#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 5.37 0.49 0.55 2.20 -1.26 -4.61 114.94 117.68 1q8a s ASN 3 Ca 0.00 -0.39 0.16 0.00 -0.94 0.00 0.00 52.86 51.69 1q8a s ASN 3 Cb 0.00 -0.50 1.19 0.00 -2.00 0.00 0.00 41.25 39.94 1q8a s ASN 3 CO 0.00 -1.04 2.08 0.08 -2.94 0.00 0.00 177.10 175.28 1q8a h ARG 4 N 0.33 0.15 -0.33 3.55 0.11 -0.26 -1.70 114.38 116.24 1q8a h ARG 4 Ca -0.38 -0.01 -0.05 0.00 0.10 0.00 0.00 59.98 59.63 1q8a h ARG 4 Cb 1.28 -0.03 -0.01 0.00 1.11 0.00 0.00 29.97 32.32 1q8a h ARG 4 CO 0.46 0.10 -0.00 0.00 0.10 0.00 0.00 179.97 180.63 1q8a h ARG 5 N 0.16 0.58 -0.51 0.08 3.08 -1.95 -1.41 114.38 114.41 1q8a h ARG 5 Ca 0.12 -0.19 -0.02 0.00 0.07 0.00 0.00 59.98 59.97 1q8a h ARG 5 Cb 0.28 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.26 1q8a h ARG 5 CO -0.02 0.71 0.26 0.93 -1.07 0.00 0.00 179.97 180.78 1q8a h GLU 6 N 0.39 0.73 -0.48 0.04 5.08 -1.73 -1.41 114.58 117.20 1q8a h GLU 6 Ca 0.09 -0.10 -0.12 0.00 -1.00 0.00 0.00 59.36 58.23 1q8a h GLU 6 Cb 0.45 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 1q8a h GLU 6 CO 0.02 0.59 -0.18 0.28 -1.00 0.00 0.00 179.01 178.72 1q8a h VAL 7 N 0.68 1.27 -0.47 3.13 2.07 -1.34 -2.22 116.25 119.37 1q8a h VAL 7 Ca 0.18 -1.33 -0.01 0.00 0.82 0.00 0.00 66.70 66.35 1q8a h VAL 7 Cb 0.10 1.12 -0.02 0.00 -1.52 0.00 0.00 31.29 30.97 1q8a h VAL 7 CO -0.02 0.46 0.25 0.28 0.02 0.00 0.00 177.57 178.56 1q8a h SER 8 N 0.82 0.59 -0.65 0.57 0.02 -1.11 -0.67 113.55 113.12 1q8a h SER 8 Ca 0.11 -0.10 0.05 0.00 -0.84 0.00 0.00 61.79 61.02 1q8a h SER 8 Cb 0.75 -0.15 -0.05 0.00 0.14 0.00 0.00 62.40 63.09 1q8a h SER 8 CO 0.06 0.52 0.37 0.50 -1.14 0.00 0.00 176.83 177.14 1q8a h LYS 9 N 0.62 0.66 -0.33 3.45 1.63 -1.13 0.15 116.57 121.63 1q8a h LYS 9 Ca 0.16 -0.04 -0.03 0.00 -0.85 0.00 0.00 60.65 59.90 1q8a h LYS 9 Cb 0.06 -0.15 -0.01 0.00 -0.60 0.00 0.00 32.23 31.53 1q8a h LYS 9 CO -0.03 0.44 0.09 1.25 -3.45 0.00 0.00 179.45 177.76 1q8a h LEU 10 N 0.68 0.50 -1.11 5.20 5.85 -0.99 -2.70 115.31 122.74 1q8a h LEU 10 Ca 0.29 -0.22 -0.02 0.00 0.84 0.00 0.00 57.88 58.77 1q8a h LEU 10 Cb 0.16 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 1q8a h LEU 10 CO -0.17 0.59 0.33 -0.07 -0.34 0.00 0.00 178.44 178.78 1q8a h LEU 11 N 0.38 0.86 -1.85 2.25 3.38 -0.47 -1.21 115.31 118.66 1q8a h LEU 11 Ca 0.11 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 1q8a h LEU 11 Cb 0.27 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 1q8a h LEU 11 CO -0.00 0.73 -0.13 0.77 0.09 0.00 0.00 178.44 179.90 1q8a h SER 12 N 0.95 0.00 0.46 -0.43 4.64 -0.80 -2.70 113.55 115.68 1q8a h SER 12 Ca 0.24 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 61.25 1q8a h SER 12 Cb 0.09 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.17 1q8a h SER 12 CO -0.03 0.13 -1.52 -0.33 -0.87 0.00 0.00 176.83 174.21 1q8a h GLU 13 N 0.00 0.24 -2.07 4.77 5.08 -0.96 -3.40 114.58 118.24 1q8a h GLU 13 Ca -0.00 -0.42 -0.05 0.00 -1.00 0.00 0.00 59.36 57.90 1q8a h GLU 13 Cb 0.26 0.15 -0.19 0.00 0.50 0.00 0.00 28.75 29.48 1q8a h GLU 13 CO 0.02 1.11 0.22 -0.98 -1.00 0.00 0.00 179.01 178.37 1q8a s ARG 14 N -2.62 1.05 0.04 2.33 1.70 -0.56 -4.27 118.95 116.62 1q8a s ARG 14 Ca -0.09 0.18 -0.31 0.00 -0.47 0.00 0.00 55.73 55.05 1q8a s ARG 14 Cb 0.07 0.49 -0.06 0.00 -0.57 0.00 0.00 34.95 34.88 1q8a s ARG 14 CO 0.85 -0.34 1.41 0.08 -1.08 0.00 0.00 175.30 176.22 1q8a s VAL 15 N -1.44 3.56 0.20 4.99 1.01 -0.07 -4.38 120.40 124.25 1q8a s VAL 15 Ca -0.09 1.02 0.05 0.00 0.00 0.00 0.00 61.98 62.96 1q8a s VAL 15 Cb -0.00 -3.65 -0.04 0.00 0.00 0.00 0.00 36.38 32.69 1q8a s VAL 15 CO 0.07 0.03 0.21 -0.76 0.00 0.00 0.00 175.10 174.65 1q8a s LEU 16 N 1.96 3.97 -0.20 3.92 1.43 -0.36 -4.74 118.68 124.67 1q8a s LEU 16 Ca 0.65 -0.08 -0.08 0.00 -1.03 0.00 0.00 54.13 53.59 1q8a s LEU 16 Cb -0.34 -2.54 -0.04 0.00 0.03 0.00 0.00 46.19 43.30 1q8a s LEU 16 CO 0.28 0.02 0.07 -0.22 0.23 0.00 0.00 176.35 176.73 1q8a s LEU 17 N -3.44 3.81 0.00 1.79 2.96 -1.26 -1.33 118.68 121.21 1q8a s LEU 17 Ca 0.32 0.06 0.00 0.00 -0.22 0.00 0.00 54.13 54.29 1q8a s LEU 17 Cb -0.09 -1.98 0.00 0.00 0.50 0.00 0.00 46.19 44.62 1q8a s LEU 17 CO 0.25 0.14 0.00 0.18 -1.32 0.00 0.00 176.35 175.61 1q8a n LEU 18 N 3.76 0.00 0.00 -0.68 4.77 0.36 -0.22 117.00 124.99 1q8a n LEU 18 Ca -0.16 0.00 -0.16 0.00 -0.03 0.00 0.00 56.01 55.66 1q8a n LEU 18 Cb 0.52 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.64 1q8a n LEU 18 CO 0.35 -0.33 0.16 -0.90 -1.33 0.00 0.00 177.39 175.34 1q8a n ASP 19 N -1.97 1.82 -0.95 -1.43 3.85 -1.18 -4.53 116.55 112.16 1q8a n ASP 19 Ca 0.00 -2.18 0.00 0.00 -0.71 0.00 0.00 54.79 51.90 1q8a n ASP 19 Cb 0.00 -0.17 0.00 0.00 -1.35 0.00 0.00 41.12 39.60 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 0.25 1.51 3.86 6.12 0.00 -1.26 -1.43 105.19 114.24 1q8a n GLY 20 Ca 0.05 -1.79 -0.31 0.00 0.00 0.00 0.00 46.02 43.97 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 -3.22 3.16 -0.03 4.61 0.00 -1.19 -4.72 121.76 120.37 1q8a s ALA 21 Ca 0.00 0.03 -0.05 0.00 0.00 0.00 0.00 51.96 51.94 1q8a s ALA 21 Cb 0.00 -2.98 -0.03 0.00 0.00 0.00 0.00 23.12 20.11 1q8a s ALA 21 CO 0.00 -0.21 -0.11 0.66 0.00 0.00 0.00 175.76 176.10 1q8a n TYR 22 N -1.61 0.00 -0.18 0.00 4.01 -1.26 -4.45 117.16 113.67 1q8a n TYR 22 Ca 0.05 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.68 1q8a n TYR 22 Cb 0.54 -0.22 -0.07 0.00 -0.31 0.00 0.00 39.34 39.29 1q8a n TYR 22 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1q8a h GLY 23 N -0.31 -0.72 2.00 2.72 0.00 -1.99 0.15 103.07 104.91 1q8a h GLY 23 Ca -0.08 0.64 -0.04 0.00 0.00 0.00 0.00 47.33 47.84 1q8a h GLY 23 CO -0.05 -0.13 -0.19 -0.91 0.00 0.00 0.00 176.54 175.25 1q8a h THR 24 N -0.30 0.80 -0.05 4.70 1.35 -1.95 -2.98 112.91 114.48 1q8a h THR 24 Ca 0.13 -0.77 -0.05 0.00 -0.55 0.00 0.00 66.41 65.17 1q8a h THR 24 Cb 0.57 1.46 0.00 0.00 -1.73 0.00 0.00 68.15 68.46 1q8a h THR 24 CO -0.65 0.19 -0.16 -0.33 -0.25 0.00 0.00 175.52 174.32 1q8a h GLU 25 N 0.00 0.19 -1.69 4.72 4.39 -1.27 -1.96 114.58 118.96 1q8a h GLU 25 Ca -0.00 -0.14 0.00 0.00 0.34 0.00 0.00 59.36 59.56 1q8a h GLU 25 Cb 0.44 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.12 1q8a h GLU 25 CO 0.03 0.77 0.00 1.19 -1.16 0.00 0.00 179.01 179.84 1q8a n PHE 26 N -4.60 0.00 0.00 4.33 0.99 0.34 -1.46 117.46 117.06 1q8a n PHE 26 Ca -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.37 1q8a n PHE 26 Cb 0.40 -0.08 0.00 0.00 -1.00 0.00 0.00 39.48 38.80 1q8a n PHE 26 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.76 177.93 1q8a n LYS 28 N 0.90 0.00 -0.08 -1.08 4.81 -0.74 -1.81 118.16 120.16 1q8a n LYS 28 Ca 0.00 0.00 0.03 0.00 -0.87 0.00 0.00 58.31 57.47 1q8a n LYS 28 Cb 0.00 0.00 0.11 0.00 0.02 0.00 0.00 35.03 35.16 1q8a n LYS 28 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1q8a n TYR 29 N 0.00 0.22 -0.10 5.64 0.53 -0.53 -4.89 117.16 118.03 1q8a n TYR 29 Ca 0.00 -0.11 0.00 0.00 -1.02 0.00 0.00 57.90 56.77 1q8a n TYR 29 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 39.34 38.31 1q8a n TYR 29 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1q8a n GLY 30 N 0.79 1.49 3.62 2.72 0.00 -1.17 -5.01 105.19 107.62 1q8a n GLY 30 Ca 0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.65 2.99 -1.45 1.61 1.51 -0.75 -4.87 117.35 113.73 1q8a s TYR 31 Ca 0.00 0.93 0.22 0.00 -1.01 0.00 0.00 57.07 57.21 1q8a s TYR 31 Cb 0.00 -4.04 0.02 0.00 -0.11 0.00 0.00 41.96 37.83 1q8a s TYR 31 CO 0.00 -1.01 1.08 -0.40 -1.11 0.00 0.00 175.55 174.11 1q8a n ASP 32 N 7.32 1.33 -4.40 2.29 5.68 -1.26 -4.80 116.55 122.71 1q8a n ASP 32 Ca 0.11 -1.10 -0.30 0.00 -0.50 0.00 0.00 54.79 53.01 1q8a n ASP 32 Cb 0.48 0.65 0.23 0.00 -1.14 0.00 0.00 41.12 41.34 1q8a n ASP 32 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1q8a n ASP 33 N -0.88 -1.99 -4.75 -1.12 8.00 -1.26 -4.87 116.55 109.69 1q8a n ASP 33 Ca 0.07 -0.14 -0.41 0.00 0.71 0.00 0.00 54.79 55.02 1q8a n ASP 33 Cb 0.38 -1.15 -0.02 0.00 -0.02 0.00 0.00 41.12 40.31 1q8a n ASP 33 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1q8a s LEU 34 N -4.93 4.40 0.31 0.64 2.01 -1.26 -4.87 118.68 114.98 1q8a s LEU 34 Ca 0.64 2.60 0.07 0.00 0.01 0.00 0.00 54.13 57.45 1q8a s LEU 34 Cb -0.20 -3.62 0.79 0.00 0.01 0.00 0.00 46.19 43.16 1q8a s LEU 34 CO 0.66 -0.62 1.76 1.55 1.01 0.00 0.00 176.35 180.70 1q8a h PRO 35 N 4.79 0.67 -0.02 1.29 0.13 -1.94 -0.48 132.00 136.44 1q8a h PRO 35 Ca -0.46 -0.04 -0.02 0.00 -0.87 0.00 0.00 66.00 64.61 1q8a h PRO 35 Cb 1.22 -0.15 -0.00 0.00 0.13 0.00 0.00 31.00 32.19 1q8a h PRO 35 CO 0.75 0.44 -0.10 0.93 -0.23 0.00 0.00 178.00 179.80 1q8a h GLU 36 N 0.69 0.03 0.00 0.86 3.07 -1.90 -1.15 114.58 116.18 1q8a h GLU 36 Ca 0.60 -0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 59.45 1q8a h GLU 36 Cb 1.02 -0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.93 1q8a h GLU 36 CO -0.42 0.12 -0.05 0.93 -1.40 0.00 0.00 179.01 178.19 1q8a h GLU 37 N 0.03 0.00 0.00 2.33 5.08 -1.44 -2.65 114.58 117.93 1q8a h GLU 37 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1q8a h GLU 37 Cb 0.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.44 1q8a h GLU 37 CO 0.01 0.05 0.00 -0.07 -1.00 0.00 0.00 179.01 178.00 1q8a h LEU 38 N 0.00 0.00 -2.07 1.33 3.38 -1.22 0.14 115.31 116.86 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 0.44 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.19 1q8a h LEU 38 CO 0.01 0.00 -0.05 0.78 0.09 0.00 0.00 178.44 179.26 1q8a h ASN 39 N 0.00 0.00 0.00 -0.43 2.35 -1.61 -0.31 115.58 115.57 1q8a h ASN 39 Ca 0.00 0.00 -0.31 0.00 -0.55 0.00 0.00 56.30 55.44 1q8a h ASN 39 Cb 0.29 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.61 1q8a h ASN 39 CO 0.00 0.05 -2.11 -0.38 -1.65 0.00 0.00 177.43 173.34 1q8a n ILE 40 N -3.32 1.11 0.10 2.81 5.41 -0.47 -4.45 119.36 120.56 1q8a n ILE 40 Ca -0.01 -0.37 -0.00 0.00 1.00 0.00 0.00 62.75 63.36 1q8a n ILE 40 Cb 0.21 -1.41 -0.03 0.00 -0.71 0.00 0.00 39.64 37.71 1q8a n ILE 40 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.55 177.05 1q8a h LYS 41 N -0.28 0.00 -0.69 0.38 3.64 -1.00 -3.40 116.57 115.22 1q8a h LYS 41 Ca -0.46 0.00 -0.33 0.00 -1.27 0.00 0.00 60.65 58.59 1q8a h LYS 41 Cb 1.58 0.00 -0.23 0.00 -0.41 0.00 0.00 32.23 33.17 1q8a h LYS 41 CO -0.16 0.59 -0.70 0.00 -2.27 0.00 0.00 179.45 176.90 1q8a n ALA 42 N -2.29 0.08 0.29 5.00 0.00 -0.20 -4.98 120.51 118.41 1q8a n ALA 42 Ca -0.01 -2.12 0.14 0.00 0.00 0.00 0.00 53.44 51.45 1q8a n ALA 42 Cb 0.81 -1.11 0.85 0.00 0.00 0.00 0.00 19.45 20.00 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 3.35 0.00 -0.23 0.00 0.13 -1.58 -1.73 132.00 131.95 1q8a h PRO 43 Ca -0.05 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.02 1q8a h PRO 43 Cb 1.03 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.14 1q8a h PRO 43 CO 0.30 0.01 -0.14 -0.44 -0.23 0.00 0.00 178.00 177.50 1q8a h ASP 44 N 0.00 0.36 0.48 1.44 3.45 -1.94 -0.94 116.42 119.27 1q8a h ASP 44 Ca -0.00 -0.09 -0.21 0.00 0.43 0.00 0.00 57.03 57.17 1q8a h ASP 44 Cb 0.03 -0.10 -0.01 0.00 -0.56 0.00 0.00 39.33 38.70 1q8a h ASP 44 CO 0.00 0.53 -0.89 1.62 -1.57 0.00 0.00 179.24 178.94 1q8a h VAL 45 N 0.35 1.46 -0.40 -1.35 3.04 -1.66 -1.54 116.25 116.15 1q8a h VAL 45 Ca 0.07 -2.53 -0.05 0.00 -1.01 0.00 0.00 66.70 63.18 1q8a h VAL 45 Cb 0.46 2.43 -0.02 0.00 -2.01 0.00 0.00 31.29 32.16 1q8a h VAL 45 CO 0.03 0.75 0.07 0.58 -1.01 0.00 0.00 177.57 177.98 1q8a h VAL 46 N 0.16 1.24 -0.67 1.51 2.07 -1.48 -2.04 116.25 117.03 1q8a h VAL 46 Ca -0.06 -0.85 0.04 0.00 0.82 0.00 0.00 66.70 66.65 1q8a h VAL 46 Cb 1.52 1.03 -0.05 0.00 -1.52 0.00 0.00 31.29 32.27 1q8a h VAL 46 CO 0.14 0.29 0.41 0.25 0.02 0.00 0.00 177.57 178.68 1q8a h LEU 47 N 0.50 0.65 -0.39 2.57 5.85 -1.05 -2.21 115.31 121.23 1q8a h LEU 47 Ca 0.12 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 1q8a h LEU 47 Cb 0.36 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 1q8a h LEU 47 CO 0.01 0.44 0.22 0.50 -0.34 0.00 0.00 178.44 179.26 1q8a h LYS 48 N 0.78 0.54 -0.24 1.25 3.64 -1.06 -0.92 116.57 120.56 1q8a h LYS 48 Ca 0.28 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.59 1q8a h LYS 48 Cb 0.08 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.78 1q8a h LYS 48 CO -0.13 0.43 0.09 0.28 -2.27 0.00 0.00 179.45 177.85 1q8a h VAL 49 N 0.50 1.17 -0.43 2.00 2.07 -1.16 -0.35 116.25 120.07 1q8a h VAL 49 Ca 0.14 -0.53 0.05 0.00 0.82 0.00 0.00 66.70 67.18 1q8a h VAL 49 Cb 0.05 1.07 -0.04 0.00 -1.52 0.00 0.00 31.29 30.85 1q8a h VAL 49 CO -0.02 0.17 0.17 0.45 0.02 0.00 0.00 177.57 178.37 1q8a h HIS 50 N 0.24 0.32 -0.91 1.57 3.86 -1.30 -2.34 115.15 116.59 1q8a h HIS 50 Ca 0.08 0.02 0.03 0.00 -1.16 0.00 0.00 60.37 59.34 1q8a h HIS 50 Cb 0.19 -0.08 -0.05 0.00 1.06 0.00 0.00 27.41 28.53 1q8a h HIS 50 CO -0.01 0.14 0.60 0.00 0.86 0.00 0.00 177.93 179.51 1q8a h ARG 51 N 0.36 1.14 -0.60 2.45 3.08 -0.70 -1.15 114.38 118.95 1q8a h ARG 51 Ca 0.19 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.17 1q8a h ARG 51 Cb 0.15 -0.26 -0.03 0.00 0.08 0.00 0.00 29.97 29.92 1q8a h ARG 51 CO -0.17 0.75 0.34 0.66 -1.07 0.00 0.00 179.97 180.48 1q8a h SER 52 N 1.17 0.73 -0.23 7.04 4.64 -0.56 0.24 113.55 126.58 1q8a h SER 52 Ca 0.36 -0.05 -0.15 0.00 -0.47 0.00 0.00 61.79 61.48 1q8a h SER 52 Cb -0.04 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 61.87 1q8a h SER 52 CO -0.11 0.58 -0.43 1.88 -0.87 0.00 0.00 176.83 177.89 1q8a h TYR 53 N 0.83 0.88 -0.52 4.77 0.99 -0.97 -1.21 116.97 121.75 1q8a h TYR 53 Ca 0.21 -0.31 0.03 0.00 2.00 0.00 0.00 58.73 60.66 1q8a h TYR 53 Cb 0.01 -0.17 -0.04 0.00 1.00 0.00 0.00 36.73 37.54 1q8a h TYR 53 CO 0.00 1.09 0.31 0.82 -0.00 0.00 0.00 178.16 180.38 1q8a h ILE 54 N 0.42 1.05 -0.44 -2.88 1.08 -0.66 -1.93 117.51 114.14 1q8a h ILE 54 Ca 0.01 -0.21 -0.05 0.00 -0.39 0.00 0.00 64.86 64.23 1q8a h ILE 54 Cb 1.03 0.38 -0.02 0.00 -3.07 0.00 0.00 36.82 35.14 1q8a h ILE 54 CO 0.10 0.11 0.08 -0.08 -0.69 0.00 0.00 178.15 177.67 1q8a h GLU 55 N 0.61 0.67 0.00 2.37 4.22 -0.91 -2.15 114.58 119.39 1q8a h GLU 55 Ca 0.21 -0.13 0.00 0.00 0.08 0.00 0.00 59.36 59.52 1q8a h GLU 55 Cb 0.03 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.18 1q8a h GLU 55 CO -0.10 0.63 0.00 0.43 -2.18 0.00 0.00 179.01 177.79 1q8a n SER 56 N -4.29 0.00 0.00 1.04 7.64 -0.46 -4.89 113.62 112.66 1q8a n SER 56 Ca 0.03 0.24 0.00 0.00 1.01 0.00 0.00 58.87 60.15 1q8a n SER 56 Cb 0.22 -0.40 0.00 0.00 -1.01 0.00 0.00 64.21 63.03 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 0.72 1.13 3.76 0.23 0.00 -0.81 -3.64 105.19 106.58 1q8a n GLY 57 Ca 0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 1q8a n GLY 57 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1q8a s SER 58 N -1.03 6.43 0.04 1.61 0.01 -0.77 -4.76 113.70 115.24 1q8a s SER 58 Ca 0.00 2.93 0.22 0.00 1.31 0.00 0.00 55.95 60.42 1q8a s SER 58 Cb 0.00 -2.65 -0.16 0.00 0.21 0.00 0.00 66.02 63.42 1q8a s SER 58 CO 0.00 -0.85 0.78 0.47 0.41 0.00 