311 Cb -0.19 -3.54 -0.04 0.00 0.01 0.00 0.00 72.50 68.74 1q8a s THR 311 CO 0.03 0.51 2.75 0.49 -0.69 0.00 0.00 174.62 177.71 1q8a n PHE 312 N 2.74 2.63 -0.63 4.92 3.72 -0.85 -4.16 117.46 125.82 1q8a n PHE 312 Ca -0.16 -3.04 0.06 0.00 -0.05 0.00 0.00 57.45 54.27 1q8a n PHE 312 Cb 0.53 -2.41 0.10 0.00 -0.94 0.00 0.00 39.48 36.76 1q8a n PHE 312 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 1q8a n ASP 313 N 3.76 2.41 -3.76 4.37 5.68 -1.26 -4.98 116.55 122.77 1q8a n ASP 313 Ca 0.72 -2.63 -0.09 0.00 -0.50 0.00 0.00 54.79 52.28 1q8a n ASP 313 Cb 0.26 -0.28 -0.03 0.00 -1.14 0.00 0.00 41.12 39.93 1q8a n ASP 313 CO 0.00 0.00 0.00 -1.38 -1.33 0.00 0.00 177.20 174.49 1q8a s HIS 314 N -2.10 -0.16 0.10 2.11 -3.43 -1.26 -5.13 115.29 105.42 1q8a s HIS 314 Ca 0.21 -0.21 -0.31 0.00 -0.80 0.00 0.00 55.06 53.96 1q8a s HIS 314 Cb 0.18 0.51 -0.08 0.00 -1.43 0.00 0.00 32.58 31.75 1q8a s HIS 314 CO 0.03 -1.03 1.53 0.12 -2.00 0.00 0.00 174.74 173.39 1q8a s PHE 315 N -3.89 2.87 -0.29 0.38 5.36 -1.26 -4.87 117.98 116.28 1q8a s PHE 315 Ca 0.10 0.63 -0.08 0.00 -0.96 0.00 0.00 56.93 56.61 1q8a s PHE 315 Cb -0.03 -3.84 -0.01 0.00 -0.34 0.00 0.00 43.02 38.80 1q8a s PHE 315 CO 0.00 -3.18 0.12 0.08 -1.46 0.00 0.00 175.22 170.78 1q8a s VAL 316 N 1.80 4.39 -0.27 3.12 1.01 -0.41 -4.97 120.40 125.07 1q8a s VAL 316 Ca 0.69 -0.43 -0.25 0.00 0.00 0.00 0.00 61.98 61.99 1q8a s VAL 316 Cb -0.39 -3.21 0.00 0.00 0.00 0.00 0.00 36.38 32.79 1q8a s VAL 316 CO 0.31 0.13 0.87 -0.69 0.00 0.00 0.00 175.10 175.71 1q8a s VAL 317 N 1.59 4.76 -0.32 2.92 1.01 -1.26 -2.16 120.40 126.94 1q8a s VAL 317 Ca 0.05 1.50 -0.06 0.00 0.00 0.00 0.00 61.98 63.46 1q8a s VAL 317 Cb -0.17 -4.18 0.03 0.00 0.00 0.00 0.00 36.38 32.06 1q8a s VAL 317 CO 0.05 -0.20 0.09 -0.63 0.00 0.00 0.00 175.10 174.41 1q8a s ILE 318 N 3.02 3.78 0.09 2.22 1.01 -0.30 -1.00 121.20 130.03 1q8a s ILE 318 Ca 0.36 -1.02 -0.31 0.00 0.00 0.00 0.00 60.65 59.69 1q8a s ILE 318 Cb -0.14 -3.08 -0.09 0.00 0.01 0.00 0.00 42.46 39.16 1q8a s ILE 318 CO 0.10 -0.09 1.63 -0.83 0.00 0.00 0.00 174.94 175.75 1q8a s GLY 319 N 1.42 1.56 0.03 6.18 0.00 -0.16 -3.96 107.32 112.39 1q8a s GLY 319 Ca -0.01 1.25 0.24 0.00 0.00 0.00 0.00 44.72 46.20 1q8a s GLY 319 CO 0.02 2.82 1.32 -1.84 0.00 0.00 0.00 173.10 175.43 1q8a n GLU 320 N 5.20 0.09 0.02 2.90 0.28 -1.26 -0.83 120.64 127.03 1q8a n GLU 320 Ca 0.15 0.01 0.09 0.00 -0.16 0.00 0.00 57.16 57.26 1q8a n GLU 320 Cb 0.40 -1.54 0.52 0.00 1.43 0.00 0.00 31.44 32.24 1q8a n GLU 320 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1q8a h ARG 321 N 0.00 0.34 -5.43 3.44 3.08 -1.91 -3.35 114.38 110.55 1q8a h ARG 321 Ca 0.00 -0.02 -0.64 0.00 0.07 0.00 0.00 59.98 59.39 1q8a h ARG 321 Cb 0.57 -0.08 -0.06 0.00 0.08 0.00 0.00 29.97 30.48 1q8a h ARG 321 CO 0.00 0.23 2.23 -0.89 -1.07 0.00 0.00 179.97 180.47 1q8a n ILE 322 N -4.48 3.52 -3.65 2.04 5.41 -1.26 -4.71 119.36 116.24 1q8a n ILE 322 Ca 0.05 -3.55 -0.06 0.00 1.00 0.00 0.00 62.75 60.20 1q8a n ILE 322 Cb 0.23 -2.37 -0.08 0.00 -0.71 0.00 0.00 39.64 36.71 1q8a n ILE 322 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 176.55 176.76 1q8a s ASN 323 N 4.37 -0.55 0.28 4.38 3.84 -1.26 -0.90 114.94 125.09 1q8a s ASN 323 Ca 0.55 1.18 0.25 0.00 0.21 0.00 0.00 52.86 55.04 1q8a s ASN 323 Cb 0.06 1.67 1.00 0.00 -0.55 0.00 0.00 41.25 43.43 1q8a s ASN 323 CO 0.06 -0.23 1.74 1.55 -2.79 0.00 0.00 177.10 177.43 1q8a h PRO 324 N 8.11 0.00 -6.21 0.43 0.13 -1.84 -3.44 132.00 129.18 1q8a h PRO 324 Ca -0.17 0.00 -0.71 0.00 -0.87 0.00 0.00 66.00 64.26 1q8a h PRO 324 Cb 1.11 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.27 1q8a h PRO 324 CO 0.12 0.00 0.71 0.00 -0.23 0.00 0.00 178.00 178.59 1q8a n ALA 325 N -1.81 -0.49 -0.94 -0.56 0.00 -1.26 0.45 120.51 115.90 1q8a n ALA 325 Ca 0.02 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.91 1q8a n ALA 325 Cb 0.25 -2.17 0.00 0.00 0.00 0.00 0.00 19.45 17.54 1q8a n ALA 325 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1q8a n GLY 326 N 3.44 0.11 2.77 0.00 0.00 -1.26 -4.89 105.19 105.36 1q8a n GLY 326 Ca 0.23 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.97 1q8a n GLY 326 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1q8a n ARG 327 N -0.08 2.03 -0.26 1.61 1.74 0.17 -4.96 116.66 116.91 1q8a n ARG 327 Ca 0.00 -4.55 0.20 0.00 -0.77 0.00 0.00 57.85 52.74 1q8a n ARG 327 Cb 0.35 -2.28 0.52 0.00 -1.02 0.00 0.00 32.46 30.02 1q8a n ARG 327 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 1q8a h LYS 328 N 5.06 0.38 0.39 5.56 1.79 -1.91 0.13 116.57 127.97 1q8a h LYS 328 Ca 0.16 -0.02 -0.02 0.00 -2.18 0.00 0.00 60.65 58.59 1q8a h LYS 328 Cb 0.73 -0.09 0.00 0.00 -1.58 0.00 0.00 32.23 31.29 1q8a h LYS 328 CO 0.75 0.25 -0.19 -0.22 -1.08 0.00 0.00 179.45 178.97 1q8a h LYS 329 N 0.39 -0.51 -0.88 3.15 1.63 -1.93 -2.26 116.57 116.17 1q8a h LYS 329 Ca 0.49 0.03 0.22 0.00 -0.85 0.00 0.00 60.65 60.55 1q8a h LYS 329 Cb 1.26 0.12 -0.13 0.00 -0.60 0.00 0.00 32.23 32.88 1q8a h LYS 329 CO -0.19 -0.34 0.35 1.25 -3.45 0.00 0.00 179.45 177.07 1q8a h LEU 330 N -0.65 0.25 -0.65 5.20 5.85 -1.78 0.29 115.31 123.82 1q8a h LEU 330 Ca -0.05 0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.83 1q8a h LEU 330 Cb 0.40 0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.56 1q8a h LEU 330 CO 0.09 -0.03 0.43 -0.25 -0.34 0.00 0.00 178.44 178.33 1q8a h TRP 331 N 0.36 0.83 0.18 1.25 -0.00 -1.00 -3.00 115.95 114.56 1q8a h TRP 331 Ca 0.55 0.02 -0.01 0.00 -0.00 0.00 0.00 58.89 59.44 1q8a h TRP 331 Cb 1.04 -0.28 0.00 0.00 -0.00 0.00 0.00 29.16 29.92 1q8a h TRP 331 CO -0.17 0.53 -0.09 0.00 -0.00 0.00 0.00 178.44 178.71 1q8a h ALA 332 N 1.23 -0.24 0.00 2.65 0.00 0.11 -2.80 119.26 120.22 1q8a h ALA 332 Ca 0.24 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1q8a h ALA 332 Cb -0.09 0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1q8a h ALA 332 CO -0.05 -0.53 0.00 0.39 0.00 0.00 0.00 179.25 179.06 1q8a n GLU 333 N -5.10 0.01 0.00 0.00 -0.58 -0.07 -2.54 120.64 112.36 1q8a n GLU 333 Ca -0.09 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.65 1q8a n GLU 333 Cb 0.19 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.57 1q8a n GLU 333 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 1q8a n GLN 335 N 1.15 0.00 0.00 3.49 6.02 -1.06 -0.75 117.38 126.23 1q8a n GLN 335 Ca 0.00 0.00 0.12 0.00 -0.01 0.00 0.00 57.00 57.11 1q8a n GLN 335 Cb 0.01 0.00 0.18 0.00 1.02 0.00 0.00 30.24 31.45 1q8a n GLN 335 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 177.06 176.41 1q8a n LYS 336 N 0.00 0.00 -0.92 -1.09 2.85 -1.05 -4.83 118.16 113.11 1q8a n LYS 336 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1q8a n LYS 336 Cb 0.00 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 32.88 1q8a n LYS 336 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1q8a n GLY 337 N 1.50 1.21 3.64 2.58 0.00 -1.04 -5.06 105.19 108.01 1q8a n GLY 337 Ca 0.05 -0.36 -0.43 0.00 0.00 0.00 0.00 46.02 45.29 1q8a n GLY 337 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1q8a s ASN 338 N -2.43 6.90 -0.15 1.61 3.84 0.07 -4.92 114.94 119.87 1q8a s ASN 338 Ca 0.00 1.02 -0.08 0.00 0.21 0.00 0.00 52.86 54.01 1q8a s ASN 338 Cb 0.00 -2.52 -0.24 0.00 -0.55 0.00 0.00 41.25 37.94 1q8a s ASN 338 CO 0.00 -0.81 0.25 -0.62 -2.79 0.00 0.00 177.10 173.13 1q8a n GLU 339 N 6.69 0.72 -0.12 0.43 1.02 -1.26 -4.28 120.64 123.84 1q8a n GLU 339 Ca 0.11 0.29 0.10 0.00 -0.02 0.00 0.00 57.16 57.64 1q8a n GLU 339 Cb 0.47 -1.69 0.45 0.00 -0.02 0.00 0.00 31.44 30.66 1q8a n GLU 339 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 1q8a h GLU 340 N -0.12 0.50 -0.29 3.49 4.57 -1.99 0.14 114.58 120.88 1q8a h GLU 340 Ca -0.44 -0.03 -0.08 0.00 -1.18 0.00 0.00 59.36 57.63 1q8a h GLU 340 Cb 1.90 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 30.37 1q8a h GLU 340 CO 0.01 0.33 -0.13 0.97 -1.18 0.00 0.00 179.01 179.01 1q8a h ILE 341 N 0.52 1.29 -0.52 2.32 2.10 -1.99 -1.85 117.51 119.38 1q8a h ILE 341 Ca 0.29 -1.22 -0.09 0.00 1.08 0.00 0.00 64.86 64.93 1q8a h ILE 341 Cb 0.47 1.46 -0.02 0.00 -1.09 0.00 0.00 36.82 37.64 1q8a h ILE 341 CO -0.09 0.39 -0.02 0.58 -1.08 0.00 0.00 178.15 177.93 1q8a h VAL 342 N 0.36 1.25 -0.79 2.19 2.07 -1.60 -2.75 116.25 116.98 1q8a h VAL 342 Ca 0.07 -1.09 -0.04 0.00 0.82 0.00 0.00 66.70 66.45 1q8a h VAL 342 Cb 0.64 0.88 -0.04 0.00 -1.52 0.00 0.00 31.29 31.26 1q8a h VAL 342 CO 0.04 0.39 0.32 0.40 0.02 0.00 0.00 177.57 178.74 1q8a h ILE 