0.00 173.24 174.05 1q8a n ASP 59 N 1.47 0.42 -3.88 2.44 8.00 0.69 -4.68 116.55 121.02 1q8a n ASP 59 Ca 0.05 -0.07 -0.13 0.00 0.71 0.00 0.00 54.79 55.34 1q8a n ASP 59 Cb 0.39 1.28 -0.14 0.00 -0.02 0.00 0.00 41.12 42.62 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 -3.36 0.09 0.12 2.53 1.01 -0.87 -1.65 120.40 118.27 1q8a s VAL 60 Ca -0.02 -0.02 0.07 0.00 0.00 0.00 0.00 61.98 62.01 1q8a s VAL 60 Cb 0.13 -0.10 -0.04 0.00 0.00 0.00 0.00 36.38 36.37 1q8a s VAL 60 CO 0.85 0.04 -0.17 0.27 0.00 0.00 0.00 175.10 176.09 1q8a s ILE 61 N 0.12 1.57 -0.10 2.22 -4.36 -0.41 -3.09 121.20 117.15 1q8a s ILE 61 Ca -0.01 -1.69 -0.07 0.00 -0.26 0.00 0.00 60.65 58.63 1q8a s ILE 61 Cb -0.02 -1.59 -0.04 0.00 1.25 0.00 0.00 42.46 42.06 1q8a s ILE 61 CO -0.00 -0.27 0.16 -0.76 0.24 0.00 0.00 174.94 174.31 1q8a s LEU 62 N -2.29 4.39 0.57 0.37 1.43 -1.26 -1.00 118.68 120.89 1q8a s LEU 62 Ca 0.09 0.47 -0.18 0.00 -1.03 0.00 0.00 54.13 53.48 1q8a s LEU 62 Cb -0.07 -2.18 -0.04 0.00 0.03 0.00 0.00 46.19 43.93 1q8a s LEU 62 CO 0.04 0.38 1.09 0.42 0.23 0.00 0.00 176.35 178.52 1q8a s THR 63 N -1.08 3.45 -1.43 5.49 -4.23 -0.57 -4.88 115.64 112.39 1q8a s THR 63 Ca 0.17 0.79 -0.12 0.00 -1.18 0.00 0.00 61.69 61.36 1q8a s THR 63 Cb -0.12 -3.29 0.06 0.00 1.34 0.00 0.00 72.50 70.48 1q8a s THR 63 CO 0.07 -0.30 2.24 -3.20 -0.54 0.00 0.00 174.62 172.88 1q8a n ASN 64 N -1.69 4.90 -0.34 3.99 5.15 -1.26 -4.32 115.26 121.69 1q8a n ASN 64 Ca 0.10 -2.88 0.01 0.00 -0.60 0.00 0.00 54.58 51.21 1q8a n ASN 64 Cb 0.52 -1.59 0.01 0.00 -0.53 0.00 0.00 39.78 38.19 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 4.36 0.21 -0.32 -0.44 -2.24 -1.26 -4.50 114.28 110.09 1q8a n THR 65 Ca 0.53 -0.24 0.12 0.00 -2.27 0.00 0.00 64.05 62.18 1q8a n THR 65 Cb 0.36 0.53 0.30 0.00 -2.10 0.00 0.00 70.33 69.42 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 0.82 -0.65 4.78 3.04 -1.76 0.80 116.94 123.97 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 1.25 -0.22 0.00 0.00 2.56 0.00 0.00 35.95 39.54 1q8a h PHE 66 CO 0.07 0.09 0.00 0.41 -2.02 0.00 0.00 178.31 176.86 1q8a n GLY 67 N -1.33 2.28 2.84 2.40 0.00 -1.26 -1.46 105.19 108.66 1q8a n GLY 67 Ca 0.22 -0.75 -0.42 0.00 0.00 0.00 0.00 46.02 45.06 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 1.31 5.41 -2.27 4.61 0.00 0.27 -4.08 120.51 125.78 1q8a n ALA 68 Ca 0.23 -4.26 -0.13 0.00 0.00 0.00 0.00 53.44 49.28 1q8a n ALA 68 Cb 0.67 -3.05 -0.10 0.00 0.00 0.00 0.00 19.45 16.97 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 0.71 0.95 -0.43 0.00 -4.23 -1.26 -4.87 115.64 106.51 1q8a s THR 69 Ca 0.40 -1.94 0.00 0.00 -1.18 0.00 0.00 61.69 58.98 1q8a s THR 69 Cb 0.10 -1.69 0.00 0.00 1.34 0.00 0.00 72.50 72.25 1q8a s THR 69 CO -0.01 -0.76 0.00 -1.14 -0.54 0.00 0.00 174.62 172.18 1q8a n ARG 70 N 0.00 0.00 0.00 3.99 0.63 -1.26 -1.43 116.66 118.59 1q8a n ARG 70 Ca -0.12 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.81 1q8a n ARG 70 Cb 0.60 -1.10 0.00 0.00 0.45 0.00 0.00 32.46 32.41 1q8a n ARG 70 CO 0.00 0.00 0.00 1.17 -2.51 0.00 0.00 177.63 176.29 1q8a n LYS 72 N 0.64 0.00 0.14 -0.14 4.81 -1.26 -1.66 118.16 120.69 1q8a n LYS 72 Ca 0.00 0.00 0.04 0.00 -0.87 0.00 0.00 58.31 57.48 1q8a n LYS 72 Cb 0.00 0.00 0.43 0.00 0.02 0.00 0.00 35.03 35.48 1q8a n LYS 72 CO 0.00 0.00 0.00 -0.07 1.17 0.00 0.00 177.40 178.50 1q8a h LEU 73 N 0.00 0.19 -1.82 3.14 3.38 -1.39 -2.26 115.31 116.55 1q8a h LEU 73 Ca 0.00 -0.03 0.05 0.00 0.09 0.00 0.00 57.88 57.99 1q8a h LEU 73 Cb 0.00 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 1q8a h LEU 73 CO 0.00 0.31 0.22 -0.09 0.09 0.00 0.00 178.44 178.97 1q8a h ARG 74 N 0.20 0.23 0.00 1.13 2.43 -1.56 0.50 114.38 117.31 1q8a h ARG 74 Ca 0.04 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 1q8a h ARG 74 Cb 0.29 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 1q8a h ARG 74 CO 0.02 0.15 0.00 1.63 -1.51 0.00 0.00 179.97 180.26 1q8a n LYS 75 N -4.48 0.08 -0.01 0.20 5.02 -0.85 -2.23 118.16 115.88 1q8a n LYS 75 Ca 0.04 0.18 0.00 0.00 -2.02 0.00 0.00 58.31 56.51 1q8a n LYS 75 Cb 0.23 -1.50 0.01 0.00 -0.02 0.00 0.00 35.03 33.75 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 -1.44 0.02 -1.80 2.13 8.25 0.05 -5.00 115.22 117.44 1q8a n HIS 76 Ca 0.05 -0.30 -0.11 0.00 -0.26 0.00 0.00 57.72 57.11 1q8a n HIS 76 Cb 0.18 -0.03 -0.02 0.00 1.12 0.00 0.00 29.99 31.24 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 -0.22 0.49 0.25 -1.41 0.00 -0.84 -4.92 105.19 98.53 1q8a n GLY 77 Ca 0.01 -0.49 0.08 0.00 0.00 0.00 0.00 46.02 45.62 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 -1.38 2.64 0.26 0.99 4.77 -0.49 -4.74 117.00 119.05 1q8a n LEU 78 Ca -0.12 -2.90 0.10 0.00 -0.03 0.00 0.00 56.01 53.06 1q8a n LEU 78 Cb 0.49 -0.39 0.69 0.00 -2.33 0.00 0.00 43.42 41.87 1q8a n LEU 78 CO 0.15 0.68 1.02 1.05 -1.33 0.00 0.00 177.39 178.96 1q8a h GLU 79 N 0.44 0.00 0.00 3.23 4.11 -1.87 0.36 114.58 120.85 1q8a h GLU 79 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1q8a h GLU 79 Cb 1.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.27 1q8a h GLU 79 CO 0.04 0.07 0.00 -0.25 0.07 0.00 0.00 179.01 178.95 1q8a n ASP 80 N -4.16 0.10 -1.18 3.06 10.43 -1.26 -1.90 116.55 121.64 1q8a n ASP 80 Ca -0.03 0.52 0.11 0.00 2.57 0.00 0.00 54.79 57.97 1q8a n ASP 80 Cb 0.16 -0.54 0.24 0.00 1.84 0.00 0.00 41.12 42.82 1q8a n ASP 80 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 1q8a n LYS 81 N -1.60 2.56 -0.03 -1.24 4.76 0.12 -4.58 118.16 118.14 1q8a n LYS 81 Ca 0.04 -2.38 -0.09 0.00 -2.87 0.00 0.00 58.31 53.01 1q8a n LYS 81 Cb 0.20 -1.51 -0.02 0.00 -1.84 0.00 0.00 35.03 31.86 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 4.23 -0.76 0.34 -0.35 5.85 -1.42 -1.08 115.31 122.11 1q8a h LEU 82 Ca 0.00 0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 1q8a h LEU 82 Cb 0.96 0.35 -0.01 0.00 0.37 0.00 0.00 40.66 42.34 1q8a h LEU 82 CO 0.00 -0.28 -0.23 -0.78 -0.34 0.00 0.00 178.44 176.80 1q8a h ASP 83 N -0.27 -0.59 0.11 1.25 3.58 -1.83 -1.69 116.42 116.98 1q8a h ASP 83 Ca 0.12 0.04 -0.07 0.00 0.42 0.00 0.00 57.03 57.54 1q8a h ASP 83 Cb 0.46 0.18 -0.01 0.00 1.72 0.00 0.00 39.33 41.68 1q8a h ASP 83 CO -0.35 -0.36 -0.23 1.55 -2.88 0.00 0.00 179.24 176.96 1q8a h PRO 84 N -0.56 0.23 0.07 0.28 0.13 -1.85 -0.78 132.00 129.51 1q8a h PRO 84 Ca -0.03 -0.07 -0.00 0.00 -0.87 0.00 0.00 66.00 65.03 1q8a h PRO 84 Cb 0.48 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.59 1q8a h PRO 84 CO 0.02 0.45 -0.03 0.82 -0.23 0.00 0.00 178.00 179.03 1q8a h ILE 85 N 0.21 1.00 -0.14 -3.56 2.04 -1.01 -1.11 117.51 114.94 1q8a h ILE 85 Ca 0.04 -0.22 -0.07 0.00 1.00 0.00 0.00 64.86 65.61 1q8a h ILE 85 Cb 0.53 1.14 -0.00 0.00 -0.74 0.00 0.00 36.82 37.75 1q8a h ILE 85 CO 0.04 0.05 -0.19 0.58 0.00 0.00 0.00 178.15 178.63 1q8a h VAL 86 N -0.19 1.36 -0.67 1.67 2.07 -1.18 -1.65 116.25 117.66 1q8a h VAL 86 Ca -0.01 -1.40 -0.06 0.00 0.82 0.00 0.00 66.70 66.06 1q8a h VAL 86 Cb 0.16 1.96 -0.03 0.00 -1.52 0.00 0.00 31.29 31.86 1q8a h VAL 86 CO 0.02 0.41 0.20 0.03 0.02 0.00 0.00 177.57 178.24 1q8a h ARG 87 N -0.03 1.04 -0.73 1.57 3.08 -1.17 -1.70 114.38 116.45 1q8a h ARG 87 Ca 0.02 -0.23 -0.04 0.00 0.07 0.00 0.00 59.98 59.79 1q8a h ARG 87 Cb 0.74 -0.15 -0.03 0.00 0.08 0.00 0.00 29.97 30.61 1q8a h ARG 87 CO 0.04 0.92 0.30 -0.91 -1.07 0.00 0.00 179.97 179.25 1q8a h ASN 88 N 0.98 1.00 -0.52 7.04 4.21 -1.23 -1.37 115.58 125.68 1q8a h ASN 88 Ca 0.21 -0.14 -0.00 0.00 1.21 0.00 0.00 56.30 57.58 1q8a h ASN 88 Cb 0.32 -0.26 -0.03 0.00 -1.12 0.00 0.00 38.32 37.23 1q8a h ASN 88 CO -0.00 0.88 0.32 0.00 -1.29 0.00 0.00 177.43 177.34 1q8a h ALA 89 N 1.26 0.67 -0.40 -0.83 0.00 -0.79 -0.25 119.26 118.92 1q8a h ALA 89 Ca 0.25 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 55.01 1q8a h ALA 89 Cb 0.20 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1q8a h ALA 89 CO -0.02 0.14 -0.10 0.28 0.00 0.00 0.00 179.25 179.55 1q8a h VAL 90 N 0.70 1.28 -0.62 0.00 2.07 -1.11 -1.06 116.25 117.51 1q8a h VAL 90 Ca 0.19 -1.20 -0.00 0.00 0.82 0.00 0.00 66.70 66.51 1q8a h VAL 90 Cb -0.03 1.23 -0.03 0.00 -1.52 0.00 0.00 31.29 30.94 1q8a h VAL 90 CO -0.04 0.40 0.37 0.03 0.02 0.00 0.00 177.57 178.36 1q8a h ARG 91 N 0.59 0.84 -0.29 1.57 3.08 -0.87 -0.13 114.38 119.17 1q8a h ARG 91 Ca 0.10 -0.08 -0.04 0.00 0.07 0.00 0.00 59.98 60.03 1q8a h ARG 91 Cb 0.63 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.49 1q8a h ARG 91 CO 0.04 0.60 0.02 0.82 -1.07 0.00 0.00 179.97 180.38 1q8a h ILE 92 N 0.83 1.25 -0.78 2.04 2.04 -1.00 -1.83 117.51 120.07 1q8a h ILE 92 Ca 0.22 -0.87 -0.04 0.00 1.00 0.00 0.00 64.86 65.17 1q8a h ILE 92 Cb -0.02 1.26 -0.03 0.00 -0.74 0.00 0.00 36.82 37.28 1q8a h ILE 92 CO -0.04 0.28 0.31 0.00 0.00 0.00 0.00 178.15 178.70 1q8a h ALA 93 N 0.85 1.01 -0.76 1.87 0.00 -0.97 -1.89 119.26 119.38 1q8a h ALA 93 Ca 0.08 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 1q8a h ALA 93 Cb 0.39 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 1q8a h ALA 93 CO 0.01 0.64 0.29 -0.09 0.00 0.00 0.00 179.25 180.10 1q8a h ARG 94 N 1.13 1.13 -0.66 0.00 9.65 -0.91 0.39 114.38 125.11 1q8a h ARG 94 Ca 0.26 -0.21 -0.06 0.00 -1.10 0.00 0.00 59.98 58.88 1q8a h ARG 94 Cb 0.21 -0.18 -0.03 0.00 -1.39 0.00 0.00 29.97 28.58 1q8a h ARG 94 CO -0.02 0.92 0.18 -0.09 2.80 0.00 0.00 179.97 183.76 1q8a h ARG 95 N 1.10 1.03 -0.05 0.20 2.43 -0.85 -3.02 114.38 115.22 1q8a h ARG 95 Ca 0.25 -0.22 -0.18 0.00 -0.81 0.00 0.00 59.98 59.02 1q8a h ARG 95 Cb 0.22 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.62 1q8a h ARG 95 CO -0.02 0.90 -0.74 0.00 -1.51 0.00 0.00 179.97 178.59 1q8a h ALA 96 N 1.21 0.63 0.00 2.80 0.00 -0.69 -3.34 119.26 119.87 1q8a h ALA 96 Ca 0.21 -0.62 -0.08 0.00 0.00 0.00 0.00 54.91 54.42 1q8a h ALA 96 Cb 0.31 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1q8a h ALA 96 CO -0.00 0.79 -0.38 0.00 0.00 0.00 0.00 179.25 179.65 1q8a h ALA 97 N 0.99 1.26 -0.64 0.00 0.00 -0.81 -3.44 119.26 116.62 1q8a h ALA 97 Ca -0.03 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1q8a h ALA 97 Cb 1.32 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1q8a h ALA 97 CO 0.12 0.48 0.00 0.41 0.00 0.00 0.00 179.25 180.26 1q8a n GLY 98 N -0.29 3.52 0.67 0.00 0.00 -1.22 -0.70 105.19 107.17 1q8a n GLY 98 Ca -0.02 -0.09 0.13 0.00 0.00 0.00 0.00 46.02 46.05 1q8a n GLY 98 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1q8a n GLU 99 N 13.28 1.87 -1.23 1.61 1.02 -1.26 -4.96 120.64 130.98 1q8a n GLU 99 Ca 0.00 -1.34 -0.29 0.00 -0.02 0.00 0.00 57.16 55.50 1q8a n GLU 99 Cb 0.00 -1.47 0.15 0.00 -0.02 0.00 0.00 31.44 30.10 1q8a n GLU 99 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1q8a s LYS 100 N -2.05 1.02 0.31 3.49 3.01 0.12 -5.00 119.74 120.63 1q8a s LYS 100 Ca 0.32 0.69 -0.27 0.00 -1.01 0.00 0.00 55.97 55.70 1q8a s LYS 100 Cb 0.20 -1.79 -0.10 0.00 -1.01 0.00 0.00 37.83 35.13 1q8a s LYS 100 CO 0.34 -2.37 0.95 -0.51 0.51 0.00 0.00 175.35 174.27 1q8a s LEU 101 N -6.27 4.40 -0.18 3.17 1.43 -0.66 -4.90 118.68 115.68 1q8a s LEU 101 Ca 0.64 1.87 0.01 0.00 -1.03 0.00 0.00 54.13 55.61 1q8a s LEU 101 Cb -0.18 -3.93 0.03 0.00 0.03 0.00 0.00 46.19 42.14 1q8a s LEU 101 CO 0.57 -0.03 -0.16 -0.69 0.23 0.00 0.00 176.35 176.27 1q8a s VAL 102 N -1.53 1.84 -0.15 -1.59 1.01 -1.26 -1.29 120.40 117.43 1q8a s VAL 102 Ca 0.48 -0.91 -0.04 0.00 0.00 0.00 0.00 61.98 61.51 1q8a s VAL 102 Cb -0.20 -1.75 -0.03 0.00 0.00 0.00 0.00 36.38 34.40 1q8a s VAL 102 CO 0.26 0.41 -0.02 -0.36 0.00 0.00 0.00 175.10 175.38 1q8a s PHE 103 N 1.36 3.06 0.05 5.22 0.08 -0.17 -0.14 117.98 127.44 1q8a s PHE 103 Ca 0.03 -0.21 -0.31 0.00 0.12 0.00 0.00 56.93 56.57 1q8a s PHE 103 Cb -0.14 -1.96 -0.06 0.00 -0.57 0.00 0.00 43.02 40.29 1q8a s PHE 103 CO -0.11 0.03 1.26 0.20 -0.10 0.00 0.00 175.22 176.51 1q8a s GLY 104 N 0.26 2.21 -0.26 4.36 0.00 0.64 -1.51 107.32 113.01 1q8a s GLY 104 Ca -0.02 0.88 -0.09 0.00 0.00 0.00 0.00 44.72 45.49 1q8a s GLY 104 CO 0.02 2.19 0.13 -0.35 0.00 0.00 0.00 173.10 175.10 1q8a s ASP 105 N 1.24 5.65 -0.10 1.64 2.15 -1.26 -0.81 116.67 125.17 1q8a s ASP 105 Ca 0.60 -0.08 0.01 0.00 0.43 0.00 0.00 52.55 53.51 1q8a s ASP 105 Cb -0.31 -2.03 0.02 0.00 -0.30 0.00 0.00 42.92 40.30 1q8a s ASP 105 CO 0.28 -0.03 -0.11 -0.63 -0.17 0.00 0.00 175.17 174.51 1q8a s ILE 106 N 1.59 1.22 0.49 4.11 1.01 -0.22 -3.60 121.20 125.80 1q8a s ILE 106 Ca 0.07 -0.46 0.08 0.00 0.00 0.00 0.00 60.65 60.33 1q8a s ILE 106 Cb -0.15 -1.16 0.03 0.00 0.01 0.00 0.00 42.46 41.19 1q8a s ILE 106 CO 0.07 0.39 0.56 -0.83 0.00 0.00 0.00 174.94 175.13 1q8a s GLY 107 N 1.18 2.01 0.86 6.18 0.00 -0.53 -0.95 107.32 116.07 1q8a s GLY 107 Ca -0.04 -1.80 -0.12 0.00 0.00 0.00 0.00 44.72 42.76 1q8a s GLY 107 CO -0.03 -1.68 1.10 2.56 0.00 0.00 0.00 173.10 175.05 1q8a s PRO 108 N -4.38 1.53 0.33 2.90 0.04 -1.26 -4.92 135.00 129.24 1q8a s PRO 108 Ca 0.52 0.65 0.21 0.00 0.04 0.00 0.00 61.00 62.42 1q8a s PRO 108 Cb -0.05 -1.85 0.18 0.00 0.04 0.00 0.00 34.50 32.81 1q8a s PRO 108 CO 0.31 -2.01 1.38 1.79 0.04 0.00 0.00 177.00 178.51 1q8a h THR 109 N -1.37 0.14 0.00 1.26 1.35 -1.98 -3.48 112.91 108.83 1q8a h THR 109 Ca -0.49 -1.21 0.00 0.00 -0.55 0.00 0.00 66.41 64.16 1q8a h THR 109 Cb 1.29 1.91 0.00 0.00 -1.73 0.00 0.00 68.15 69.62 1q8a h THR 109 CO 0.58 0.08 0.00 0.61 -0.25 0.00 0.00 175.52 176.54 1q8a n GLY 110 N 1.16 0.75 3.46 5.82 0.00 -1.26 -4.53 105.19 110.58 1q8a n GLY 110 Ca 0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.53 3.63 0.42 1.61 0.41 -1.26 -5.11 118.70 117.88 1q8a s GLU 111 Ca 0.00 -0.52 -0.23 0.00 -0.41 0.00 0.00 54.97 53.81 1q8a s GLU 111 Cb 0.00 -3.01 -0.09 0.00 -1.78 0.00 0.00 34.13 29.25 1q8a s GLU 111 CO 0.00 0.10 1.02 -0.51 -0.49 0.00 0.00 175.26 175.38 1q8a s LEU 112 N 0.76 4.04 0.61 1.80 1.43 -1.26 -4.99 118.68 121.06 1q8a s LEU 112 Ca -0.01 1.93 -0.16 0.00 -1.03 0.00 0.00 54.13 54.86 1q8a s LEU 112 Cb -0.14 -4.34 -0.02 0.00 0.03 0.00 0.00 46.19 41.71 1q8a s LEU 112 CO 0.02 -0.52 1.10 -2.16 0.23 0.00 0.00 176.35 175.02 1q8a s PRO 113 N -2.79 3.08 0.39 1.29 0.04 -1.26 -3.46 135.00 132.28 1q8a s PRO 113 Ca 0.61 1.38 -0.27 0.00 0.04 0.00 0.00 61.00 62.76 1q8a s PRO 113 Cb -0.18 -1.99 -0.09 0.00 0.04 0.00 0.00 34.50 32.28 1q8a s PRO 113 CO 0.22 -1.03 1.31 -0.47 0.04 0.00 0.00 177.00 177.08 1q8a s TYR 114 N -2.24 2.86 -1.84 0.56 5.04 0.20 -0.23 117.35 121.70 1q8a s TYR 114 Ca 0.67 1.40 0.29 0.00 -2.44 0.00 0.00 57.07 56.99 1q8a s TYR 114 Cb -0.20 -3.69 1.21 0.00 0.35 0.00 0.00 41.96 39.63 1q8a s TYR 114 CO 0.37 -2.07 1.84 -0.35 -1.34 0.00 0.00 175.55 173.99 1q8a n PRO 115 N 0.29 0.90 0.19 4.97 -0.04 -1.26 -4.57 135.00 135.49 1q8a n PRO 115 Ca 0.03 -0.36 0.04 0.00 -0.04 0.00 0.00 63.50 63.16 1q8a n PRO 115 Cb 0.43 -1.49 0.39 0.00 -0.04 0.00 0.00 33.50 32.79 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 0.89 0.00 0.00 1.53 3.38 -1.28 -3.45 115.31 116.39 1q8a h LEU 116 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1q8a h LEU 116 Cb 0.