343 N 0.82 1.26 -0.39 4.57 2.04 -0.86 -2.28 117.51 122.66 1q8a h ILE 343 Ca 0.15 -0.81 -0.01 0.00 1.00 0.00 0.00 64.86 65.20 1q8a h ILE 343 Cb 0.51 0.30 -0.02 0.00 -0.74 0.00 0.00 36.82 36.88 1q8a h ILE 343 CO 0.03 0.33 0.22 0.50 0.00 0.00 0.00 178.15 179.23 1q8a h LYS 344 N 1.15 0.54 -0.92 2.37 3.64 -1.17 -1.93 116.57 120.25 1q8a h LYS 344 Ca 0.27 -0.06 0.01 0.00 -1.27 0.00 0.00 60.65 59.60 1q8a h LYS 344 Cb 0.20 -0.11 -0.05 0.00 -0.41 0.00 0.00 32.23 31.87 1q8a h LYS 344 CO -0.02 0.42 0.61 1.49 -2.27 0.00 0.00 179.45 179.68 1q8a h GLU 345 N 0.50 1.19 0.28 1.90 4.57 -1.23 -2.01 114.58 119.79 1q8a h GLU 345 Ca 0.14 -0.07 -0.01 0.00 -1.18 0.00 0.00 59.36 58.23 1q8a h GLU 345 Cb 0.04 -0.27 0.00 0.00 -0.16 0.00 0.00 28.75 28.36 1q8a h GLU 345 CO -0.02 0.79 -0.13 0.00 -1.18 0.00 0.00 179.01 178.46 1q8a h ALA 346 N 1.43 -0.38 -0.91 2.92 0.00 -1.17 -2.45 119.26 118.71 1q8a h ALA 346 Ca 0.34 -0.17 0.03 0.00 0.00 0.00 0.00 54.91 55.11 1q8a h ALA 346 Cb -0.12 0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.77 1q8a h ALA 346 CO -0.08 -0.57 0.60 0.87 0.00 0.00 0.00 179.25 180.07 1q8a h LYS 347 N -0.67 1.15 -0.53 0.00 1.57 -1.23 -1.68 116.57 115.18 1q8a h LYS 347 Ca -0.04 -0.07 -0.07 0.00 -1.87 0.00 0.00 60.65 58.60 1q8a h LYS 347 Cb 0.47 -0.26 -0.02 0.00 0.08 0.00 0.00 32.23 32.50 1q8a h LYS 347 CO 0.06 0.76 0.07 1.15 -0.57 0.00 0.00 179.45 180.92 1q8a h THR 348 N 1.18 1.26 -0.54 -0.16 2.02 -1.37 -0.26 112.91 115.04 1q8a h THR 348 Ca 0.35 -0.99 -0.00 0.00 0.77 0.00 0.00 66.41 66.54 1q8a h THR 348 Cb -0.05 0.86 -0.03 0.00 -1.74 0.00 0.00 68.15 67.19 1q8a h THR 348 CO -0.10 0.35 0.32 1.56 0.37 0.00 0.00 175.52 178.03 1q8a h GLN 349 N 0.78 0.74 -0.72 6.66 4.20 -1.05 -1.70 115.11 124.02 1q8a h GLN 349 Ca 0.16 -0.07 -0.07 0.00 0.06 0.00 0.00 58.65 58.73 1q8a h GLN 349 Cb 0.43 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 28.03 1q8a h GLN 349 CO 0.01 0.54 0.18 0.28 -0.67 0.00 0.00 178.83 179.17 1q8a h VAL 350 N 0.73 1.26 -0.80 -0.54 2.07 -1.14 -1.15 116.25 116.68 1q8a h VAL 350 Ca 0.19 -0.97 0.10 0.00 0.82 0.00 0.00 66.70 66.84 1q8a h VAL 350 Cb -0.01 0.52 -0.05 0.00 -1.52 0.00 0.00 31.29 30.22 1q8a h VAL 350 CO -0.04 0.37 0.52 -0.08 0.02 0.00 0.00 177.57 178.37 1q8a h GLU 351 N 1.08 0.71 -0.01 1.57 4.81 -0.41 -1.44 114.58 120.90 1q8a h GLU 351 Ca 0.23 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.41 1q8a h GLU 351 Cb 0.37 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.59 1q8a h GLU 351 CO 0.00 0.47 -0.04 1.63 -0.73 0.00 0.00 179.01 180.34 1q8a n LYS 352 N -4.51 1.17 0.00 1.92 4.01 -0.70 -4.90 118.16 115.15 1q8a n LYS 352 Ca 0.13 -0.45 0.00 0.00 -0.51 0.00 0.00 58.31 57.49 1q8a n LYS 352 Cb 0.33 -1.49 0.00 0.00 -0.51 0.00 0.00 35.03 33.36 1q8a n LYS 352 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1q8a n GLY 353 N 1.15 1.02 3.73 0.72 0.00 -0.54 -4.97 105.19 106.30 1q8a n GLY 353 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 1q8a n GLY 353 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q8a s ALA 354 N -1.97 3.60 -0.04 4.61 0.00 -0.50 -4.71 121.76 122.76 1q8a s ALA 354 Ca 0.00 1.20 0.22 0.00 0.00 0.00 0.00 51.96 53.38 1q8a s ALA 354 Cb 0.00 -3.53 -0.33 0.00 0.00 0.00 0.00 23.12 19.26 1q8a s ALA 354 CO 0.00 -0.64 0.46 0.39 0.00 0.00 0.00 175.76 175.97 1q8a n GLU 355 N 3.05 0.65 -3.94 0.00 1.02 -0.17 -4.42 120.64 116.84 1q8a n GLU 355 Ca 0.09 -0.19 -0.10 0.00 -0.02 0.00 0.00 57.16 56.94 1q8a n GLU 355 Cb 0.41 -1.51 -0.12 0.00 -0.02 0.00 0.00 31.44 30.20 1q8a n GLU 355 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1q8a s VAL 356 N -3.46 0.08 -0.13 2.62 1.01 -1.10 -4.13 120.40 115.29 1q8a s VAL 356 Ca -0.08 -0.63 0.02 0.00 0.00 0.00 0.00 61.98 61.29 1q8a s VAL 356 Cb 0.13 -0.19 0.00 0.00 0.00 0.00 0.00 36.38 36.32 1q8a s VAL 356 CO 0.89 -0.34 -0.20 -0.76 0.00 0.00 0.00 175.10 174.69 1q8a s LEU 357 N -1.01 2.26 0.23 3.92 1.43 -0.39 -0.99 118.68 124.14 1q8a s LEU 357 Ca -0.11 -0.53 -0.30 0.00 -1.03 0.00 0.00 54.13 52.16 1q8a s LEU 357 Cb -0.07 -1.48 -0.09 0.00 0.03 0.00 0.00 46.19 44.58 1q8a s LEU 357 CO -0.01 0.11 1.03 -0.62 0.23 0.00 0.00 176.35 177.09 1q8a s ASP 358 N 0.64 7.44 -0.09 2.29 2.15 -0.01 -0.29 116.67 128.79 1q8a s ASP 358 Ca -0.10 2.08 -0.01 0.00 0.43 0.00 0.00 52.55 54.94 1q8a s ASP 358 Cb -0.16 -2.61 0.03 0.00 -0.30 0.00 0.00 42.92 39.87 1q8a s ASP 358 CO 0.02 -0.03 -0.02 -0.69 -0.17 0.00 0.00 175.17 174.28 1q8a s VAL 359 N -0.93 0.62 0.05 1.11 1.01 -0.00 -4.04 120.40 118.21 1q8a s VAL 359 Ca 0.44 -0.06 0.05 0.00 0.00 0.00 0.00 61.98 62.42 1q8a s VAL 359 Cb -0.28 -0.74 -0.02 0.00 0.00 0.00 0.00 36.38 35.33 1q8a s VAL 359 CO 0.36 0.28 -0.15 0.21 0.00 0.00 0.00 175.10 175.79 1q8a s ASN 360 N 1.87 1.81 -0.29 3.32 3.84 -0.08 -1.02 114.94 124.39 1q8a s ASN 360 Ca 0.05 -0.52 0.08 0.00 0.21 0.00 0.00 52.86 52.68 1q8a s ASN 360 Cb -0.13 -0.10 0.46 0.00 -0.55 0.00 0.00 41.25 40.93 1q8a s ASN 360 CO -0.06 0.02 1.34 0.49 -2.79 0.00 0.00 177.10 176.10 1q8a n PHE 361 N 1.69 1.49 0.00 0.43 3.01 -1.26 -4.37 117.46 118.45 1q8a n PHE 361 Ca -0.19 -1.89 0.00 0.00 1.01 0.00 0.00 57.45 56.38 1q8a n PHE 361 Cb 0.54 -0.44 0.00 0.00 -0.01 0.00 0.00 39.48 39.57 1q8a n PHE 361 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1q8a n GLY 362 N -0.97 3.06 3.56 1.37 0.00 -1.26 -3.80 105.19 107.15 1q8a n GLY 362 Ca 0.35 -0.03 -0.37 0.00 0.00 0.00 0.00 46.02 45.96 1q8a n GLY 362 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1q8a s ILE 363 N 0.00 3.78 0.50 -0.61 1.09 -1.26 -4.87 121.20 119.82 1q8a s ILE 363 Ca 0.00 -0.58 0.31 0.00 -1.10 0.00 0.00 60.65 59.28 1q8a s ILE 363 Cb 0.00 -4.76 0.50 0.00 -1.06 0.00 0.00 42.46 37.14 1q8a s ILE 363 CO 0.00 -1.67 1.79 -0.33 -0.10 0.00 0.00 174.94 174.63 1q8a h GLU 364 N 10.29 0.11 0.00 2.79 5.08 -1.96 0.35 114.58 131.25 1q8a h GLU 364 Ca 0.14 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 1q8a h GLU 364 Cb 1.01 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.24 1q8a h GLU 364 CO 1.36 0.08 0.00 0.66 -1.00 0.00 0.00 179.01 180.11 1q8a h SER 365 N 0.12 0.00 0.33 1.42 4.64 -1.92 -2.31 113.55 115.84 1q8a h SER 365 Ca 0.58 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.90 1q8a h SER 365 Cb 2.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.15 1q8a h SER 365 CO -0.11 0.00 -0.17 1.67 -0.87 0.00 0.00 176.83 177.36 1q8a n GLN 366 N -2.92 0.71 -4.61 4.77 -0.06 0.12 -4.89 117.38 110.50 1q8a n GLN 366 Ca -0.00 -0.31 -0.31 0.00 -2.00 0.00 0.00 57.00 54.38 1q8a n GLN 366 Cb 0.23 -1.49 -0.12 0.00 -4.06 0.00 0.00 30.24 24.80 1q8a n GLN 366 CO 0.00 0.00 0.00 0.42 -0.20 0.00 0.00 177.06 177.28 1q8a s ILE 367 N -2.51 2.84 -0.38 1.69 1.09 -0.87 -4.79 121.20 118.27 1q8a s ILE 367 Ca 0.27 -1.20 -0.29 0.00 -1.10 0.00 0.00 60.65 58.33 1q8a s ILE 367 Cb 0.20 -2.21 0.01 0.00 -1.06 0.00 0.00 42.46 39.39 1q8a s ILE 367 CO 0.50 0.31 1.40 -0.62 -0.10 0.00 0.00 174.94 176.43 1q8a s ASP 368 N -1.51 6.39 0.35 3.58 3.68 -1.26 -4.90 116.67 123.00 1q8a s ASP 368 Ca 0.15 0.93 0.16 0.00 2.13 0.00 0.00 52.55 55.92 1q8a s ASP 368 Cb -0.11 -2.54 1.12 0.00 -1.45 0.00 0.00 42.92 39.94 1q8a s ASP 368 CO 0.06 -1.37 1.66 1.62 0.13 0.00 0.00 175.17 177.27 1q8a h VAL 369 N 6.36 0.28 -0.25 1.11 3.04 -1.98 1.45 116.25 126.27 1q8a h VAL 369 Ca -0.28 -0.10 -0.01 0.00 -1.01 0.00 0.00 66.70 65.31 1q8a h VAL 369 Cb 1.11 -0.05 -0.01 0.00 -2.01 0.00 0.00 31.29 30.33 1q8a h VAL 369 CO 1.07 0.06 0.13 0.03 -1.01 0.00 0.00 177.57 177.85 1q8a h ARG 370 N 0.30 0.34 -0.30 4.17 3.08 -1.99 -0.37 114.38 119.61 1q8a h ARG 370 Ca 0.74 -0.03 -0.17 0.00 0.07 0.00 0.00 59.98 60.60 1q8a h ARG 370 Cb 1.73 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 31.71 1q8a h ARG 370 CO -0.60 0.26 -0.48 -0.92 -1.07 0.00 0.00 179.97 177.16 1q8a h TYR 371 N 0.35 0.98 -0.50 3.04 5.03 0.16 -1.91 116.97 124.12 1q8a h TYR 371 Ca 0.09 -0.32 -0.04 0.00 2.58 0.00 0.00 58.73 61.04 1q8a h TYR 371 Cb 0.02 -0.20 -0.02 0.00 1.55 0.00 0.00 36.73 38.08 1q8a h TYR 371 CO 0.00 1.12 0.16 0.28 -1.32 0.00 0.00 178.16 178.40 1q8a h VAL 372 N 0.63 1.23 -0.54 1.81 2.07 -0.77 -2.07 116.25 118.61 1q8a h VAL 372 Ca 0.03 -0.75 -0.02 0.00 0.82 0.00 0.00 66.70 66.78 1q8a h VAL 372 Cb 1.06 0.77 -0.03 0.00 -1.52 0.00 0.00 31.29 31.57 1q8a h VAL 372 CO 0.10 0.27 0.24 -0.33 0.02 0.00 0.00 177.57 177.88 1q8a h GLU 373 N 0.67 0.76 0.10 1.57 5.08 -0.98 -1.84 114.58 119.95 1q8a h GLU 373 Ca 0.16 -0.10 -0.26 0.00 -1.00 0.00 0.00 59.36 58.16 1q8a h GLU 373 Cb 0.26 -0.14 0.01 0.00 0.50 0.00 0.00 28.75 29.37 1q8a h GLU 373 CO -0.01 0.60 -1.17 -0.22 -1.00 0.00 0.00 179.01 177.21 1q8a h LYS 374 N 0.76 0.33 -0.28 2.33 3.64 -1.17 -2.79 116.57 119.39 1q8a h LYS 374 Ca 0.19 -0.49 -0.11 0.00 -1.27 0.00 0.00 60.65 58.96 1q8a h LYS 374 Cb 0.10 0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 32.09 1q8a h LYS 374 CO -0.02 1.20 -0.26 0.82 -2.27 0.00 0.00 179.45 178.93 1q8a h ILE 375 N 0.12 1.30 -0.71 2.00 1.08 -1.24 -1.07 117.51 118.99 1q8a h ILE 375 Ca -0.13 -1.41 -0.03 0.00 -0.39 0.00 0.00 64.86 62.90 1q8a h ILE 375 Cb 1.87 1.58 -0.03 0.00 -3.07 0.00 0.00 36.82 37.17 1q8a h ILE 375 CO 0.20 0.45 0.34 0.58 -0.69 0.00 0.00 178.15 179.02 1q8a h VAL 376 N 0.41 1.23 -0.02 1.67 2.07 -1.41 -2.29 116.25 117.90 1q8a h VAL 376 Ca 0.05 -0.65 -0.18 0.00 0.82 0.00 0.00 66.70 66.75 1q8a h VAL 376 Cb 0.82 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 1q8a h VAL 376 CO 0.06 0.27 -0.78 -0.61 0.02 0.00 0.00 177.57 176.54 1q8a h GLN 377 N 1.01 0.18 0.07 1.57 4.15 -1.43 -3.39 115.11 117.27 1q8a h GLN 377 Ca 0.25 -0.17 -0.15 0.00 0.77 0.00 0.00 58.65 59.35 1q8a h GLN 377 Cb 0.11 0.04 0.02 0.00 0.21 0.00 0.00 27.48 27.86 1q8a h GLN 377 CO -0.03 0.87 -0.63 1.15 -1.93 0.00 0.00 178.83 178.25 1q8a h THR 378 N 0.11 1.51 -0.95 2.39 2.02 -0.66 -3.40 112.91 113.93 1q8a h THR 378 Ca -0.03 -2.32 0.07 0.00 0.77 0.00 0.00 66.41 64.90 1q8a h THR 378 Cb 1.36 2.99 -0.06 0.00 -1.74 0.00 0.00 68.15 70.69 1q8a h THR 378 CO 0.12 0.66 0.62 -0.07 0.37 0.00 0.00 175.52 177.21 1q8a h LEU 379 N -0.35 0.96 -2.06 2.58 3.38 -1.63 -1.84 115.31 116.36 1q8a h LEU 379 Ca -0.10 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 1q8a h LEU 379 Cb 1.43 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.98 1q8a h LEU 379 CO 0.12 0.61 -0.09 -0.65 0.09 0.00 0.00 178.44 178.52 1q8a h PRO 380 N 1.09 0.00 0.04 1.13 0.11 -1.76 0.75 132.00 133.35 1q8a h PRO 380 Ca 0.41 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 66.38 1q8a h PRO 380 Cb 0.20 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.31 1q8a h PRO 380 CO -0.16 0.09 -0.73 1.88 -0.21 0.00 0.00 178.00 178.87 1q8a h TYR 381 N 0.00 0.16 0.01 0.65 -1.99 -1.58 -2.81 116.97 111.41 1q8a h TYR 381 Ca -0.00 -0.12 -0.21 0.00 2.00 0.00 0.00 58.73 60.41 1q8a h TYR 381 Cb 0.24 -0.01 -0.01 0.00 2.00 0.00 0.00 36.73 38.95 1q8a h TYR 381 CO 0.00 1.28 -0.92 -0.39 -0.00 0.00 0.00 178.16 178.14 1q8a h VAL 382 N -0.78 1.50 0.00 -2.88 -1.51 -1.22 -3.24 116.25 108.12 1q8a h VAL 382 Ca -0.17 -2.67 0.00 0.00 -1.23 0.00 0.00 66.70 62.62 1q8a h VAL 382 Cb 1.32 2.51 0.00 0.00 -2.13 0.00 0.00 31.29 32.99 1q8a h VAL 382 CO -0.02 0.78 -1.02 -1.54 -1.23 0.00 0.00 177.57 174.53 1q8a n SER 383 N -3.64 0.63 0.00 4.19 3.41 0.24 -4.94 113.62 113.50 1q8a n SER 383 Ca -0.04 -0.32 0.00 0.00 -0.26 0.00 0.00 58.87 58.25 1q8a n SER 383 Cb 0.83 0.84 0.00 0.00 -0.26 0.00 0.00 64.21 65.62 1q8a n SER 383 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1q8a n ASN 384 N -1.87 0.00 -4.79 4.04 3.02 -1.06 -4.95 115.26 109.65 1q8a n ASN 384 Ca 0.02 0.00 -0.22 0.00 -0.03 0.00 0.00 54.58 54.35 1q8a n ASN 384 Cb 0.42 -0.04 -0.05 0.00 -0.61 0.00 0.00 39.78 39.50 1q8a n ASN 384 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 1q8a s VAL 385 N -1.85 3.61 0.81 2.41 -7.23 -1.25 -4.15 120.40 112.74 1q8a s VAL 385 Ca 0.00 -1.52 -0.11 0.00 -1.81 0.00 0.00 61.98 58.55 1q8a s VAL 385 Cb 0.00 -3.15 0.08 0.00 0.56 0.00 0.00 36.38 33.87 1q8a s VAL 385 CO 0.00 -0.24 1.09 -2.84 -0.31 0.00 0.00 175.10 172.80 1q8a s PRO 386 N -3.89 1.98 0.16 4.82 0.02 -1.26 -4.27 135.00 132.57 1q8a s PRO 386 Ca 0.37 1.06 0.08 0.00 0.02 0.00 0.00 61.00 62.53 1q8a s PRO 386 Cb -0.06 -1.87 -0.04 0.00 0.02 0.00 0.00 34.50 32.55 1q8a s PRO 386 CO 0.24 -1.80 -0.08 -0.51 -0.33 0.00 0.00 177.00 174.52 1q8a s LEU 387 N -6.00 3.04 -0.36 -5.54 1.43 -1.26 -1.26 118.68 108.73 1q8a s LEU 387 Ca 0.62 -0.51 -0.09 0.00 -1.03 0.00 0.00 54.13 53.12 1q8a s LEU 387 Cb -0.17 -1.74 0.03 0.00 0.03 0.00 0.00 46.19 44.34 1q8a s LEU 387 CO 0.56 0.12 0.17 -0.55 0.23 0.00 0.00 176.35 176.88 1q8a s SER 388 N -2.70 5.57 -0.54 2.29 0.15 0.60 -2.33 113.70 116.74 1q8a s SER 388 Ca 0.24 -1.04 -0.27 0.00 0.70 0.00 0.00 55.95 55.58 1q8a s SER 388 Cb -0.09 -1.96 0.03 0.00 -1.71 0.00 0.00 66.02 62.29 1q8a s SER 388 CO 0.15 -0.36 1.08 -0.76 1.20 0.00 0.00 173.24 174.55 1q8a s LEU 389 N 1.50 3.74 -0.96 3.45 1.43 0.74 -0.82 118.68 127.76 1q8a s LEU 389 Ca 0.01 0.04 -0.12 0.00 -1.03 0.00 0.00 54.13 53.02 1q8a s LEU 389 Cb -0.19 -3.14 0.24 0.00 0.03 0.00 0.00 46.19 43.14 1q8a s LEU 389 CO 0.05 -1.31 0.93 -0.62 0.23 0.00 0.00 176.35 175.63 1q8a s ASP 390 N 2.75 7.01 -0.02 2.29 -1.08 -0.19 0.61 116.67 128.05 1q8a s ASP 390 Ca 0.39 -3.09 0.03 0.00 -0.52 0.00 0.00 52.55 49.37 1q8a s ASP 390 Cb -0.09 -2.21 -0.00 0.00 -1.46 0.00 0.00 42.92 39.15 1q8a s ASP 390 CO 0.25 -0.46 -0.11 -0.63 0.52 0.00 0.00 175.17 174.74 1q8a s ILE 391 N -0.41 0.92 -0.23 4.11 1.01 -1.26 -4.15 121.20 121.19 1q8a s ILE 391 Ca 0.24 -0.47 -0.19 0.00 0.00 0.00 0.00 60.65 60.22 1q8a s ILE 391 Cb -0.10 -0.79 -0.17 0.00 0.01 0.00 0.00 42.46 41.42 1q8a s ILE 391 CO -0.08 0.27 0.04 1.67 0.00 0.00 0.00 174.94 176.84 1q8a n GLN 392 N 2.98 0.57 -2.10 2.79 7.27 -1.26 -4.92 117.38 122.71 1q8a n GLN 392 Ca -0.16 0.48 -0.42 0.00 0.07 0.00 0.00 57.00 56.98 1q8a n GLN 392 Cb 0.55 -1.67 -0.03 0.00 2.41 0.00 0.00 30.24 31.50 1q8a n GLN 392 CO 0.00 0.00 0.00 1.21 0.07 0.00 0.00 177.06 178.34 1q8a s ASN 393 N -7.05 6.75 0.23 1.69 3.84 -1.26 -4.93 114.94 114.21 1q8a s ASN 393 Ca -0.32 2.36 -0.07 0.00 0.21 0.00 0.00 52.86 55.04 1q8a s ASN 393 Cb 0.09 -2.58 0.26 0.00 -0.55 0.00 0.00 41.25 38.47 1q8a s ASN 393 CO 0.56 -0.74 1.87 1.62 -2.79 0.00 0.00 177.10 177.62 1q8a h VAL 394 N 4.47 1.12 -0.39 -5.21 3.04 -1.99 -0.62 116.25 116.66 1q8a h VAL 394 Ca -0.41 -0.35 -0.01 0.00 -1.01 0.00 0.00 66.70 64.91 1q8a h VAL 394 Cb 1.20 -0.01 -0.02 0.00 -2.01 0.00 0.00 31.29 30.46 1q8a h VAL 394 CO 0.89 0.19 0.22 -0.78 -1.01 0.00 0.00 177.57 177.08 1q8a h ASP 395 N 1.03 0.49 0.23 3.17 3.58 -2.00 -0.68 116.42 122.25 1q8a h ASP 395 Ca 0.34 -0.09 -0.09 0.00 0.42 0.00 0.00 57.03 57.61 1q8a h ASP 395 Cb 0.03 -0.12 -0.01 0.00 1.72 0.00 0.00 39.33 40.95 1q8a h ASP 395 CO -0.12 0.43 -0.35 0.25 -2.88 0.00 0.00 179.24 176.57 1q8a h LEU 396 N 0.51 0.19 -0.03 2.28 5.85 -1.88 -2.35 115.31 119.88 1q8a h LEU 396 Ca 0.14 -0.07 -0.00 0.00 0.84 0.00 0.00 57.88 58.79 1q8a h LEU 396 Cb 0.05 -0.05 -0.00 0.00 0.37 0.00 0.00 40.66 41.03 1q8a h LEU 396 CO -0.02 0.53 0.00 0.74 -0.34 0.00 0.00 178.44 179.35 1q8a h THR 397 N 0.16 1.24 -0.84 1.05 2.02 -0.74 -1.44 112.91 114.36 1q8a h THR 397 Ca 0.02 -0.72 0.11 0.00 0.77 0.00 0.00 66.41 66.59 1q8a h THR 397 Cb 0.70 1.67 -0.08 0.00 -1.74 0.00 0.00 68.15 68.70 1q8a h THR 397 CO 0.05 0.19 0.48 -0.08 0.37 0.00 0.00 175.52 176.53 1q8a h GLU 398 N -0.24 0.75 -0.57 6.66 4.81 -0.85 0.75 114.58 125.87 1q8a h GLU 398 Ca 0.01 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 59.14 1q8a h GLU 398 Cb 0.31 -0.17 -0.03 0.00 0.63 0.00 0.00 28.75 29.49 1q8a h GLU 398 CO 0.00 0.49 0.14 0.00 -0.73 0.00 0.00 179.01 178.92 1q8a h ARG 399 N 0.77 0.88 -0.15 1.92 3.08 -1.16 -1.17 114.38 118.56 1q8a h ARG 399 Ca 0.42 -0.18 -0.09 0.00 0.07 0.00 0.00 59.98 60.19 1q8a h ARG 399 Cb 0.44 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.35 1q8a h ARG 399 CO -0.27 0.79 -0.27 0.00 -1.07 0.00 0.00 179.97 179.14 1q8a h ALA 400 N 1.31 0.24 -0.56 0.04 0.00 -0.14 -3.13 119.26 117.02 1q8a h ALA 400 Ca 0.19 -0.40 -0.04 0.00 0.00 0.00 0.00 54.91 54.66 1q8a h ALA 400 Cb 0.30 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1q8a h ALA 400 CO -0.00 0.24 0.19 -0.07 0.00 0.00 0.00 179.25 179.61 1q8a h LEU 401 N 0.08 0.80 -1.55 0.00 3.38 -0.77 -2.12 115.31 115.12 1q8a h LEU 401 Ca 0.01 -0.19 -0.00 0.00 0.09 0.00 0.00 57.88 57.78 1q8a h LEU 401 Cb 0.86 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.38 1q8a h LEU 401 CO 0.06 0.78 0.22 0.08 0.09 0.00 0.00 178.44 179.67 1q8a h ARG 402 N 0.78 0.52 -0.62 1.13 0.11 -1.26 -2.80 114.38 112.24 1q8a h ARG 402 Ca 0.18 -0.04 0.00 0.00 0.10 0.00 0.00 59.98 60.22 1q8a h ARG 402 Cb 0.25 -0.11 0.00 0.00 1.11 0.00 0.00 29.97 31.22 1q8a h ARG 402 CO -0.01 0.38 0.00 0.00 0.10 0.00 0.00 179.97 180.44 1q8a n ALA 403 N -2.48 2.40 -2.70 0.08 0.00 -1.10 -4.91 120.51 111.80 1q8a n ALA 403 Ca 0.03 -1.16 -0.42 0.00 0.00 0.00 0.00 53.44 51.89 1q8a n ALA 403 Cb 0.09 -0.93 -0.03 0.00 0.00 0.00 0.00 19.45 18.57 1q8a n ALA 403 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1q8a s TYR 404 N -1.18 3.57 -1.39 0.00 6.14 -0.82 -4.29 117.35 119.38 1q8a s TYR 404 Ca 0.45 1.54 -0.16 0.00 0.64 0.00 0.00 57.07 59.54 1q8a s TYR 404 Cb 0.24 -3.07 0.05 0.00 0.42 0.00 0.00 41.96 39.60 1q8a s TYR 404 CO 0.32 -0.08 2.03 -0.35 0.64 0.00 0.00 175.55 178.10 1q8a n PRO 405 N 4.36 3.00 -0.32 4.97 -0.04 -1.26 -4.81 135.00 140.89 1q8a n PRO 405 Ca 0.05 -2.89 0.00 0.00 -0.04 0.00 0.00 63.50 60.63 1q8a n PRO 405 Cb 0.50 -3.37 0.00 0.00 -0.04 0.00 0.00 33.50 30.59 1q8a n PRO 405 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1q8a n GLY 406 N 4.62 0.66 3.28 0.55 0.00 -1.26 -3.32 105.19 109.73 1q8a n GLY 406 Ca 0.51 -1.63 -0.38 0.00 0.00 0.00 0.00 46.02 44.51 1q8a n GLY 406 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1q8a s ARG 407 N -2.00 2.62 0.72 1.61 3.52 -1.12 -4.88 118.95 119.41 1q8a s ARG 407 Ca 0.00 -1.22 -0.05 0.00 -0.13 0.00 0.00 55.73 54.33 1q8a s ARG 407 Cb 0.00 -3.52 0.10 0.00 -1.56 0.00 0.00 34.95 29.96 1q8a s ARG 407 CO 0.00 -0.71 1.01 -1.54 -0.81 0.00 0.00 175.30 173.25 1q8a s SER 408 N 1.51 4.51 -0.16 -2.12 1.04 -1.26 -0.54 113.70 116.67 1q8a s SER 408 Ca -0.01 0.11 -0.03 0.00 0.48 0.00 0.00 55.95 56.51 1q8a s SER 408 Cb -0.20 -0.63 -0.02 0.00 0.10 0.00 0.00 66.02 65.27 1q8a s SER 408 CO 0.03 -1.76 -0.07 -0.22 0.98 0.00 0.00 173.24 172.20 1q8a s LEU 409 N -5.23 2.99 -0.26 2.42 2.96 -0.99 -0.27 118.68 120.31 1q8a s LEU 409 Ca 0.63 -0.26 -0.10 0.00 -0.22 0.00 0.00 54.13 54.18 1q8a s LEU 409 Cb -0.08 -1.72 -0.05 0.00 0.50 0.00 0.00 46.19 44.84 1q8a s LEU 409 CO 0.45 0.12 0.16 0.12 -1.32 0.00 0.00 176.35 175.88 1q8a s PHE 410 N 0.65 3.25 -0.74 5.38 5.36 0.11 -0.18 117.98 131.80 1q8a s PHE 410 Ca -0.04 0.11 -0.23 0.00 -0.96 0.00 0.00 56.93 55.82 1q8a s PHE 410 Cb -0.15 -2.31 0.07 0.00 -0.34 0.00 0.00 43.02 40.29 1q8a s PHE 410 CO 0.02 -0.08 1.07 1.21 -1.46 0.00 0.00 175.22 175.99 1q8a s ASN 411 N 1.42 6.27 0.24 6.13 3.84 0.20 -1.44 114.94 131.61 1q8a s ASN 411 Ca 0.07 -1.13 0.00 0.00 0.21 0.00 0.00 52.86 52.01 1q8a s ASN 411 Cb -0.15 -2.45 0.00 0.00 -0.55 0.00 0.00 41.25 38.11 1q8a s ASN 411 CO 0.07 -1.44 0.00 -1.54 -2.79 0.00 0.00 177.10 171.40 1q8a n SER 412 N 7.84 -3.56 -4.10 -4.21 3.41 -1.21 -4.08 113.62 107.71 1q8a n SER 412 Ca 0.05 0.75 -0.24 0.00 -0.26 0.00 0.00 58.87 59.17 1q8a n SER 412 Cb 0.47 -3.03 -0.16 0.00 -0.26 0.00 0.00 64.21 61.23 1q8a n SER 412 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1q8a s ALA 413 N -4.42 1.34 0.75 7.33 0.00 -0.53 -4.98 121.76 121.25 1q8a s ALA 413 Ca 0.00 -0.60 -0.08 0.00 0.00 0.00 0.00 51.96 51.28 1q8a s ALA 413 Cb 0.00 -0.44 0.09 0.00 0.00 0.00 0.00 23.12 22.77 1q8a s ALA 413 CO 0.00 0.25 1.07 0.15 0.00 0.00 0.00 175.76 177.23 1q8a s LYS 414 N 0.03 1.91 -1.23 0.00 1.02 -1.26 -0.81 119.74 119.40 1q8a s LYS 414 Ca -0.02 -0.33 -0.18 0.00 0.02 0.00 0.00 55.97 55.46 1q8a s LYS 414 Cb -0.10 -2.12 0.09 0.00 -0.52 0.00 0.00 37.83 35.18 1q8a s LYS 414 CO 0.01 -1.45 1.60 0.08 -0.92 0.00 0.00 175.35 174.67 1q8a s VAL 415 N -3.35 4.34 -0.14 3.17 1.01 -1.18 -4.50 120.40 119.76 1q8a s VAL 415 Ca 0.63 -1.94 -0.04 0.00 0.00 0.00 0.00 61.98 60.63 1q8a s VAL 415 Cb -0.09 -5.09 0.06 0.00 0.00 0.00 0.00 36.38 31.25 1q8a s VAL 415 CO 0.46 -1.90 0.15 -0.62 0.00 0.00 0.00 175.10 173.19 1q8a s ASP 416 N 3.96 1.42 0.11 3.32 -1.08 -1.26 -4.59 116.67 118.55 1q8a s ASP 416 Ca 0.49 -0.12 -0.20 0.00 -0.52 0.00 0.00 52.55 52.20 1q8a s ASP 416 Cb 0.01 0.12 -0.04 0.00 -1.46 0.00 0.00 42.92 41.55 1q8a s ASP 416 CO 0.03 -0.30 1.01 -0.62 0.52 0.00 0.00 175.17 175.82 1q8a n GLU 417 N 5.31 -0.29 0.01 4.34 -0.58 -1.26 -0.75 120.64 127.42 1q8a n GLU 417 Ca -0.05 0.99 -0.11 0.00 -0.42 0.00 0.00 57.16 57.57 1q8a n GLU 417 Cb 0.50 -1.46 -0.06 0.00 -0.57 0.00 0.00 31.44 29.84 1q8a n GLU 417 CO 0.00 0.00 0.00 1.49 -0.48 0.00 0.00 177.13 178.14 1q8a h GLU 418 N 0.00 0.09 -0.40 3.49 4.81 -1.97 -1.31 114.58 119.29 1q8a h GLU 418 Ca 0.11 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.33 1q8a h GLU 418 Cb 0.27 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.62 1q8a h GLU 418 CO -0.62 0.10 0.26 1.49 -0.73 0.00 0.00 179.01 179.51 1q8a h GLU 419 N 0.05 0.53 -0.29 1.92 4.81 -1.54 -3.02 114.58 117.04 1q8a h GLU 419 Ca 0.02 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1q8a h GLU 419 Cb 0.03 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.28 1q8a h GLU 419 CO -0.00 0.36 0.17 -0.07 -0.73 0.00 0.00 179.01 178.74 1q8a h LEU 420 N 0.54 0.35 -1.28 1.64 3.38 -0.81 -2.46 115.31 116.68 1q8a h LEU 420 Ca 0.15 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1q8a h LEU 420 Cb -0.05 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.61 1q8a h LEU 420 CO -0.03 0.31 0.00 -0.62 0.09 0.00 0.00 178.44 178.19 1q8a n GLU 421 N -4.84 0.00 0.00 1.13 1.02 -0.51 -0.51 120.64 116.93 1q8a n GLU 421 Ca -0.02 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.12 1q8a n GLU 421 Cb 0.06 -1.03 0.00 0.00 -0.02 0.00 0.00 31.44 30.45 1q8a n GLU 421 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1q8a n LYS 423 N 0.55 0.00 -0.15 3.49 5.02 -0.93 -1.30 118.16 124.84 1q8a n LYS 423 Ca 0.00 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.19 1q8a n LYS 423 Cb 0.00 0.00 -0.01 0.00 -0.02 0.00 0.00 35.03 35.00 1q8a n LYS 423 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1q8a h ILE 424 N 0.00 1.25 -0.91 -0.18 2.04 -1.06 -1.35 117.51 117.30 1q8a h ILE 424 Ca 0.00 -0.96 -0.02 0.00 1.00 0.00 0.00 64.86 64.88 1q8a h ILE 424 Cb 0.00 1.02 -0.04 0.00 -0.74 0.00 0.00 36.82 37.05 1q8a h ILE 424 CO 0.00 0.33 0.50 0.78 0.00 0.00 0.00 178.15 179.76 1q8a h ASN 425 N 0.60 1.13 -0.58 1.72 2.35 -1.43 0.44 115.58 119.81 1q8a h ASN 425 Ca 0.13 -0.10 -0.10 0.00 -0.55 0.00 0.00 56.30 55.68 1q8a h ASN 425 Cb 0.43 -0.29 -0.02 0.00 0.05 0.00 0.00 38.32 38.49 1q8a h ASN 425 CO 0.01 0.90 -0.04 -0.07 -1.65 0.00 0.00 177.43 176.59 1q8a h LEU 426 N 1.27 1.04 -0.52 1.61 3.38 -1.79 -2.35 115.31 117.96 1q8a h LEU 426 Ca 0.32 -0.31 -0.13 0.00 0.09 0.00 0.00 57.88 57.85 1q8a h LEU 426 Cb 0.02 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.48 1q8a h LEU 426 CO -0.05 1.11 -0.18 -0.07 0.09 0.00 0.00 178.44 179.34 1q8a h LEU 427 N 0.96 1.03 -1.50 1.67 3.38 -0.07 -0.51 115.31 120.26 1q8a h LEU 427 Ca 0.16 -0.37 -0.04 0.00 0.09 0.00 0.00 57.88 57.71 1q8a h LEU 427 Cb 0.60 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 1q8a h LEU 427 CO 0.04 1.18 -0.16 0.11 0.09 0.00 0.00 178.44 179.70 1q8a h LYS 428 N 0.88 0.13 0.12 1.13 1.57 -0.14 0.44 116.57 120.69 1q8a h LYS 428 Ca 0.12 -0.03 -0.32 0.00 -1.87 0.00 0.00 60.65 58.55 1q8a h LYS 428 Cb 0.76 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.04 1q8a h LYS 428 CO 0.06 0.29 -1.66 -0.22 -0.57 0.00 0.00 179.45 177.35 1q8a h LYS 429 N 0.12 0.25 -0.01 3.15 3.64 -1.05 -3.39 116.57 119.28 1q8a h LYS 429 Ca 0.02 -0.42 0.00 0.00 -1.27 0.00 0.00 60.65 58.98 1q8a h LYS 429 Cb 0.36 0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.33 1q8a h LYS 429 CO 0.02 1.10 -0.21 0.66 -2.27 0.00 0.00 179.45 178.75 1q8a n TYR 430 N -3.43 0.00 0.00 1.91 4.01 -0.23 -4.72 117.16 114.70 1q8a n TYR 430 Ca -0.20 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.54 1q8a n TYR 430 Cb 1.05 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 40.08 1q8a n TYR 430 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1q8a n GLY 431 N 0.95 -0.32 0.00 2.72 0.00 0.15 -4.90 105.19 103.79 1q8a n GLY 431 Ca 0.06 -1.69 0.00 0.00 0.00 0.00 0.00 46.02 44.38 1q8a n GLY 431 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1q8a n GLY 432 N -0.18 3.08 3.69 -0.02 0.00 -1.25 -4.66 105.19 105.85 1q8a n GLY 432 Ca 0.00 -1.93 -0.26 0.00 0.00 0.00 0.00 46.02 43.84 1q8a n GLY 432 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1q8a s THR 433 N -2.17 2.24 -0.02 2.61 -4.23 0.63 -4.90 115.64 109.80 1q8a s THR 433 Ca 0.00 -1.82 0.02 0.00 -1.18 0.00 0.00 61.69 58.70 1q8a s THR 433 Cb 0.00 -2.98 0.00 0.00 1.34 0.00 0.00 72.50 70.86 1q8a s THR 433 CO 0.00 -0.02 -0.05 -0.22 -0.54 0.00 0.00 174.62 173.79 1q8a s LEU 434 N -3.82 1.77 -0.14 4.79 2.96 0.02 0.10 118.68 124.35 1q8a s LEU 434 Ca 0.38 -0.11 -0.18 0.00 -0.22 0.00 0.00 54.13 54.01 1q8a s LEU 434 Cb 0.06 -0.36 -0.04 0.00 0.50 0.00 0.00 46.19 46.35 1q8a s LEU 434 