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.11 1q8a h LEU 116 CO 0.00 0.36 0.00 0.61 0.09 0.00 0.00 178.44 179.50 1q8a n GLY 117 N -0.35 5.44 0.00 0.83 0.00 0.68 -4.90 105.19 106.90 1q8a n GLY 117 Ca -0.02 -1.45 0.00 0.00 0.00 0.00 0.00 46.02 44.56 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 1.66 -4.72 1.61 3.41 -1.24 -3.88 113.62 110.46 1q8a n SER 118 Ca 0.00 -1.74 -0.38 0.00 -0.26 0.00 0.00 58.87 56.49 1q8a n SER 118 Cb 0.00 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 63.89 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 -0.74 5.14 0.31 6.66 2.01 -1.24 -4.68 115.64 123.10 1q8a s THR 119 Ca 0.00 1.10 -0.06 0.00 0.31 0.00 0.00 61.69 63.03 1q8a s THR 119 Cb 0.00 -3.88 -0.06 0.00 0.01 0.00 0.00 72.50 68.57 1q8a s THR 119 CO 0.00 0.31 0.59 -0.76 -0.69 0.00 0.00 174.62 174.07 1q8a s LEU 120 N 0.66 4.02 0.25 4.42 1.43 -1.26 -0.63 118.68 127.57 1q8a s LEU 120 Ca 0.29 0.81 -0.07 0.00 -1.03 0.00 0.00 54.13 54.13 1q8a s LEU 120 Cb -0.16 -3.63 0.44 0.00 0.03 0.00 0.00 46.19 42.87 1q8a s LEU 120 CO 0.13 -0.22 1.64 0.15 0.23 0.00 0.00 176.35 178.27 1q8a h PHE 121 N 1.66 -0.01 -0.84 0.29 3.57 -1.94 -1.33 116.94 118.33 1q8a h PHE 121 Ca -0.47 0.05 0.10 0.00 3.53 0.00 0.00 57.97 61.18 1q8a h PHE 121 Cb 1.19 0.12 -0.06 0.00 2.79 0.00 0.00 35.95 39.99 1q8a h PHE 121 CO 0.58 -0.22 0.55 1.49 -2.23 0.00 0.00 178.31 178.48 1q8a h GLU 122 N 0.12 0.77 -0.41 1.11 4.57 -1.98 -0.43 114.58 118.33 1q8a h GLU 122 Ca 0.41 -0.05 -0.13 0.00 -1.18 0.00 0.00 59.36 58.42 1q8a h GLU 122 Cb 0.73 -0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 29.13 1q8a h GLU 122 CO -0.64 0.51 -0.26 1.49 -1.18 0.00 0.00 179.01 178.93 1q8a h GLU 123 N 0.80 0.86 -0.45 1.92 4.81 -1.64 -1.28 114.58 119.61 1q8a h GLU 123 Ca 0.39 -0.38 -0.05 0.00 -0.13 0.00 0.00 59.36 59.20 1q8a h GLU 123 Cb 0.45 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.79 1q8a h GLU 123 CO -0.16 1.02 0.09 0.74 -0.73 0.00 0.00 179.01 179.97 1q8a h PHE 124 N 0.74 0.77 -0.13 0.92 0.05 -1.25 -1.86 116.94 116.18 1q8a h PHE 124 Ca 0.09 -0.10 0.02 0.00 3.82 0.00 0.00 57.97 61.80 1q8a h PHE 124 Cb 0.81 -0.21 -0.02 0.00 2.00 0.00 0.00 35.95 38.53 1q8a h PHE 124 CO 0.05 0.72 0.02 -0.92 -0.18 0.00 0.00 178.31 178.00 1q8a h TYR 125 N 0.59 0.04 -0.02 -0.55 3.20 -0.84 -1.07 116.97 118.32 1q8a h TYR 125 Ca 0.14 0.01 -0.08 0.00 3.14 0.00 0.00 58.73 61.94 1q8a h TYR 125 Cb 0.35 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.61 1q8a h TYR 125 CO 0.02 0.01 -0.35 0.93 -1.64 0.00 0.00 178.16 177.13 1q8a h GLU 126 N 0.07 0.03 0.16 1.82 5.08 -1.17 -0.83 114.58 119.74 1q8a h GLU 126 Ca 0.06 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 1q8a h GLU 126 Cb 0.05 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1q8a h GLU 126 CO -0.08 0.38 -0.08 -0.97 -1.00 0.00 0.00 179.01 177.26 1q8a h ASN 127 N 0.03 -0.18 -0.17 1.42 -1.24 -0.63 -2.85 115.58 111.95 1q8a h ASN 127 Ca 0.00 -0.08 -0.15 0.00 0.71 0.00 0.00 56.30 56.78 1q8a h ASN 127 Cb 0.64 0.05 -0.01 0.00 0.73 0.00 0.00 38.32 39.73 1q8a h ASN 127 CO 0.05 -0.03 -0.41 -0.26 -1.29 0.00 0.00 177.43 175.48 1q8a h PHE 128 N -0.33 0.86 -0.45 0.67 0.04 -1.06 -3.20 116.94 113.47 1q8a h PHE 128 Ca -0.02 -0.26 0.08 0.00 2.80 0.00 0.00 57.97 60.57 1q8a h PHE 128 Cb 0.26 -0.18 -0.06 0.00 2.20 0.00 0.00 35.95 38.16 1q8a h PHE 128 CO -0.03 1.01 0.07 -0.09 -0.60 0.00 0.00 178.31 178.66 1q8a h ARG 129 N 0.58 0.19 -0.49 1.51 2.43 -1.10 -1.35 114.38 116.14 1q8a h ARG 129 Ca 0.04 -0.01 0.07 0.00 -0.81 0.00 0.00 59.98 59.28 1q8a h ARG 129 Cb 0.96 -0.04 -0.06 0.00 -0.42 0.00 0.00 29.97 30.40 1q8a h ARG 129 CO 0.09 0.12 0.15 1.49 -1.51 0.00 0.00 179.97 180.31 1q8a h GLU 130 N 0.19 0.30 -0.38 0.20 4.81 -1.50 -0.21 114.58 117.99 1q8a h GLU 130 Ca 0.22 -0.02 -0.11 0.00 -0.13 0.00 0.00 59.36 59.32 1q8a h GLU 130 Cb 0.30 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.60 1q8a h GLU 130 CO -0.31 0.20 -0.20 1.15 -0.73 0.00 0.00 179.01 179.12 1q8a h THR 131 N 0.31 1.28 -0.68 0.32 2.02 -1.48 -2.93 112.91 111.75 1q8a h THR 131 Ca 0.24 -1.33 0.01 0.00 0.77 0.00 0.00 66.41 66.10 1q8a h THR 131 Cb 0.28 1.33 -0.04 0.00 -1.74 0.00 0.00 68.15 67.99 1q8a h THR 131 CO -0.27 0.44 0.45 0.58 0.37 0.00 0.00 175.52 177.09 1q8a h VAL 132 N 0.60 1.16 -0.44 3.16 2.07 -0.96 -2.57 116.25 119.26 1q8a h VAL 132 Ca 0.08 -0.31 0.07 0.00 0.82 0.00 0.00 66.70 67.36 1q8a h VAL 132 Cb 0.75 0.17 -0.06 0.00 -1.52 0.00 0.00 31.29 30.63 1q8a h VAL 132 CO 0.06 0.17 0.10 -0.33 0.02 0.00 0.00 177.57 177.59 1q8a h GLU 133 N 0.91 0.24 -1.07 1.57 5.08 -0.94 0.03 114.58 120.40 1q8a h GLU 133 Ca 0.26 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.60 1q8a h GLU 133 Cb -0.08 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.12 1q8a h GLU 133 CO -0.07 0.16 0.00 -0.89 -1.00 0.00 0.00 179.01 177.21 1q8a n ILE 134 N -5.08 0.05 0.00 3.13 5.41 -0.97 -1.44 119.36 120.46 1q8a n ILE 134 Ca 0.04 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.79 1q8a n ILE 134 Cb 0.20 -0.31 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 0.72 0.00 -0.24 1.39 0.31 -0.00 -1.80 118.33 118.71 1q8a n VAL 136 Ca 0.00 0.00 -0.02 0.00 -0.01 0.00 0.00 64.34 64.31 1q8a n VAL 136 Cb 0.04 0.00 0.09 0.00 -0.91 0.00 0.00 33.84 33.06 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 0.77 0.00 5.55 5.08 -1.49 -2.46 114.58 122.03 1q8a h GLU 137 Ca 0.00 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 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 0.51 0.00 0.93 -1.00 0.00 0.00 179.01 179.45 1q8a h GLU 138 N 0.79 0.00 -0.90 2.33 4.39 -1.62 -3.48 114.58 116.09 1q8a h GLU 138 Ca 0.30 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.00 1q8a h GLU 138 Cb 0.10 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.75 1q8a h GLU 138 CO -0.14 0.00 0.00 0.41 -1.16 0.00 0.00 179.01 178.12 1q8a n GLY 139 N 0.96 -0.23 3.67 -3.84 0.00 -0.93 -4.92 105.19 99.91 1q8a n GLY 139 Ca 0.04 -0.53 -0.23 0.00 0.00 0.00 0.00 46.02 45.31 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 -0.18 3.51 -2.42 1.61 -7.23 -1.26 -5.01 120.40 109.42 1q8a s VAL 140 Ca 0.00 -1.84 0.22 0.00 -1.81 0.00 0.00 61.98 58.55 1q8a s VAL 140 Cb 0.00 -2.91 0.43 0.00 0.56 0.00 0.00 36.38 34.46 1q8a s VAL 140 CO 0.00 -0.36 1.49 0.47 -0.31 0.00 0.00 175.10 176.39 1q8a n ASP 141 N -0.95 2.34 0.00 4.85 10.43 0.81 -4.62 116.55 129.42 1q8a n ASP 141 Ca -0.06 -1.81 0.00 0.00 2.57 0.00 0.00 54.79 55.49 1q8a n ASP 141 Cb 0.59 -0.13 0.00 0.00 1.84 0.00 0.00 41.12 43.42 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 1.27 1.33 2.99 0.44 0.00 -1.22 -4.33 105.19 105.67 1q8a n GLY 142 Ca 0.17 -0.90 -0.22 0.00 0.00 0.00 0.00 46.02 45.07 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 0.90 -0.09 -0.61 1.01 0.44 -0.26 121.20 120.58 1q8a s ILE 143 Ca 0.00 -0.37 0.03 0.00 0.00 0.00 0.00 60.65 60.32 1q8a s ILE 143 Cb 0.00 -0.83 0.01 0.00 0.01 0.00 0.00 42.46 41.65 1q8a s ILE 143 CO 0.00 0.29 -0.20 -0.51 0.00 0.00 0.00 174.94 174.53 1q8a s ILE 144 N 0.56 1.75 -0.51 2.92 2.07 0.01 -0.77 121.20 127.22 1q8a s ILE 144 Ca -0.10 -0.83 -0.17 0.00 -1.41 0.00 0.00 60.65 58.14 1q8a s ILE 144 Cb -0.13 -1.54 0.09 0.00 0.13 0.00 0.00 42.46 41.02 1q8a s ILE 144 CO 0.02 0.49 0.50 -0.36 -1.91 0.00 0.00 174.94 173.68 1q8a s PHE 145 N 0.53 3.19 0.11 3.50 0.40 -0.10 -1.05 117.98 124.56 1q8a s PHE 145 Ca -0.16 -1.01 -0.10 0.00 -0.60 0.00 0.00 56.93 55.06 1q8a s PHE 