CO 0.21 0.03 0.46 -0.63 -1.32 0.00 0.00 176.35 175.10 1q8a s ILE 435 N 0.22 5.19 -0.27 6.68 1.01 -0.52 -0.88 121.20 132.63 1q8a s ILE 435 Ca -0.02 0.90 -0.05 0.00 0.00 0.00 0.00 60.65 61.48 1q8a s ILE 435 Cb -0.07 -3.80 0.01 0.00 0.01 0.00 0.00 42.46 38.62 1q8a s ILE 435 CO -0.00 0.30 0.02 -0.69 0.00 0.00 0.00 174.94 174.56 1q8a s VAL 436 N 0.84 3.51 -0.14 2.92 1.01 -0.21 -1.45 120.40 126.88 1q8a s VAL 436 Ca 0.24 -0.79 -0.25 0.00 0.00 0.00 0.00 61.98 61.18 1q8a s VAL 436 Cb -0.15 -2.78 -0.02 0.00 0.00 0.00 0.00 36.38 33.43 1q8a s VAL 436 CO 0.09 0.16 0.80 -0.22 0.00 0.00 0.00 175.10 175.93 1q8a s LEU 437 N 1.43 4.21 -1.09 3.92 2.96 0.01 -1.16 118.68 128.96 1q8a s LEU 437 Ca 0.02 1.17 -0.22 0.00 -0.22 0.00 0.00 54.13 54.88 1q8a s LEU 437 Cb -0.17 -3.20 0.05 0.00 0.50 0.00 0.00 46.19 43.37 1q8a s LEU 437 CO -0.01 -0.33 1.56 -0.76 -1.32 0.00 0.00 176.35 175.50 1q8a s LEU 438 N 1.82 3.56 0.00 -0.68 1.43 -0.35 -3.08 118.68 121.37 1q8a s LEU 438 Ca 0.38 -1.67 0.00 0.00 -1.03 0.00 0.00 54.13 51.81 1q8a s LEU 438 Cb -0.17 -2.57 0.00 0.00 0.03 0.00 0.00 46.19 43.48 1q8a s LEU 438 CO 0.14 -1.52 0.00 0.61 0.23 0.00 0.00 176.35 175.81 1q8a n GLY 440 N 6.49 4.67 0.30 -3.19 0.00 -1.26 -4.65 105.19 107.54 1q8a n GLY 440 Ca 0.38 -0.66 -0.05 0.00 0.00 0.00 0.00 46.02 45.69 1q8a n GLY 440 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1q8a h LYS 441 N 0.00 1.03 -6.20 1.61 3.64 -2.02 -3.43 116.57 111.19 1q8a h LYS 441 Ca 0.00 -0.10 -0.54 0.00 -1.27 0.00 0.00 60.65 58.74 1q8a h LYS 441 Cb 0.00 -0.21 -0.06 0.00 -0.41 0.00 0.00 32.23 31.54 1q8a h LYS 441 CO 0.00 0.73 -0.56 0.34 -2.27 0.00 0.00 179.45 177.69 1q8a s ASP 442 N -6.00 5.44 0.16 4.20 -1.08 -1.26 -5.09 116.67 113.04 1q8a s ASP 442 Ca -0.13 -0.22 -0.30 0.00 -0.52 0.00 0.00 52.55 51.39 1q8a s ASP 442 Cb 0.15 -1.38 -0.07 0.00 -1.46 0.00 0.00 42.92 40.16 1q8a s ASP 442 CO 0.79 0.02 1.06 0.68 0.52 0.00 0.00 175.17 178.24 1q8a s VAL 443 N -1.93 4.04 0.75 1.11 -7.23 -1.26 -5.03 120.40 110.85 1q8a s VAL 443 Ca 0.32 1.75 -0.11 0.00 -1.81 0.00 0.00 61.98 62.13 1q8a s VAL 443 Cb -0.09 -4.12 0.04 0.00 0.56 0.00 0.00 36.38 32.77 1q8a s VAL 443 CO 0.24 0.30 1.08 -2.16 -0.31 0.00 0.00 175.10 174.24 1q8a s PRO 444 N -0.30 2.46 -0.10 4.82 0.04 -1.26 -4.98 135.00 135.68 1q8a s PRO 444 Ca 0.48 0.93 0.21 0.00 0.04 0.00 0.00 61.00 62.65 1q8a s PRO 444 Cb -0.28 -1.94 0.44 0.00 0.04 0.00 0.00 34.50 32.76 1q8a s PRO 444 CO 0.33 -1.43 1.18 1.63 0.04 0.00 0.00 177.00 178.75 1q8a n LYS 445 N -3.35 0.82 -3.61 4.56 4.76 -1.26 -5.03 118.16 115.05 1q8a n LYS 445 Ca 0.08 -2.64 -0.04 0.00 -2.87 0.00 0.00 58.31 52.84 1q8a n LYS 445 Cb 0.54 -0.74 -0.02 0.00 -1.84 0.00 0.00 35.03 32.97 1q8a n LYS 445 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 1q8a s SER 446 N -2.62 -0.20 0.15 4.39 1.04 -1.26 -5.02 113.70 110.18 1q8a s SER 446 Ca 0.35 -0.11 -0.15 0.00 0.48 0.00 0.00 55.95 56.52 1q8a s SER 446 Cb 0.38 0.29 0.02 0.00 0.10 0.00 0.00 66.02 66.81 1q8a s SER 446 CO -0.12 -0.50 1.69 0.15 0.98 0.00 0.00 173.24 175.44 1q8a h PHE 447 N 2.00 0.71 -0.64 5.02 3.57 -1.96 -2.54 116.94 123.09 1q8a h PHE 447 Ca -0.21 -0.05 0.05 0.00 3.53 0.00 0.00 57.97 61.29 1q8a h PHE 447 Cb 1.21 -0.21 -0.05 0.00 2.79 0.00 0.00 35.95 39.69 1q8a h PHE 447 CO 0.30 0.60 0.36 1.49 -2.23 0.00 0.00 178.31 178.84 1q8a h GLU 448 N 0.61 0.66 -0.60 1.11 4.57 -1.96 0.15 114.58 119.12 1q8a h GLU 448 Ca 0.15 -0.04 -0.07 0.00 -1.18 0.00 0.00 59.36 58.22 1q8a h GLU 448 Cb 0.20 -0.15 -0.03 0.00 -0.16 0.00 0.00 28.75 28.61 1q8a h GLU 448 CO -0.01 0.43 0.10 0.93 -1.18 0.00 0.00 179.01 179.28 1q8a h GLU 449 N 0.68 0.97 -0.22 1.92 5.08 -1.94 -1.83 114.58 119.25 1q8a h GLU 449 Ca 0.28 -0.24 -0.12 0.00 -1.00 0.00 0.00 59.36 58.28 1q8a h GLU 449 Cb 0.15 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 1q8a h GLU 449 CO -0.17 0.90 -0.36 0.00 -1.00 0.00 0.00 179.01 178.39 1q8a h ARG 450 N 0.92 0.47 -0.29 2.33 3.08 -0.81 -2.25 114.38 117.83 1q8a h ARG 450 Ca 0.19 -0.22 -0.09 0.00 0.07 0.00 0.00 59.98 59.93 1q8a h ARG 450 Cb 0.40 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.43 1q8a h ARG 450 CO 0.01 0.77 -0.20 -0.22 -1.07 0.00 0.00 179.97 179.26 1q8a h LYS 451 N 0.40 0.53 -0.45 0.04 3.64 -0.34 -0.37 116.57 120.01 1q8a h LYS 451 Ca 0.04 -0.18 -0.12 0.00 -1.27 0.00 0.00 60.65 59.12 1q8a h LYS 451 Cb 0.81 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.58 1q8a h LYS 451 CO 0.07 0.70 -0.19 0.93 -2.27 0.00 0.00 179.45 178.68 1q8a h GLU 452 N 0.48 0.90 -0.24 1.90 5.08 -1.07 -0.51 114.58 121.11 1q8a h GLU 452 Ca 0.08 -0.36 -0.10 0.00 -1.00 0.00 0.00 59.36 57.97 1q8a h GLU 452 Cb 0.61 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.81 1q8a h GLU 452 CO 0.04 1.01 -0.28 1.88 -1.00 0.00 0.00 179.01 180.66 1q8a h TYR 453 N 0.79 0.54 -0.24 4.33 -1.99 -0.98 -1.19 116.97 118.24 1q8a h TYR 453 Ca 0.11 -0.12 -0.01 0.00 2.00 0.00 0.00 58.73 60.71 1q8a h TYR 453 Cb 0.74 -0.13 -0.01 0.00 2.00 0.00 0.00 36.73 39.33 1q8a h TYR 453 CO 0.04 0.72 0.11 0.35 -0.00 0.00 0.00 178.16 179.38 1q8a h PHE 454 N 0.42 0.35 -0.61 4.88 3.57 -0.65 0.10 116.94 124.99 1q8a h PHE 454 Ca 0.06 -0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.47 1q8a h PHE 454 Cb 0.71 -0.11 -0.03 0.00 2.79 0.00 0.00 35.95 39.32 1q8a h PHE 454 CO 0.02 0.35 0.12 0.93 -2.23 0.00 0.00 178.31 177.51 1q8a h GLU 455 N 0.24 0.98 -0.52 1.11 5.08 -0.85 0.18 114.58 120.79 1q8a h GLU 455 Ca 0.08 -0.23 -0.10 0.00 -1.00 0.00 0.00 59.36 58.10 1q8a h GLU 455 Cb 0.14 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.25 1q8a h GLU 455 CO -0.01 0.89 -0.09 -0.22 -1.00 0.00 0.00 179.01 178.58 1q8a h LYS 456 N 0.93 0.96 -0.44 2.33 3.64 -1.06 -1.76 116.57 121.16 1q8a h LYS 456 Ca 0.19 -0.33 -0.02 0.00 -1.27 0.00 0.00 60.65 59.22 1q8a h LYS 456 Cb 0.37 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.10 1q8a h LYS 456 CO 0.01 1.00 0.20 0.00 -2.27 0.00 0.00 179.45 178.38 1q8a h ALA 457 N 1.03 0.57 -0.72 5.00 0.00 -0.19 -2.22 119.26 122.72 1q8a h ALA 457 Ca 0.14 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1q8a h ALA 457 Cb 0.63 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 1q8a h ALA 457 CO 0.04 0.15 0.46 -0.07 0.00 0.00 0.00 179.25 179.83 1q8a h LEU 458 N 0.57 0.84 -0.31 0.00 3.38 -0.64 0.88 115.31 120.04 1q8a h LEU 458 Ca 0.15 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 1q8a h LEU 458 Cb 0.15 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1q8a h LEU 458 CO -0.02 0.63 0.15 0.50 0.09 0.00 0.00 178.44 179.79 1q8a h LYS 459 N 0.99 0.45 -0.48 1.13 3.64 -0.98 -0.29 116.57 121.02 1q8a h LYS 459 Ca 0.26 -0.07 -0.07 0.00 -1.27 0.00 0.00 60.65 59.50 1q8a h LYS 459 Cb -0.08 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.64 1q8a h LYS 459 CO -0.05 0.42 0.01 0.82 -2.27 0.00 0.00 179.45 178.38 1q8a h ILE 460 N 0.37 1.26 -0.41 2.00 2.04 -0.85 -2.43 117.51 119.50 1q8a h ILE 460 Ca 0.11 -1.05 -0.05 0.00 1.00 0.00 0.00 64.86 64.86 1q8a h ILE 460 Cb 0.12 0.99 -0.02 0.00 -0.74 0.00 0.00 36.82 37.17 1q8a h ILE 460 CO -0.01 0.37 0.03 -0.07 0.00 0.00 0.00 178.15 178.46 1q8a h LEU 461 N 0.70 0.60 -0.59 1.44 3.38 -0.68 -2.55 115.31 117.61 1q8a h LEU 461 Ca 0.14 -0.12 -0.07 0.00 0.09 0.00 0.00 57.88 57.92 1q8a h LEU 461 Cb 0.50 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 1q8a h LEU 461 CO 0.02 0.65 0.08 -0.33 0.09 0.00 0.00 178.44 178.95 1q8a h GLU 462 N 0.61 0.99 -0.14 1.13 4.39 -0.80 -0.76 114.58 120.00 1q8a h GLU 462 Ca 0.13 -0.27 -0.02 0.00 0.34 0.00 0.00 59.36 59.54 1q8a h GLU 462 Cb 0.34 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 1q8a h GLU 462 CO 0.01 0.94 0.01 -0.09 -1.16 0.00 0.00 179.01 178.72 1q8a h ARG 463 N 0.89 0.20 -0.32 2.33 2.43 -1.03 -2.19 114.38 116.68 1q8a h ARG 463 Ca 0.18 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.30 1q8a h ARG 463 Cb 0.44 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.94 1q8a h ARG 463 CO 0.01 0.21 0.01 0.72 -1.51 0.00 0.00 179.97 179.42 1q8a n HIS 464 N -4.42 1.13 -3.44 2.20 8.25 -1.07 -4.99 115.22 112.87 1q8a n HIS 464 Ca -0.01 -0.95 -0.38 0.00 -0.26 0.00 0.00 57.72 56.13 1q8a n HIS 464 Cb 0.15 -0.37 0.04 0.00 1.12 0.00 0.00 29.99 30.93 1q8a n HIS 464 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 1q8a n ASP 465 N -0.46 -5.23 -0.03 0.41 4.64 -0.79 -4.88 116.55 110.21 1q8a n ASP 465 Ca 0.24 -0.20 0.00 0.00 -1.38 0.00 0.00 54.79 53.45 1q8a n ASP 465 Cb 0.96 -1.53 0.00 0.00 -1.04 0.00 0.00 41.12 39.51 1q8a n ASP 465 CO 0.00 0.00 0.00 0.33 -0.82 0.00 0.00 177.20 176.71 1q8a n PHE 466 N -0.29 0.00 0.24 -0.67 7.35 -0.36 -4.92 117.46 118.81 1q8a n PHE 466 Ca -0.10 0.00 0.16 0.00 -0.76 0.00 0.00 57.45 56.75 1q8a n PHE 466 Cb 0.67 0.08 0.84 0.00 0.35 0.00 0.00 39.48 41.41 1q8a n PHE 466 CO 0.00 0.00 0.00 0.77 -0.76 0.00 0.00 176.76 176.77 1q8a h SER 467 N 0.00 0.00 -0.19 -2.13 0.02 -1.90 -1.82 113.55 107.53 1q8a h SER 467 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1q8a h SER 467 Cb 1.01 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.55 1q8a h SER 467 CO 0.00 0.00 0.00 -0.90 -1.14 0.00 0.00 176.83 174.79 1q8a n ASP 468 N -3.91 1.88 -0.49 3.07 5.75 -1.26 -4.13 116.55 117.46 1q8a n ASP 468 Ca -0.00 -1.75 0.07 0.00 -0.01 0.00 0.00 54.79 53.10 1q8a n ASP 468 Cb 0.23 -0.12 0.19 0.00 -1.03 0.00 0.00 41.12 40.39 1q8a n ASP 468 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1q8a n ARG 469 N 0.47 1.54 -4.21 0.11 1.74 -0.68 -4.85 116.66 110.78 1q8a n ARG 469 Ca 0.16 -3.09 -0.18 0.00 -0.77 0.00 0.00 57.85 53.98 1q8a n ARG 469 Cb 0.36 -1.60 -0.11 0.00 -1.02 0.00 0.00 32.46 30.09 1q8a n ARG 469 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1q8a s VAL 470 N -3.13 1.21 -0.01 1.55 -7.23 -1.26 -0.80 120.40 110.73 1q8a s VAL 470 Ca 0.37 -1.58 0.06 0.00 -1.81 0.00 0.00 61.98 59.02 1q8a s VAL 470 Cb 0.35 -1.37 -0.01 0.00 0.56 0.00 0.00 36.38 35.90 1q8a s VAL 470 CO -0.03 -0.37 -0.19 -0.51 -0.31 0.00 0.00 175.10 173.69 1q8a s ILE 471 N -1.91 1.47 -0.16 -0.62 2.07 -0.05 -4.60 121.20 117.39 1q8a s ILE 471 Ca 0.05 -0.80 -0.09 0.00 -1.41 0.00 0.00 60.65 58.40 1q8a s ILE 471 Cb -0.06 -1.22 -0.05 0.00 0.13 0.00 0.00 42.46 41.26 1q8a s ILE 471 CO 0.02 0.41 0.16 -0.36 -1.91 0.00 0.00 174.94 173.26 1q8a s PHE 472 N -0.44 3.49 -0.34 3.50 0.08 -0.55 -1.04 117.98 122.67 1q8a s PHE 472 Ca 0.07 0.45 -0.05 0.00 0.12 0.00 0.00 56.93 57.52 1q8a s PHE 472 Cb -0.07 -2.10 0.05 0.00 -0.57 0.00 0.00 43.02 40.33 1q8a s PHE 472 CO -0.01 0.46 0.10 0.34 -0.10 0.00 0.00 175.22 176.01 1q8a s ASP 473 N -0.19 5.22 0.51 1.36 3.68 -0.31 -1.48 116.67 125.46 1q8a s ASP 473 Ca 0.12 -1.31 0.34 0.00 2.13 0.00 0.00 52.55 53.83 1q8a s ASP 473 Cb -0.12 -1.83 1.82 0.00 -1.45 0.00 0.00 42.92 41.34 1q8a s ASP 473 CO 0.01 -0.35 2.05 1.55 0.13 0.00 0.00 175.17 178.56 1q8a h PRO 474 N 8.15 0.00 -1.73 4.34 0.13 -1.85 -0.93 132.00 140.11 1q8a h PRO 474 Ca -0.21 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.92 1q8a h PRO 474 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 1q8a h PRO 474 CO 0.61 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.79 1q8a n GLY 475 N -1.01 -0.77 3.71 1.56 0.00 -1.26 -4.55 105.19 102.87 1q8a n GLY 475 Ca -0.02 -0.39 -0.42 0.00 0.00 0.00 0.00 46.02 45.19 1q8a n GLY 475 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1q8a s VAL 476 N -0.34 4.66 0.17 1.61 1.01 -1.26 -4.94 120.40 121.30 1q8a s VAL 476 Ca 0.00 1.91 0.08 0.00 0.00 0.00 0.00 61.98 63.97 1q8a s VAL 476 Cb 0.00 -4.23 -0.04 0.00 0.00 0.00 0.00 36.38 32.11 1q8a s VAL 476 CO 0.00 0.15 -0.05 -0.76 0.00 0.00 0.00 175.10 174.44 1q8a s LEU 477 N 0.99 3.14 0.31 3.92 1.43 -1.26 -4.71 118.68 122.50 1q8a s LEU 477 Ca 0.53 -0.47 -0.30 0.00 -1.03 0.00 0.00 54.13 52.87 1q8a s LEU 477 Cb -0.23 -1.82 -0.12 0.00 0.03 0.00 0.00 46.19 44.05 1q8a s LEU 477 CO 0.28 0.11 1.53 -2.65 0.23 0.00 0.00 176.35 175.85 1q8a n PRO 478 N 0.07 2.58 -0.26 1.29 -0.02 -1.19 -4.41 135.00 133.05 1q8a n PRO 478 Ca -0.11 0.91 -0.04 0.00 -2.02 0.00 0.00 63.50 62.24 1q8a n PRO 478 Cb 0.55 -2.66 0.07 0.00 -0.02 0.00 0.00 33.50 31.44 1q8a n PRO 478 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1q8a h LEU 479 N 4.22 0.80 0.00 2.45 3.38 -1.14 -1.25 115.31 123.77 1q8a h LEU 479 Ca -0.47 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.48 1q8a h LEU 479 Cb 1.24 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.79 1q8a h LEU 479 CO 0.75 0.57 0.00 0.61 0.09 0.00 0.00 178.44 180.46 1q8a n GLY 480 N -1.30 -0.66 2.18 0.83 0.00 -1.26 -2.32 105.19 102.66 1q8a n GLY 480 Ca 0.07 -0.04 -0.25 0.00 0.00 0.00 0.00 46.02 45.80 1q8a n GLY 480 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q8a n ALA 481 N -1.37 5.09 -4.14 4.61 0.00 -0.79 -4.93 120.51 118.99 1q8a n ALA 481 Ca 0.03 -3.95 -0.35 0.00 0.00 0.00 0.00 53.44 49.17 1q8a n ALA 481 Cb 0.08 -0.45 -0.04 0.00 0.00 0.00 0.00 19.45 19.04 1q8a n ALA 481 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1q8a n GLU 482 N -0.64 -1.11 0.00 0.00 2.13 -0.98 -4.82 120.64 115.22 1q8a n GLU 482 Ca 0.43 0.16 0.08 0.00 0.66 0.00 0.00 57.16 58.49 1q8a n GLU 482 Cb 0.86 -3.43 0.38 0.00 0.27 0.00 0.00 31.44 29.52 1q8a n GLU 482 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1q8a n GLY 483 N -2.27 -1.04 3.83 8.31 0.00 -0.54 -4.95 105.19 108.54 1q8a n GLY 483 Ca -0.24 -0.06 -0.31 0.00 0.00 0.00 0.00 46.02 45.41 1q8a n GLY 483 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1q8a n LYS 484 N -1.46 -0.75 0.29 1.61 3.00 -1.26 -4.48 118.16 115.12 1q8a n LYS 484 Ca 0.05 0.23 0.18 0.00 -0.00 0.00 0.00 58.31 58.77 1q8a n LYS 484 Cb 0.19 -1.81 0.92 0.00 0.00 0.00 0.00 35.03 34.32 1q8a n LYS 484 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.40 176.40 1q8a h PRO 485 N -0.95 0.00 -0.16 1.64 0.13 -1.92 -0.85 132.00 129.89 1q8a h PRO 485 Ca -0.56 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.53 1q8a h PRO 485 Cb 1.15 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.27 1q8a h PRO 485 CO 0.37 0.00 -0.07 0.28 -0.23 0.00 0.00 178.00 178.35 1q8a h VAL 486 N 0.00 1.15 -0.18 1.56 2.07 -2.00 -1.14 116.25 117.71 1q8a h VAL 486 Ca 0.03 -0.62 -0.08 0.00 0.82 0.00 0.00 66.70 66.85 1q8a h VAL 486 Cb 0.50 1.11 -0.01 0.00 -1.52 0.00 0.00 31.29 31.36 1q8a h VAL 486 CO -0.00 0.20 -0.25 -0.33 0.02 0.00 0.00 177.57 177.21 1q8a h GLU 487 N 0.23 0.32 -0.02 1.57 4.39 -1.48 -1.32 114.58 118.28 1q8a h GLU 487 Ca 0.05 -0.11 -0.25 0.00 0.34 0.00 0.00 59.36 59.39 1q8a h GLU 487 Cb 0.28 -0.02 0.02 0.00 -0.10 0.00 0.00 28.75 28.92 1q8a h GLU 487 CO 0.01 0.56 -1.00 0.28 -1.16 0.00 0.00 179.01 177.70 1q8a h VAL 488 N 0.29 1.30 -0.66 3.13 2.07 -1.40 -2.59 116.25 118.39 1q8a h VAL 488 Ca 0.05 -2.26 -0.04 0.00 0.82 0.00 0.00 66.70 65.27 1q8a h VAL 488 Cb 0.60 2.35 -0.03 0.00 -1.52 0.00 0.00 31.29 32.69 1q8a h VAL 488 CO 0.04 0.70 0.24 -0.07 0.02 0.00 0.00 177.57 178.50 1q8a h LEU 489 N 0.38 0.90 -0.65 2.57 3.38 -0.95 0.05 115.31 120.99 1q8a h LEU 489 Ca -0.11 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.71 1q8a h LEU 489 Cb 1.64 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 42.13 1q8a h LEU 489 CO 0.19 0.82 0.36 0.11 0.09 0.00 0.00 178.44 180.02 1q8a h LYS 490 N 0.96 0.90 -0.35 1.13 1.57 -1.20 -1.17 116.57 118.42 1q8a h LYS 490 Ca 0.22 -0.10 -0.03 0.00 -1.87 0.00 0.00 60.65 58.87 1q8a h LYS 490 Cb 0.22 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 1q8a h LYS 490 CO -0.02 0.67 0.09 1.15 -0.57 0.00 0.00 179.45 180.78 1q8a h THR 491 N 0.89 1.22 -0.26 -0.16 2.02 -0.99 -0.94 112.91 114.69 1q8a h THR 491 Ca 0.23 -0.73 0.03 0.00 0.77 0.00 0.00 66.41 66.72 1q8a h THR 491 Cb 0.03 1.03 -0.03 0.00 -1.74 0.00 0.00 68.15 67.44 1q8a h THR 491 CO -0.04 0.25 0.06 0.40 0.37 0.00 0.00 175.52 176.56 1q8a h ILE 492 N 0.41 0.89 -0.69 3.11 2.04 -0.72 0.10 117.51 122.65 1q8a h ILE 492 Ca 0.11 -0.05 0.03 0.00 1.00 0.00 0.00 64.86 65.94 1q8a h ILE 492 Cb 0.28 0.72 -0.04 0.00 -0.74 0.00 0.00 36.82 37.04 1q8a h ILE 492 CO -0.00 0.03 0.44 -0.08 0.00 0.00 0.00 178.15 178.53 1q8a h GLU 493 N 0.16 0.83 -0.24 2.37 4.81 -1.01 -0.58 114.58 120.92 1q8a h GLU 493 Ca 0.12 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.28 1q8a h GLU 493 Cb 0.11 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.30 1q8a h GLU 493 CO -0.15 0.55 0.07 0.35 -0.73 0.00 0.00 179.01 179.10 1q8a h PHE 494 N 0.86 0.39 -0.68 0.92 3.57 -0.63 -1.90 116.94 119.47 1q8a h PHE 494 Ca 0.27 -0.04 -0.07 0.00 3.53 0.00 0.00 57.97 61.67 1q8a h PHE 494 Cb 0.00 -0.11 -0.03 0.00 2.79 0.00 0.00 35.95 38.60 1q8a h PHE 494 CO -0.04 0.45 0.16 0.82 -2.23 0.00 0.00 178.31 177.47 1q8a h ILE 495 N 0.22 1.26 -0.86 1.41 1.08 -0.49 -2.49 117.51 117.64 1q8a h ILE 495 Ca 0.08 -0.95 -0.02 0.00 -0.39 0.00 0.00 64.86 63.57 1q8a h ILE 495 Cb 0.24 0.56 -0.04 0.00 -3.07 0.00 0.00 36.82 34.51 1q8a h ILE 495 CO -0.00 0.36 0.46 0.28 -0.69 0.00 0.00 178.15 178.56 1q8a h SER 496 N 1.03 1.09 0.52 1.72 0.02 -1.02 -1.63 113.55 