145 Cb -0.17 -3.54 -0.06 0.00 0.51 0.00 0.00 43.02 39.76 1q8a s PHE 145 CO 0.06 -0.96 0.43 -1.21 0.70 0.00 0.00 175.22 174.24 1q8a s GLU 146 N 1.87 3.77 -1.63 0.44 2.02 -0.12 -0.86 118.70 124.19 1q8a s GLU 146 Ca 0.06 0.19 0.00 0.00 0.02 0.00 0.00 54.97 55.24 1q8a s GLU 146 Cb -0.26 -2.93 0.00 0.00 0.10 0.00 0.00 34.13 31.04 1q8a s GLU 146 CO 0.06 0.51 0.00 2.41 0.02 0.00 0.00 175.26 178.26 1q8a n THR 147 N 0.67 -0.67 -2.43 3.63 -1.04 -1.26 -4.03 114.28 109.14 1q8a n THR 147 Ca -0.06 0.00 -0.39 0.00 -2.04 0.00 0.00 64.05 61.56 1q8a n THR 147 Cb 0.52 -2.46 -0.03 0.00 -1.82 0.00 0.00 70.33 66.53 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 -2.85 3.32 -0.27 -1.42 0.40 -1.16 -4.56 117.98 111.44 1q8a s PHE 148 Ca 0.00 1.63 0.08 0.00 -0.60 0.00 0.00 56.93 58.05 1q8a s PHE 148 Cb 0.00 -3.28 -0.10 0.00 0.51 0.00 0.00 43.02 40.14 1q8a s PHE 148 CO 0.00 -0.83 0.30 0.43 0.70 0.00 0.00 175.22 175.81 1q8a n SER 149 N 0.49 1.23 -4.05 1.36 7.64 -1.26 -1.07 113.62 117.96 1q8a n SER 149 Ca 0.02 -0.48 -0.23 0.00 1.01 0.00 0.00 58.87 59.19 1q8a n SER 149 Cb 0.47 1.12 -0.16 0.00 -1.01 0.00 0.00 64.21 64.63 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 -2.15 1.65 0.31 6.43 2.15 -1.26 -2.96 116.67 120.84 1q8a s ASP 150 Ca 0.01 -0.27 0.13 0.00 0.43 0.00 0.00 52.55 52.85 1q8a s ASP 150 Cb 0.06 -0.54 0.50 0.00 -0.30 0.00 0.00 42.92 42.64 1q8a s ASP 150 CO 0.34 0.08 1.68 0.16 -0.17 0.00 0.00 175.17 177.27 1q8a h ILE 151 N 5.50 1.30 -0.35 4.11 3.07 -1.94 -2.00 117.51 127.21 1q8a h ILE 151 Ca -0.33 -1.82 -0.10 0.00 1.55 0.00 0.00 64.86 64.16 1q8a h ILE 151 Cb 1.17 2.00 -0.01 0.00 -0.27 0.00 0.00 36.82 39.72 1q8a h ILE 151 CO 0.48 0.51 -0.19 0.25 -1.05 0.00 0.00 178.15 178.15 1q8a h LEU 152 N 0.00 0.76 -0.70 0.16 5.85 -1.94 0.13 115.31 119.57 1q8a h LEU 152 Ca -0.01 -0.41 -0.09 0.00 0.84 0.00 0.00 57.88 58.21 1q8a h LEU 152 Cb 0.96 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.76 1q8a h LEU 152 CO 0.07 1.01 0.02 -0.08 -0.34 0.00 0.00 178.44 179.11 1q8a h GLU 153 N 0.52 1.02 -0.26 1.25 4.81 -1.95 -0.58 114.58 119.39 1q8a h GLU 153 Ca 0.07 -0.31 -0.14 0.00 -0.13 0.00 0.00 59.36 58.86 1q8a h GLU 153 Cb 0.73 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.00 1q8a h GLU 153 CO 0.05 0.99 -0.42 1.25 -0.73 0.00 0.00 179.01 180.15 1q8a h LEU 154 N 0.94 0.67 -0.75 1.64 5.85 -1.27 -1.73 115.31 120.65 1q8a h LEU 154 Ca 0.17 -0.30 -0.06 0.00 0.84 0.00 0.00 57.88 58.53 1q8a h LEU 154 Cb 0.52 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.33 1q8a h LEU 154 CO 0.03 1.00 0.23 0.50 -0.34 0.00 0.00 178.44 179.85 1q8a h LYS 155 N 0.51 1.17 -0.69 1.25 3.64 -0.42 -1.42 116.57 120.59 1q8a h LYS 155 Ca 0.04 -0.26 -0.02 0.00 -1.27 0.00 0.00 60.65 59.14 1q8a h LYS 155 Cb 0.94 -0.17 -0.03 0.00 -0.41 0.00 0.00 32.23 32.56 1q8a h LYS 155 CO 0.08 0.99 0.34 0.00 -2.27 0.00 0.00 179.45 178.60 1q8a h ALA 156 N 1.12 0.89 -0.18 5.00 0.00 -0.89 -1.43 119.26 123.78 1q8a h ALA 156 Ca 0.24 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1q8a h ALA 156 Cb 0.32 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1q8a h ALA 156 CO -0.01 0.44 0.08 0.00 0.00 0.00 0.00 179.25 179.76 1q8a h ALA 157 N 1.16 0.23 -0.36 0.00 0.00 -0.88 -0.84 119.26 118.57 1q8a h ALA 157 Ca 0.24 -0.09 -0.13 0.00 0.00 0.00 0.00 54.91 54.92 1q8a h ALA 157 Cb 0.10 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1q8a h ALA 157 CO -0.03 -0.20 -0.30 -0.39 0.00 0.00 0.00 179.25 178.33 1q8a h VAL 158 N 0.14 1.28 -0.55 0.00 -1.51 -1.15 -1.25 116.25 113.21 1q8a h VAL 158 Ca 0.06 -1.44 -0.08 0.00 -1.23 0.00 0.00 66.70 64.01 1q8a h VAL 158 Cb 0.15 1.32 -0.02 0.00 -2.13 0.00 0.00 31.29 30.61 1q8a h VAL 158 CO -0.01 0.48 0.02 0.25 -1.23 0.00 0.00 177.57 177.08 1q8a h LEU 159 N 0.65 0.93 -0.84 4.19 7.12 -1.21 -1.17 115.31 124.98 1q8a h LEU 159 Ca 0.08 -0.30 -0.03 0.00 0.13 0.00 0.00 57.88 57.76 1q8a h LEU 159 Cb 0.83 -0.25 -0.04 0.00 -0.53 0.00 0.00 40.66 40.67 1q8a h LEU 159 CO 0.07 1.00 0.41 0.00 -0.13 0.00 0.00 178.44 179.79 1q8a h ALA 160 N 0.97 1.08 -0.31 1.25 0.00 -0.92 -2.04 119.26 119.29 1q8a h ALA 160 Ca 0.16 -0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 1q8a h ALA 160 Cb 0.51 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1q8a h ALA 160 CO 0.02 0.64 -0.19 0.00 0.00 0.00 0.00 179.25 179.73 1q8a h ALA 161 N 1.22 0.44 0.00 0.00 0.00 -0.94 -2.90 119.26 117.08 1q8a h ALA 161 Ca 0.29 -0.35 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 1q8a h ALA 161 Cb 0.11 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1q8a h ALA 161 CO -0.04 0.37 -0.27 -0.09 0.00 0.00 0.00 179.25 179.22 1q8a h ARG 162 N 0.43 0.00 0.00 0.00 9.65 -1.14 -1.26 114.38 122.06 1q8a h ARG 162 Ca 0.06 0.00 -0.11 0.00 -1.10 0.00 0.00 59.98 58.83 1q8a h ARG 162 Cb 0.73 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 29.29 1q8a h ARG 162 CO 0.05 0.27 -0.53 0.93 2.80 0.00 0.00 179.97 183.49 1q8a h GLU 163 N 0.00 0.00 -0.01 0.20 5.08 -1.27 -3.12 114.58 115.46 1q8a h GLU 163 Ca -0.00 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 1q8a h GLU 163 Cb 0.58 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.83 1q8a h GLU 163 CO 0.04 0.53 -0.11 0.28 -1.00 0.00 0.00 179.01 178.75 1q8a h VAL 164 N 0.00 1.54 -3.30 3.13 2.07 -1.23 -3.46 116.25 115.01 1q8a h VAL 164 Ca -0.01 -1.75 -0.28 0.00 0.82 0.00 0.00 66.70 65.48 1q8a h VAL 164 Cb 1.14 2.67 -0.34 0.00 -1.52 0.00 0.00 31.29 33.24 1q8a h VAL 164 CO 0.07 0.47 -0.65 -0.55 0.02 0.00 0.00 177.57 176.93 1q8a s SER 165 N -6.09 0.21 0.02 0.57 0.15 -0.52 -4.99 113.70 103.05 1q8a s SER 165 Ca -0.17 0.22 0.26 0.00 0.70 0.00 0.00 55.95 56.97 1q8a s SER 165 Cb 0.00 0.11 0.73 0.00 -1.71 0.00 0.00 66.02 65.15 1q8a s SER 165 CO 0.71 -0.17 1.58 0.54 1.20 0.00 0.00 173.24 177.10 1q8a n ARG 166 N 4.51 0.04 -0.00 5.44 5.12 -1.24 -4.01 116.66 126.51 1q8a n ARG 166 Ca -0.21 0.02 0.10 0.00 -1.93 0.00 0.00 57.85 55.83 1q8a n ARG 166 Cb 0.51 -1.53 -0.14 0.00 -1.16 0.00 0.00 32.46 30.14 1q8a n ARG 166 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 1q8a n ASP 167 N -1.58 0.62 -4.77 0.55 10.43 -1.26 -4.97 116.55 115.57 1q8a n ASP 167 Ca 0.06 -0.62 -0.38 0.00 2.57 0.00 0.00 54.79 56.42 1q8a n ASP 167 Cb 0.35 1.38 -0.06 0.00 1.84 0.00 0.00 41.12 44.63 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 -3.20 4.07 -0.03 2.53 0.11 -1.26 0.46 120.40 123.09 1q8a s VAL 168 Ca 0.02 1.88 -0.30 0.00 -2.93 0.00 0.00 61.98 60.65 1q8a s VAL 168 Cb 0.15 -4.12 -0.04 0.00 -1.53 0.00 0.00 36.38 30.85 1q8a s VAL 168 CO 0.88 0.30 1.20 0.12 -3.33 0.00 0.00 175.10 174.27 1q8a s PHE 169 N -1.41 3.24 -0.13 1.54 5.36 -1.26 -4.66 117.98 120.66 1q8a s PHE 169 Ca 0.46 1.23 0.02 0.00 -0.96 0.00 0.00 56.93 57.68 1q8a s PHE 169 Cb -0.23 -3.42 -0.00 0.00 -0.34 0.00 0.00 43.02 39.03 1q8a s PHE 169 CO 0.29 -1.30 -0.19 -0.51 -1.46 0.00 0.00 175.22 172.05 1q8a s LEU 170 N 1.94 2.33 -0.10 6.12 1.43 -1.26 -0.42 118.68 128.72 1q8a s LEU 170 Ca 0.57 -0.50 0.03 0.00 -1.03 0.00 0.00 54.13 53.20 1q8a s LEU 170 Cb -0.26 -1.51 -0.01 0.00 0.03 0.00 0.00 46.19 44.45 1q8a s LEU 170 CO 0.24 0.11 -0.21 -0.63 0.23 0.00 0.00 176.35 176.09 1q8a s ILE 171 N 0.63 2.35 -0.14 -0.59 1.01 0.05 -0.67 121.20 123.84 1q8a s ILE 171 Ca -0.10 -0.92 0.00 0.00 0.00 0.00 0.00 60.65 59.63 1q8a s ILE 171 Cb -0.16 -1.92 -0.00 0.00 0.01 0.00 0.00 42.46 40.39 1q8a s ILE 171 CO 0.03 0.55 -0.16 0.00 0.00 0.00 0.00 174.94 175.37 1q8a s ALA 172 N 0.21 2.49 0.00 9.38 0.00 -0.73 -0.92 121.76 132.19 1q8a s ALA 172 Ca -0.13 -1.00 0.00 0.00 0.00 0.00 0.00 51.96 50.83 1q8a s ALA 172 Cb -0.16 -1.18 0.00 0.00 0.00 0.00 0.00 23.12 21.77 1q8a s ALA 172 CO 0.07 0.06 0.00 0.72 0.00 0.00 0.00 175.76 176.61 1q8a n HIS 173 N 3.90 0.00 -3.82 0.00 8.25 -0.04 -0.95 115.22 122.56 1q8a n HIS 173 Ca -0.19 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.15 1q8a n HIS 173 Cb 0.52 0.00 -0.13 0.00 1.12 0.00 0.00 29.99 31.51 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 -0.55 -0.00 0.13 1.59 -1.32 -0.23 -3.00 115.64 112.26 1q8a s THR 175 Ca 0.00 0.00 0.10 0.00 -1.21 0.00 0.00 61.69 60.59 1q8a s THR 175 Cb 0.00 -0.22 -0.04 0.00 -1.51 0.00 0.00 72.50 70.72 1q8a s THR 175 CO 0.00 0.00 -0.23 -0.36 -2.21 0.00 0.00 174.62 171.82 1q8a s PHE 176 N 0.11 2.40 0.21 9.09 0.40 -1.26 -4.41 117.98 124.52 1q8a s PHE 176 Ca -0.00 -0.33 -0.02 0.00 -0.60 0.00 0.00 56.93 55.97 1q8a s PHE 176 Cb -0.01 -1.28 0.05 0.00 0.51 0.00 0.00 43.02 42.28 1q8a s PHE 176 CO 0.00 0.37 0.29 -0.40 0.70 0.00 0.00 175.22 176.18 1q8a n ASP 177 N 0.80 0.15 0.30 1.36 5.68 0.11 -4.59 116.55 120.37 1q8a n ASP 177 Ca -0.17 -1.18 0.20 0.00 -0.50 0.00 0.00 54.79 53.14 1q8a n ASP 177 Cb 0.53 -0.21 0.97 0.00 -1.14 0.00 0.00 41.12 41.28 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 -0.12 0.11 9.09 -1.93 -0.98 114.58 120.75 1q8a h GLU 178 Ca -0.09 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.32 1q8a h GLU 178 Cb 0.29 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.39 1q8a h GLU 178 CO 0.08 0.00 0.00 1.63 0.05 0.00 0.00 179.01 180.77 1q8a n LYS 179 N -3.00 1.85 -2.30 1.06 5.02 -1.26 -4.92 118.16 114.61 1q8a n LYS 179 Ca -0.01 -1.26 -0.05 0.00 -2.02 0.00 0.00 58.31 54.96 1q8a n LYS 179 Cb 0.15 -1.44 0.00 0.00 -0.02 0.00 0.00 35.03 33.72 1q8a n LYS 179 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1q8a n GLY 180 N 1.21 0.32 3.13 0.72 0.00 -0.37 -5.05 105.19 105.15 1q8a n GLY 180 Ca 0.17 -0.62 -0.22 0.00 0.00 0.00 0.00 46.02 45.35 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 -4.57 1.10 0.83 1.61 0.52 -1.26 -4.09 118.95 113.10 1q8a s ARG 181 Ca 0.04 -0.62 -0.12 0.00 -0.52 0.00 0.00 55.73 54.50 1q8a s ARG 181 Cb -0.02 -1.09 0.10 0.00 0.52 0.00 0.00 34.95 34.46 1q8a s ARG 181 CO 0.05 0.29 1.19 -1.54 0.02 0.00 0.00 175.30 175.31 1q8a s SER 182 N -0.66 4.28 0.35 0.23 1.04 -0.03 -0.71 113.70 118.20 1q8a s SER 182 Ca 0.04 0.73 0.07 0.00 0.48 0.00 0.00 55.95 57.28 1q8a s SER 182 Cb -0.07 -1.18 0.77 0.00 0.10 0.00 0.00 66.02 65.65 1q8a s SER 182 CO 0.00 -2.04 1.89 0.25 0.98 0.00 0.00 173.24 174.32 1q8a h LEU 183 N -1.15 0.68 -3.46 2.42 5.85 -1.79 -1.75 115.31 116.11 1q8a h LEU 183 Ca -0.46 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.29 1q8a h LEU 183 Cb 1.32 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.24 1q8a h LEU 183 CO 0.63 0.38 0.00 0.35 -0.34 0.00 0.00 178.44 179.46 1q8a n THR 184 N -4.53 2.54 -0.00 1.05 -2.24 -1.19 -4.95 114.28 104.96 1q8a n THR 184 Ca 0.15 -1.37 0.00 0.00 -2.27 0.00 0.00 64.05 60.56 1q8a n THR 184 Cb 0.38 -0.18 0.00 0.00 -2.10 0.00 0.00 70.33 68.44 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 0.72 0.94 3.72 3.38 0.00 -0.66 -3.87 105.19 109.43 1q8a n GLY 185 Ca 0.27 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.90 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 5.01 0.44 2.61 2.01 -0.77 -4.19 115.64 118.76 1q8a s THR 186 Ca 0.00 1.43 0.08 0.00 0.31 0.00 0.00 61.69 63.51 1q8a s THR 186 Cb 0.00 -4.03 0.02 0.00 0.01 0.00 0.00 72.50 68.50 1q8a s THR 186 CO 0.00 0.28 0.59 1.51 -0.69 0.00 0.00 174.62 176.31 1q8a s ASP 187 N 0.64 5.52 0.26 3.53 1.47 -1.26 -0.85 116.67 125.97 1q8a s ASP 187 Ca 0.37 -0.52 -0.02 0.00 1.18 0.00 0.00 52.55 53.56 1q8a s ASP 187 Cb -0.18 -0.49 0.52 0.00 -0.34 0.00 0.00 42.92 42.42 1q8a s ASP 187 CO 0.18 -0.85 1.76 -0.65 0.68 0.00 0.00 175.17 176.30 1q8a h PRO 188 N 0.60 0.58 -0.51 2.11 0.11 -1.89 -0.48 132.00 132.52 1q8a h PRO 188 Ca -0.38 -0.04 -0.13 0.00 0.11 0.00 0.00 66.00 65.56 1q8a h PRO 188 Cb 1.28 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 1q8a h PRO 188 CO 0.45 0.39 -0.18 0.00 -0.21 0.00 0.00 178.00 178.45 1q8a h ALA 189 N 1.55 0.71 0.02 -0.75 0.00 -1.93 -0.02 119.26 118.84 1q8a h ALA 189 Ca 0.45 -0.38 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1q8a h ALA 189 Cb 0.64 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1q8a h ALA 189 CO -0.36 0.67 -0.01 -0.97 0.00 0.00 0.00 179.25 178.58 1q8a h ASN 190 N 0.89 -0.02 -0.33 0.00 -0.73 -1.87 0.15 115.58 113.67 1q8a h ASN 190 Ca 0.12 -0.09 0.07 0.00 1.87 0.00 0.00 56.30 58.27 1q8a h ASN 190 Cb 0.76 0.00 -0.07 0.00 0.27 0.00 0.00 38.32 39.28 1q8a h ASN 190 CO 0.06 0.08 -0.12 0.15 -0.37 0.00 0.00 177.43 177.23 1q8a h PHE 191 N -0.12 -0.29 0.08 0.67 3.57 -0.94 0.20 116.94 120.11 1q8a h PHE 191 Ca -0.00 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.53 1q8a h PHE 191 Cb 0.11 0.18 0.00 0.00 2.79 0.00 0.00 35.95 39.03 1q8a h PHE 191 CO -0.04 -0.19 -0.04 0.00 -2.23 0.00 0.00 178.31 175.80 1q8a h ALA 192 N 1.23 -0.11 -0.64 2.41 0.00 -0.73 -0.42 119.26 121.00 1q8a h ALA 192 Ca 0.16 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 1q8a h ALA 192 Cb 0.31 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 1q8a h ALA 192 CO -0.37 -0.55 0.18 0.82 0.00 0.00 0.00 179.25 179.33 1q8a h ILE 193 N -0.14 1.24 -0.30 0.00 2.04 -0.40 0.25 117.51 120.21 1q8a h ILE 193 Ca -0.01 -0.87 -0.18 0.00 1.00 0.00 0.00 64.86 64.80 1q8a h ILE 193 Cb 0.11 0.57 -0.00 0.00 -0.74 0.00 0.00 36.82 36.75 1q8a h ILE 193 CO 0.02 0.33 -0.51 0.74 0.00 0.00 0.00 178.15 178.73 1q8a h THR 194 N 0.95 1.28 0.00 -0.27 2.02 -0.45 -3.36 112.91 113.07 1q8a h THR 194 Ca 0.21 -1.70 -0.11 0.00 0.77 0.00 0.00 66.41 65.58 1q8a h THR 194 Cb 0.31 1.59 -0.02 0.00 -1.74 0.00 0.00 68.15 68.28 1q8a h THR 194 CO -0.00 0.56 -1.80 0.49 0.37 0.00 0.00 175.52 175.13 1q8a n PHE 195 N -4.01 0.36 -0.30 3.16 3.01 -0.18 -4.36 117.46 115.14 1q8a n PHE 195 Ca -0.04 0.11 0.10 0.00 1.01 0.00 0.00 57.45 58.63 1q8a n PHE 195 Cb 0.61 -0.80 0.32 0.00 -0.01 0.00 0.00 39.48 39.60 1q8a n PHE 195 CO 0.00 0.00 0.00 0.22 1.01 0.00 0.00 176.76 177.99 1q8a h ASP 196 N 0.00 0.76 0.54 4.37 3.58 -0.64 -0.41 116.42 124.62 1q8a h ASP 196 Ca -0.15 0.04 0.00 0.00 0.42 0.00 0.00 57.03 57.34 1q8a h ASP 196 Cb 1.38 -0.11 0.00 0.00 1.72 0.00 0.00 39.33 42.32 1q8a h ASP 196 CO 0.02 0.40 -0.08 -1.84 -2.88 0.00 0.00 179.24 174.85 1q8a n GLU 197 N -4.58 0.44 -1.94 0.28 0.28 -1.26 -4.83 120.64 109.04 1q8a n GLU 197 Ca 0.18 -0.09 -0.30 0.00 -0.16 0.00 0.00 57.16 56.79 1q8a n GLU 197 Cb 0.42 -1.50 0.04 0.00 1.43 0.00 0.00 31.44 31.83 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 -2.62 2.95 -0.16 -1.84 1.43 -0.17 -4.84 118.68 113.43 1q8a s LEU 198 Ca 0.25 1.10 -0.06 0.00 -1.03 0.00 0.00 54.13 54.40 1q8a s LEU 198 Cb 0.20 -3.92 -0.24 0.00 0.03 0.00 0.00 46.19 42.27 1q8a s LEU 198 CO 0.49 -1.29 3.38 -0.67 0.23 0.00 0.00 176.35 178.49 1q8a n ASP 199 N -2.95 5.25 -4.95 2.29 4.64 -1.26 -4.85 116.55 114.73 1q8a n ASP 199 Ca 0.07 -2.43 -0.19 0.00 -1.38 0.00 0.00 54.79 50.86 1q8a n ASP 199 Cb 0.57 -1.35 -0.01 0.00 -1.04 0.00 0.00 41.12 39.29 1q8a n ASP 199 CO 0.00 0.00 0.00 0.27 -0.82 0.00 0.00 177.20 176.65 1q8a s ILE 200 N 1.25 2.82 -0.08 5.18 -4.36 -1.26 -4.92 121.20 119.83 1q8a s ILE 200 Ca 0.63 -1.16 0.13 0.00 -0.26 0.00 0.00 60.65 60.00 1q8a s ILE 200 Cb 0.29 -2.98 -0.20 0.00 1.25 