115.27 1q8a h SER 496 Ca 0.21 -0.11 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 1q8a h SER 496 Cb 0.36 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.63 1q8a h SER 496 CO 0.00 0.89 0.00 0.77 -1.14 0.00 0.00 176.83 177.35 1q8a h SER 497 N 1.21 0.00 0.02 3.07 4.64 -0.89 -0.51 113.55 121.09 1q8a h SER 497 Ca 0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.62 1q8a h SER 497 Cb 0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 1q8a h SER 497 CO -0.05 0.00 -0.04 0.29 -0.87 0.00 0.00 176.83 176.16 1q8a n LYS 498 N -3.02 1.56 -0.51 4.77 4.76 -0.63 -4.94 118.16 120.15 1q8a n LYS 498 Ca -0.01 -0.92 0.00 0.00 -2.87 0.00 0.00 58.31 54.51 1q8a n LYS 498 Cb 0.19 -1.48 0.00 0.00 -1.84 0.00 0.00 35.03 31.90 1q8a n LYS 498 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1q8a n GLY 499 N 1.21 0.75 3.89 0.72 0.00 -0.20 -5.06 105.19 106.50 1q8a n GLY 499 Ca 0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 1q8a n GLY 499 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1q8a s PHE 500 N -2.42 3.56 0.68 1.61 0.40 -1.09 -5.03 117.98 115.69 1q8a s PHE 500 Ca 0.00 0.51 -0.13 0.00 -0.60 0.00 0.00 56.93 56.71 1q8a s PHE 500 Cb 0.00 -1.95 0.01 0.00 0.51 0.00 0.00 43.02 41.59 1q8a s PHE 500 CO 0.00 0.60 1.09 -0.80 0.70 0.00 0.00 175.22 176.81 1q8a s ASN 501 N -1.86 5.09 0.10 1.36 0.01 -1.26 -4.15 114.94 114.23 1q8a s ASN 501 Ca 0.29 1.87 0.03 0.00 -0.71 0.00 0.00 52.86 54.34 1q8a s ASN 501 Cb -0.13 -2.53 -0.04 0.00 0.41 0.00 0.00 41.25 38.96 1q8a s ASN 501 CO 0.18 -1.64 -0.08 0.42 -1.51 0.00 0.00 177.10 174.47 1q8a s THR 502 N -2.60 0.79 0.19 1.60 -4.23 -1.26 -1.48 115.64 108.66 1q8a s THR 502 Ca 0.64 -1.79 -0.13 0.00 -1.18 0.00 0.00 61.69 59.23 1q8a s THR 502 Cb -0.18 -1.51 0.00 0.00 1.34 0.00 0.00 72.50 72.16 1q8a s THR 502 CO 0.46 -0.73 0.40 0.28 -0.54 0.00 0.00 174.62 174.49 1q8a s THR 503 N -3.06 0.04 0.06 3.99 -1.32 -0.55 -2.28 115.64 112.51 1q8a s THR 503 Ca 0.09 -1.18 -0.11 0.00 -1.21 0.00 0.00 61.69 59.27 1q8a s THR 503 Cb 0.01 -1.82 0.01 0.00 -1.51 0.00 0.00 72.50 69.19 1q8a s THR 503 CO -0.02 -0.18 0.25 0.68 -2.21 0.00 0.00 174.62 173.13 1q8a s VAL 504 N -3.94 0.10 -1.07 5.08 -7.23 -1.24 -4.01 120.40 108.09 1q8a s VAL 504 Ca 0.15 -0.86 -0.15 0.00 -1.81 0.00 0.00 61.98 59.32 1q8a s VAL 504 Cb 0.01 -1.03 0.18 0.00 0.56 0.00 0.00 36.38 36.11 1q8a s VAL 504 CO 0.01 -0.47 1.21 -0.83 -0.31 0.00 0.00 175.10 174.71 1q8a s GLY 505 N -2.28 2.43 0.17 2.32 0.00 -1.26 -0.70 107.32 107.99 1q8a s GLY 505 Ca -0.02 -3.26 -0.15 0.00 0.00 0.00 0.00 44.72 41.28 1q8a s GLY 505 CO -0.06 1.83 1.69 -2.00 0.00 0.00 0.00 173.10 174.57 1q8a h LEU 506 N 9.21 -0.20 -2.09 0.66 5.85 -1.71 -2.29 115.31 124.74 1q8a h LEU 506 Ca 0.22 0.10 0.00 0.00 0.84 0.00 0.00 57.88 59.05 1q8a h LEU 506 Cb 0.94 0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.15 1q8a h LEU 506 CO 1.11 -0.06 0.00 0.28 -0.34 0.00 0.00 178.44 179.43 1q8a h SER 507 N 0.10 0.00 0.55 1.25 0.02 -1.91 -1.95 113.55 111.61 1q8a h SER 507 Ca 0.21 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.15 1q8a h SER 507 Cb 0.31 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.84 1q8a h SER 507 CO -0.36 0.00 -0.04 -1.13 -1.14 0.00 0.00 176.83 174.16 1q8a h ASN 508 N 0.00 0.00 -0.47 3.07 -1.24 -1.75 -2.24 115.58 112.95 1q8a h ASN 508 Ca 0.00 0.00 -0.05 0.00 0.71 0.00 0.00 56.30 56.96 1q8a h ASN 508 Cb 0.06 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.08 1q8a h ASN 508 CO 0.00 0.04 0.12 0.25 -1.29 0.00 0.00 177.43 176.55 1q8a h LEU 509 N 0.00 0.77 -1.50 0.34 5.85 -1.53 -3.15 115.31 116.08 1q8a h LEU 509 Ca -0.00 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.58 1q8a h LEU 509 Cb 0.33 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.16 1q8a h LEU 509 CO 0.01 0.76 0.00 -1.54 -0.34 0.00 0.00 178.44 177.33 1q8a n SER 510 N -4.27 1.55 -3.35 1.25 3.41 -0.97 -0.66 113.62 110.58 1q8a n SER 510 Ca 0.04 -1.34 -0.32 0.00 -0.26 0.00 0.00 58.87 56.99 1q8a n SER 510 Cb 0.23 -0.02 -0.03 0.00 -0.26 0.00 0.00 64.21 64.14 1q8a n SER 510 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1q8a n PHE 511 N 0.19 1.90 0.00 7.33 3.01 -0.88 -1.77 117.46 127.23 1q8a n PHE 511 Ca 0.03 -2.25 0.00 0.00 1.01 0.00 0.00 57.45 56.24 1q8a n PHE 511 Cb 0.15 -1.93 0.00 0.00 -0.01 0.00 0.00 39.48 37.69 1q8a n PHE 511 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1q8a n GLY 512 N 3.92 0.00 3.27 1.37 0.00 -1.26 -5.06 105.19 107.42 1q8a n GLY 512 Ca 0.53 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.46 1q8a n GLY 512 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1q8a s LEU 513 N 0.00 1.15 0.78 0.99 2.34 -0.73 -4.93 118.68 118.28 1q8a s LEU 513 Ca 0.00 -0.69 -0.12 0.00 0.06 0.00 0.00 54.13 53.38 1q8a s LEU 513 Cb 0.00 1.18 0.06 0.00 -0.56 0.00 0.00 46.19 46.87 1q8a s LEU 513 CO 0.00 -0.80 1.12 -2.16 -1.06 0.00 0.00 176.35 173.45 1q8a s PRO 514 N -3.89 2.23 -1.51 1.48 0.04 -1.26 -3.82 135.00 128.26 1q8a s PRO 514 Ca 0.09 0.41 0.00 0.00 0.04 0.00 0.00 61.00 61.54 1q8a s PRO 514 Cb 0.04 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 32.63 1q8a s PRO 514 CO -0.07 -1.47 0.00 -0.25 0.04 0.00 0.00 177.00 175.25 1q8a n ASP 515 N -3.29 -4.10 -0.37 6.66 8.00 -1.26 -4.80 116.55 117.38 1q8a n ASP 515 Ca 0.07 0.31 0.30 0.00 0.71 0.00 0.00 54.79 56.18 1q8a n ASP 515 Cb 0.58 -3.68 0.60 0.00 -0.02 0.00 0.00 41.12 38.61 1q8a n ASP 515 CO 0.00 0.00 0.00 0.08 -0.39 0.00 0.00 177.20 176.89 1q8a h ARG 516 N 0.00 0.21 -1.00 -1.24 0.11 -1.85 0.19 114.38 110.81 1q8a h ARG 516 Ca -0.32 -0.01 0.14 0.00 0.10 0.00 0.00 59.98 59.89 1q8a h ARG 516 Cb 1.05 -0.05 -0.09 0.00 1.11 0.00 0.00 29.97 31.99 1q8a h ARG 516 CO 0.44 0.14 0.63 1.03 0.10 0.00 0.00 179.97 182.31 1q8a h SER 517 N 0.22 0.88 -0.08 0.08 0.87 -1.93 0.39 113.55 113.98 1q8a h SER 517 Ca 0.67 0.06 -0.20 0.00 -1.23 0.00 0.00 61.79 61.09 1q8a h SER 517 Cb 2.03 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 63.88 1q8a h SER 517 CO -0.27 0.43 -0.68 1.88 -0.53 0.00 0.00 176.83 177.66 1q8a h TYR 518 N 0.92 0.93 -0.51 2.24 -1.99 -0.98 -1.86 116.97 115.71 1q8a h TYR 518 Ca 0.52 -0.38 -0.12 0.00 2.00 0.00 0.00 58.73 60.76 1q8a h TYR 518 Cb 0.62 -0.16 -0.02 0.00 2.00 0.00 0.00 36.73 39.18 1q8a h TYR 518 CO -0.00 1.18 -0.14 1.88 -0.00 0.00 0.00 178.16 181.07 1q8a h TYR 519 N 0.51 1.13 -0.57 4.88 -1.99 -1.34 -1.32 116.97 118.26 1q8a h TYR 519 Ca -0.02 -0.25 -0.02 0.00 2.00 0.00 0.00 58.73 60.44 1q8a h TYR 519 Cb 1.28 -0.27 -0.03 0.00 2.00 0.00 0.00 36.73 39.71 1q8a h TYR 519 CO 0.07 1.07 0.29 -0.91 -0.00 0.00 0.00 178.16 178.67 1q8a h ASN 520 N 0.87 0.73 0.21 3.88 2.35 -0.85 -0.06 115.58 122.71 1q8a h ASN 520 Ca 0.13 -0.12 -0.01 0.00 -0.55 0.00 0.00 56.30 55.75 1q8a h ASN 520 Cb 0.71 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.90 1q8a h ASN 520 CO 0.05 0.64 -0.10 0.74 -1.65 0.00 0.00 177.43 177.12 1q8a h THR 521 N 0.77 0.86 -0.43 2.81 2.02 -1.27 0.25 112.91 117.92 1q8a h THR 521 Ca 0.20 -0.38 0.07 0.00 0.77 0.00 0.00 66.41 67.07 1q8a h THR 521 Cb 0.09 1.08 -0.06 0.00 -1.74 0.00 0.00 68.15 67.52 1q8a h THR 521 CO -0.03 0.09 0.04 0.00 0.37 0.00 0.00 175.52 175.99 1q8a h ALA 522 N 0.27 0.43 -0.71 6.16 0.00 -1.08 -0.58 119.26 123.75 1q8a h ALA 522 Ca -0.03 0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 1q8a h ALA 522 Cb 0.36 0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 1q8a h ALA 522 CO 0.05 -0.36 0.23 0.35 0.00 0.00 0.00 179.25 179.52 1q8a h PHE 523 N 0.16 1.12 -0.07 0.00 3.57 -0.90 -1.55 116.94 119.28 1q8a h PHE 523 Ca 0.21 -0.11 0.01 0.00 3.53 0.00 0.00 57.97 61.61 1q8a h PHE 523 Cb 0.29 -0.33 -0.01 0.00 2.79 0.00 0.00 35.95 38.69 1q8a h PHE 523 CO -0.25 0.89 0.01 1.25 -2.23 0.00 0.00 178.31 177.99 1q8a h LEU 524 N 1.03 -0.00 -0.07 0.59 6.46 -0.04 0.34 115.31 123.62 1q8a h LEU 524 Ca 0.23 0.01 0.02 0.00 -0.12 0.00 0.00 57.88 58.02 1q8a h LEU 524 Cb 0.29 0.02 -0.03 0.00 -0.73 0.00 0.00 40.66 40.21 1q8a h LEU 524 CO -0.01 0.01 -0.08 0.58 -0.62 0.00 0.00 178.44 178.32 1q8a h VAL 525 N 0.04 0.78 -0.38 1.05 2.07 -1.00 0.19 116.25 119.00 1q8a h VAL 525 Ca 0.03 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.57 1q8a h VAL 525 Cb 0.03 0.78 -0.02 0.00 -1.52 0.00 0.00 31.29 30.56 1q8a h VAL 525 CO -0.05 0.00 0.22 -0.07 0.02 0.00 0.00 177.57 177.70 1q8a h LEU 526 N -0.10 0.36 -0.75 2.57 4.07 -1.00 -2.01 115.31 118.46 1q8a h LEU 526 Ca 0.05 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.02 1q8a h LEU 526 Cb 0.18 -0.07 -0.04 0.00 1.08 0.00 0.00 40.66 41.81 1q8a h LEU 526 CO -0.13 0.26 0.47 1.23 -1.08 0.00 0.00 178.44 179.19 1q8a h GLY 527 N 0.45 1.07 1.45 0.83 0.00 0.20 -2.39 103.07 104.68 1q8a h GLY 527 Ca 0.15 -0.42 -0.05 0.00 0.00 0.00 0.00 47.33 47.01 1q8a h GLY 527 CO -0.07 0.41 0.09 -2.22 0.00 0.00 0.00 176.54 174.75 1q8a h ILE 528 N 1.02 1.21 0.00 2.60 2.04 -0.37 -1.05 117.51 122.95 1q8a h ILE 528 Ca 0.27 -0.77 -0.00 0.00 1.00 0.00 0.00 64.86 65.36 1q8a h ILE 528 Cb -0.08 0.77 -0.00 0.00 -0.74 0.00 0.00 36.82 36.77 1q8a h ILE 528 CO -0.05 0.28 -0.01 0.77 0.00 0.00 0.00 178.15 179.13 1q8a h SER 529 N 0.67 0.00 -0.16 1.72 4.64 -0.86 -1.49 113.55 118.07 1q8a h SER 529 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 1q8a h SER 529 Cb 0.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.38 1q8a h SER 529 CO 0.00 0.01 0.00 0.29 -0.87 0.00 0.00 176.83 176.26 1q8a n LYS 530 N -3.13 2.15 0.00 4.77 4.76 -0.59 -4.94 118.16 121.18 1q8a n LYS 530 Ca -0.01 -1.70 0.00 0.00 -2.87 0.00 0.00 58.31 53.73 1q8a n LYS 530 Cb 0.23 -1.47 0.00 0.00 -1.84 0.00 0.00 35.03 31.95 1q8a n LYS 530 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1q8a n GLY 531 N 1.32 0.82 3.67 0.72 0.00 -0.56 -3.63 105.19 107.53 1q8a n GLY 531 Ca 0.17 0.00 -0.52 0.00 0.00 0.00 0.00 46.02 45.67 1q8a n GLY 531 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1q8a n LEU 532 N 0.00 2.56 0.14 0.99 7.94 -0.50 -4.78 117.00 123.34 1q8a n LEU 532 Ca 0.00 1.06 0.10 0.00 -1.11 0.00 0.00 56.01 56.06 1q8a n LEU 532 Cb 0.00 -1.25 0.05 0.00 0.53 0.00 0.00 43.42 42.75 1q8a n LEU 532 CO 0.00 -0.48 0.29 0.28 -1.11 0.00 0.00 177.39 176.37 1q8a h SER 533 N 6.77 0.00 -5.59 1.96 0.02 -1.89 -3.43 113.55 111.40 1q8a h SER 533 Ca -0.47 0.00 0.25 0.00 -0.84 0.00 0.00 61.79 60.73 1q8a h SER 533 Cb 1.30 0.00 -0.08 0.00 0.14 0.00 0.00 62.40 63.77 1q8a h SER 533 CO 0.90 0.11 0.70 -0.94 -1.14 0.00 0.00 176.83 176.46 1q8a s SER 534 N -5.79 -0.05 -0.17 3.07 1.04 -0.97 -1.29 113.70 109.54 1q8a s SER 534 Ca 0.02 -0.37 -0.28 0.00 0.48 0.00 0.00 55.95 55.81 1q8a s SER 534 Cb 0.08 0.33 0.09 0.00 0.10 0.00 0.00 66.02 66.61 1q8a s SER 534 CO 0.75 -0.63 0.80 0.00 0.98 0.00 0.00 173.24 175.15 1q8a s ALA 535 N -2.44 -1.83 -0.16 5.32 0.00 -0.92 -3.69 121.76 118.05 1q8a s ALA 535 Ca 0.19 1.68 -0.19 0.00 0.00 0.00 0.00 51.96 53.64 1q8a s ALA 535 Cb 0.00 -0.72 -0.04 0.00 0.00 0.00 0.00 23.12 22.37 1q8a s ALA 535 CO 0.01 -0.33 0.53 0.42 0.00 0.00 0.00 175.76 176.39 1q8a s ILE 536 N -0.46 5.12 -0.40 0.00 1.01 0.12 -1.15 121.20 125.45 1q8a s ILE 536 Ca -0.04 1.03 -0.09 0.00 0.00 0.00 0.00 60.65 61.55 1q8a s ILE 536 Cb -0.02 -3.86 0.07 0.00 0.01 0.00 0.00 42.46 38.65 1q8a s ILE 536 CO 0.03 0.23 0.23 0.21 0.00 0.00 0.00 174.94 175.65 1q8a s ASN 538 N 0.92 5.61 0.00 3.58 2.47 -1.26 -1.69 114.94 124.56 1q8a s ASN 538 Ca 0.27 -1.40 0.24 0.00 0.42 0.00 0.00 52.86 52.38 1q8a s ASN 538 Cb -0.16 -1.98 1.17 0.00 -1.45 0.00 0.00 41.25 38.84 1q8a s ASN 538 CO 0.11 -0.49 1.79 -0.81 -3.72 0.00 0.00 177.10 173.97 1q8a n PRO 539 N 4.91 0.27 -0.05 0.43 -0.04 -1.26 -2.26 135.00 137.00 1q8a n PRO 539 Ca -0.10 0.07 0.12 0.00 -0.04 0.00 0.00 63.50 63.54 1q8a n PRO 539 Cb 0.43 -1.50 0.41 0.00 -0.04 0.00 0.00 33.50 32.80 1q8a n PRO 539 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1q8a n LEU 540 N -1.33 1.81 -4.49 1.53 4.77 -1.26 -4.67 117.00 113.35 1q8a n LEU 540 Ca 0.10 -0.69 -0.42 0.00 -0.03 0.00 0.00 56.01 54.97 1q8a n LEU 540 Cb 0.21 -0.07 -0.03 0.00 -2.33 0.00 0.00 43.42 41.20 1q8a n LEU 540 CO 0.19 0.35 1.00 -0.62 -1.33 0.00 0.00 177.39 176.97 1q8a s ASP 541 N -1.76 6.28 0.25 -1.43 -1.08 -0.96 -4.91 116.67 113.05 1q8a s ASP 541 Ca 0.35 -1.06 -0.06 0.00 -0.52 0.00 0.00 52.55 51.26 1q8a s ASP 541 Cb 0.19 -2.47 0.29 0.00 -1.46 0.00 0.00 42.92 39.47 1q8a s ASP 541 CO 0.30 -1.51 1.90 -0.08 0.52 0.00 0.00 175.17 176.30 1q8a h GLU 542 N 9.62 1.20 0.27 4.34 4.81 -1.89 -2.67 114.58 130.26 1q8a h GLU 542 Ca -0.16 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 58.99 1q8a h GLU 542 Cb 1.05 -0.27 0.00 0.00 0.63 0.00 0.00 28.75 30.16 1q8a h GLU 542 CO 1.23 0.79 -0.13 1.15 -0.73 0.00 0.00 179.01 181.32 1q8a h THR 543 N 1.23 0.74 0.00 0.32 2.02 -1.98 -0.63 112.91 114.61 1q8a h THR 543 Ca 0.38 -0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.55 1q8a h THR 543 Cb -0.03 0.74 0.00 0.00 -1.74 0.00 0.00 68.15 67.12 1q8a h THR 543 CO -0.11 0.00 0.00 -0.11 0.37 0.00 0.00 175.52 175.67 1q8a n LEU 544 N -5.24 0.00 0.00 2.58 7.94 -1.01 -0.76 117.00 120.50 1q8a n LEU 544 Ca -0.10 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.80 1q8a n LEU 544 Cb 0.16 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.11 1q8a n LEU 544 CO 0.35 0.00 0.00 0.29 -1.11 0.00 0.00 177.39 176.92 1q8a n LYS 546 N 0.02 0.00 0.14 1.96 5.02 -0.24 -1.25 118.16 123.81 1q8a n LYS 546 Ca 0.00 0.00 -0.01 0.00 -2.02 0.00 0.00 58.31 56.28 1q8a n LYS 546 Cb 0.00 0.00 0.21 0.00 -0.02 0.00 0.00 35.03 35.22 1q8a n LYS 546 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 1q8a h THR 547 N 0.00 1.40 0.00 -0.18 2.02 -1.18 -0.77 112.91 114.19 1q8a h THR 547 Ca 0.00 -1.91 -0.00 0.00 0.77 0.00 0.00 66.41 65.27 1q8a h THR 547 Cb 0.00 2.02 0.00 0.00 -1.74 0.00 0.00 68.15 68.43 1q8a h THR 547 CO 0.00 0.55 -0.00 0.25 0.37 0.00 0.00 175.52 176.69 1q8a h LEU 548 N 0.02 -0.00 -0.43 2.58 5.85 -1.40 -0.81 115.31 121.13 1q8a h LEU 548 Ca -0.00 -0.26 0.04 0.00 0.84 0.00 0.00 57.88 58.49 1q8a h LEU 548 Cb 0.99 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.99 1q8a h LEU 548 CO 0.07 0.26 0.20 -1.13 -0.34 0.00 0.00 178.44 177.50 1q8a h ASN 549 N -0.27 0.28 -0.88 1.25 -1.24 -1.78 -1.64 115.58 111.31 1q8a h ASN 549 Ca -0.00 0.03 0.06 0.00 0.71 0.00 0.00 56.30 57.10 1q8a h ASN 549 Cb 0.27 -0.02 -0.06 0.00 0.73 0.00 0.00 38.32 39.23 1q8a h ASN 549 CO 0.00 0.20 0.55 0.00 -1.29 0.00 0.00 177.43 176.89 1q8a h ALA 550 N 1.24 1.21 -0.54 1.57 0.00 -0.99 -1.45 119.26 120.29 1q8a h ALA 550 Ca 0.19 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1q8a h ALA 550 Cb 0.11 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 1q8a h ALA 550 CO -0.14 0.29 0.32 1.15 0.00 0.00 0.00 179.25 180.86 1q8a h THR 551 N 0.99 1.17 -0.67 0.00 2.02 -0.35 0.52 112.91 116.59 1q8a h THR 551 Ca 0.38 -0.40 -0.05 0.00 0.77 0.00 0.00 66.41 67.12 1q8a h THR 551 Cb 0.18 0.45 -0.03 0.00 -1.74 0.00 0.00 68.15 67.01 1q8a h THR 551 CO -0.18 0.18 0.22 -0.07 0.37 0.00 0.00 175.52 176.03 1q8a h LEU 552 N 0.73 0.95 0.17 2.58 3.38 -0.64 0.12 115.31 122.60 1q8a h LEU 552 Ca 0.19 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 1q8a h LEU 552 Cb 0.00 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.51 1q8a h LEU 552 CO -0.03 0.89 -0.08 0.58 0.09 0.00 0.00 178.44 179.88 1q8a h VAL 553 N 0.99 0.94 -0.69 1.22 2.07 -0.95 0.44 116.25 120.27 1q8a h VAL 553 Ca 0.22 -0.62 0.09 0.00 0.82 0.00 0.00 66.70 67.21 1q8a h VAL 553 Cb 0.27 1.31 -0.07 0.00 -1.52 0.00 0.00 31.29 31.29 1q8a h VAL 553 CO -0.01 0.14 0.35 0.40 0.02 0.00 0.00 177.57 178.47 1q8a h ILE 554 N -0.54 0.87 -0.09 4.57 2.04 -0.69 0.28 117.51 123.95 1q8a h ILE 554 Ca -0.02 -0.21 0.00 0.00 1.00 0.00 0.00 64.86 65.63 1q8a h ILE 554 Cb 0.41 0.21 0.00 0.00 -0.74 0.00 0.00 36.82 36.70 1q8a h ILE 554 CO 0.04 0.11 0.00 0.18 0.00 0.00 0.00 178.15 178.48 1q8a n LEU 555 N -4.86 0.52 -3.13 1.44 4.77 0.01 -4.89 117.00 110.87 1q8a n LEU 555 Ca 0.10 -0.26 -0.21 0.00 -0.03 0.00 0.00 56.01 55.61 1q8a n LEU 555 Cb 0.25 -0.07 0.06 0.00 -2.33 0.00 0.00 43.42 41.33 1q8a n LEU 555 CO 0.26 0.13 0.14 -0.62 -1.33 0.00 0.00 177.39 175.97 1q8a n GLU 556 N -0.22 -6.29 0.00 3.23 1.02 0.09 -4.90 120.64 113.57 1q8a n GLU 556 Ca 0.03 0.79 0.10 0.00 -0.02 0.00 0.00 57.16 58.06 1q8a n GLU 556 Cb 0.08 -5.58 -0.06 0.00 -0.02 0.00 0.00 31.44 25.87 1q8a n GLU 556 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1q8a n LYS 557 N -4.31 0.97 -3.81 3.49 5.02 0.15 -5.02 118.16 114.64 1q8a n LYS 557 Ca -0.03 -0.48 0.02 0.00 -2.02 0.00 0.00 58.31 55.80 1q8a n LYS 557 Cb 0.58 -1.42 0.01 0.00 -0.02 0.00 0.00 35.03 34.17 1q8a n LYS 557 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 1q8a s LYS 558 N -2.57 0.40 0.00 1.97 -2.85 -1.17 -4.97 119.74 110.55 1q8a s LYS 558 Ca 0.12 -0.25 0.00 0.00 -1.00 0.00 0.00 55.97 54.85 1q8a s LYS 558 Cb 0.16 0.12 0.00 0.00 -2.06 0.00 0.00 37.83 36.05 1q8a s LYS 558 CO 0.66 -0.19 0.15 -1.91 0.10 0.00 0.00 175.35 174.16