0.00 0.00 42.46 40.82 1q8a s ILE 200 CO -0.01 0.00 0.18 0.47 0.24 0.00 0.00 174.94 175.82 1q8a n ASP 201 N -1.72 1.66 -3.76 4.36 8.00 0.15 -4.96 116.55 120.28 1q8a n ASP 201 Ca 0.06 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.45 1q8a n ASP 201 Cb 0.60 1.23 -0.07 0.00 -0.02 0.00 0.00 41.12 42.86 1q8a n ASP 201 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1q8a s ALA 202 N -2.65 -0.63 0.14 2.24 0.00 -0.89 -2.47 121.76 117.49 1q8a s ALA 202 Ca -0.06 -0.07 0.08 0.00 0.00 0.00 0.00 51.96 51.91 1q8a s ALA 202 Cb 0.07 0.35 -0.04 0.00 0.00 0.00 0.00 23.12 23.49 1q8a s ALA 202 CO 0.58 -0.43 -0.19 -0.51 0.00 0.00 0.00 175.76 175.21 1q8a s LEU 203 N -2.16 2.38 0.00 0.00 1.02 -0.22 -1.77 118.68 117.93 1q8a s LEU 203 Ca -0.04 -0.79 -0.12 0.00 0.02 0.00 0.00 54.13 53.20 1q8a s LEU 203 Cb -0.00 -0.82 0.04 0.00 0.02 0.00 0.00 46.19 45.43 1q8a s LEU 203 CO -0.04 -0.01 0.60 0.61 0.02 0.00 0.00 176.35 177.53 1q8a n GLY 204 N 0.62 1.05 2.88 -3.19 0.00 -0.12 -1.71 105.19 104.72 1q8a n GLY 204 Ca -0.16 -1.11 -0.14 0.00 0.00 0.00 0.00 46.02 44.61 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 -2.32 0.15 0.05 -0.61 1.01 -0.95 -4.21 121.20 114.33 1q8a s ILE 205 Ca 0.13 -0.03 -0.08 0.00 0.00 0.00 0.00 60.65 60.66 1q8a s ILE 205 Cb -0.02 -0.17 -0.00 0.00 0.01 0.00 0.00 42.46 42.28 1q8a s ILE 205 CO 0.05 0.07 0.17 0.54 0.00 0.00 0.00 174.94 175.77 1q8a s ASN 206 N 0.25 0.09 0.66 3.58 4.22 -1.26 -1.54 114.94 120.94 1q8a s ASN 206 Ca -0.02 -0.48 0.00 0.00 -2.14 0.00 0.00 52.86 50.22 1q8a s ASN 206 Cb -0.04 0.29 0.00 0.00 1.28 0.00 0.00 41.25 42.77 1q8a s ASN 206 CO -0.01 -0.59 0.00 0.00 -2.04 0.00 0.00 177.10 174.46 1q8a n SER 208 N -2.06 0.00 -4.20 0.00 7.64 -1.26 -4.62 113.62 109.12 1q8a n SER 208 Ca 0.00 0.00 -0.12 0.00 1.01 0.00 0.00 58.87 59.77 1q8a n SER 208 Cb 0.06 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.16 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 2.03 0.86 -3.43 1.43 -1.26 -4.96 118.68 113.35 1q8a s LEU 209 Ca 0.00 -1.17 -0.12 0.00 -1.03 0.00 0.00 54.13 51.81 1q8a s LEU 209 Cb 0.00 0.09 0.14 0.00 0.03 0.00 0.00 46.19 46.45 1q8a s LEU 209 CO 0.00 -0.62 1.20 -0.83 0.23 0.00 0.00 176.35 176.33 1q8a s GLY 210 N -3.11 1.72 0.19 -3.19 0.00 -1.26 -0.83 107.32 100.84 1q8a s GLY 210 Ca 0.22 -1.09 -0.12 0.00 0.00 0.00 0.00 44.72 43.73 1q8a s GLY 210 CO 0.02 -0.47 1.78 -2.55 0.00 0.00 0.00 173.10 171.88 1q8a h PRO 211 N -1.21 0.46 0.33 2.90 0.11 -1.91 -1.60 132.00 131.07 1q8a h PRO 211 Ca -0.44 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.63 1q8a h PRO 211 Cb 1.27 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 1q8a h PRO 211 CO 0.48 0.31 -0.19 1.49 -0.21 0.00 0.00 178.00 179.88 1q8a h GLU 212 N 0.48 -0.48 -0.46 1.05 4.57 -1.96 -2.58 114.58 115.20 1q8a h GLU 212 Ca 0.24 0.03 -0.02 0.00 -1.18 0.00 0.00 59.36 58.43 1q8a h GLU 212 Cb 0.18 0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 28.86 1q8a h GLU 212 CO -0.19 -0.32 0.21 0.93 -1.18 0.00 0.00 179.01 178.46 1q8a h GLU 213 N -0.50 0.65 0.00 1.92 3.07 -1.90 -2.40 114.58 115.42 1q8a h GLU 213 Ca -0.04 -0.08 0.00 0.00 -0.50 0.00 0.00 59.36 58.75 1q8a h GLU 213 Cb 0.40 -0.13 0.00 0.00 -0.84 0.00 0.00 28.75 28.19 1q8a h GLU 213 CO 0.04 0.52 0.00 0.82 -1.40 0.00 0.00 179.01 178.99 1q8a h ILE 214 N 0.65 0.00 -0.28 3.13 2.04 -1.16 -3.37 117.51 118.52 1q8a h ILE 214 Ca 0.16 -0.68 0.06 0.00 1.00 0.00 0.00 64.86 65.40 1q8a h ILE 214 Cb 0.09 1.66 -0.08 0.00 -0.74 0.00 0.00 36.82 37.75 1q8a h ILE 214 CO -0.02 0.00 -0.39 0.25 0.00 0.00 0.00 178.15 177.99 1q8a h LEU 215 N 0.00 -1.25 -1.68 1.44 5.85 -1.02 0.50 115.31 119.16 1q8a h LEU 215 Ca 0.00 0.19 -0.04 0.00 0.84 0.00 0.00 57.88 58.87 1q8a h LEU 215 Cb 0.70 0.54 -0.01 0.00 0.37 0.00 0.00 40.66 42.27 1q8a h LEU 215 CO 0.00 -0.37 -0.19 1.55 -0.34 0.00 0.00 178.44 179.09 1q8a h PRO 216 N -0.37 0.00 -0.07 5.25 0.13 -1.78 -0.63 132.00 134.53 1q8a h PRO 216 Ca 0.12 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.18 1q8a h PRO 216 Cb 0.58 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.71 1q8a h PRO 216 CO -0.48 0.19 -0.22 0.82 -0.23 0.00 0.00 178.00 178.08 1q8a h ILE 217 N 0.00 1.42 -0.50 -3.56 2.04 -1.40 -2.55 117.51 112.96 1q8a h ILE 217 Ca -0.00 -1.59 -0.04 0.00 1.00 0.00 0.00 64.86 64.23 1q8a h ILE 217 Cb 0.43 2.26 -0.02 0.00 -0.74 0.00 0.00 36.82 38.74 1q8a h ILE 217 CO 0.02 0.45 0.15 0.15 0.00 0.00 0.00 178.15 178.92 1q8a h PHE 218 N -0.21 0.75 -0.51 1.37 3.04 -0.79 -1.41 116.94 119.18 1q8a h PHE 218 Ca -0.01 -0.05 -0.02 0.00 3.98 0.00 0.00 57.97 61.87 1q8a h PHE 218 Cb 0.84 -0.23 -0.02 0.00 2.56 0.00 0.00 35.95 39.10 1q8a h PHE 218 CO 0.12 0.62 0.24 0.37 -2.02 0.00 0.00 178.31 177.65 1q8a h GLN 219 N 0.72 0.74 -0.62 1.11 4.15 -1.04 0.14 115.11 120.32 1q8a h GLN 219 Ca 0.17 -0.11 -0.01 0.00 0.77 0.00 0.00 58.65 59.46 1q8a h GLN 219 Cb 0.22 -0.13 -0.03 0.00 0.21 0.00 0.00 27.48 27.75 1q8a h GLN 219 CO -0.01 0.62 0.35 1.49 -1.93 0.00 0.00 178.83 179.35 1q8a h GLU 220 N 0.68 0.87 -0.55 1.69 4.81 -0.99 -1.92 114.58 119.17 1q8a h GLU 220 Ca 0.18 -0.10 0.01 0.00 -0.13 0.00 0.00 59.36 59.32 1q8a h GLU 220 Cb 0.13 -0.17 -0.03 0.00 0.63 0.00 0.00 28.75 29.31 1q8a h GLU 220 CO -0.02 0.65 0.36 1.25 -0.73 0.00 0.00 179.01 180.52 1q8a h LEU 221 N 0.85 0.61 -1.91 1.64 5.85 -0.78 -2.53 115.31 119.04 1q8a h LEU 221 Ca 0.22 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.91 1q8a h LEU 221 Cb 0.03 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 40.91 1q8a h LEU 221 CO -0.04 0.44 -0.10 0.77 -0.34 0.00 0.00 178.44 179.18 1q8a h SER 222 N 0.73 0.00 1.33 1.25 4.64 -0.13 -2.39 113.55 118.98 1q8a h SER 222 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 1q8a h SER 222 Cb -0.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.02 1q8a h SER 222 CO -0.05 0.10 0.00 1.56 -0.87 0.00 0.00 176.83 177.57 1q8a h GLN 223 N 0.00 0.00 -0.20 4.77 4.20 -0.91 -3.31 115.11 119.66 1q8a h GLN 223 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1q8a h GLN 223 Cb 0.19 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.97 1q8a h GLN 223 CO 0.01 0.00 0.00 0.66 -0.67 0.00 0.00 178.83 178.83 1q8a n TYR 224 N -2.87 0.26 -3.89 2.96 4.01 -0.90 0.36 117.16 117.09 1q8a n TYR 224 Ca 0.02 -0.31 -0.11 0.00 -0.16 0.00 0.00 57.90 57.34 1q8a n TYR 224 Cb 0.38 -0.02 -0.12 0.00 -0.31 0.00 0.00 39.34 39.27 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 -0.94 0.05 -1.52 -0.72 -1.32 -1.21 -4.53 115.64 105.45 1q8a s THR 225 Ca 0.17 -0.38 0.15 0.00 -1.21 0.00 0.00 61.69 60.42 1q8a s THR 225 Cb 0.10 -0.20 0.32 0.00 -1.51 0.00 0.00 72.50 71.21 1q8a s THR 225 CO 0.14 -0.21 1.23 0.47 -2.21 0.00 0.00 174.62 174.04 1q8a n ASP 226 N 2.35 2.96 -4.49 8.08 8.00 -1.26 -4.66 116.55 127.52 1q8a n ASP 226 Ca -0.17 -1.88 -0.29 0.00 0.71 0.00 0.00 54.79 53.15 1q8a n ASP 226 Cb 0.58 -0.21 0.15 0.00 -0.02 0.00 0.00 41.12 41.61 1q8a n ASP 226 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1q8a s LYS 227 N -1.10 1.00 0.53 -1.24 1.02 -1.26 -5.00 119.74 113.69 1q8a s LYS 227 Ca 0.28 -0.06 -0.22 0.00 0.02 0.00 0.00 55.97 55.99 1q8a s LYS 227 Cb 0.16 -1.85 -0.05 0.00 -0.52 0.00 0.00 37.83 35.56 1q8a s LYS 227 CO 0.21 -2.23 1.31 -0.06 -0.92 0.00 0.00 175.35 173.66 1q8a s PHE 228 N -3.57 2.40 -0.04 3.18 0.08 -1.03 -4.82 117.98 114.18 1q8a s PHE 228 Ca 0.68 1.41 0.05 0.00 0.12 0.00 0.00 56.93 59.19 1q8a s PHE 228 Cb -0.09 -3.70 -0.02 0.00 -0.57 0.00 0.00 43.02 38.63 1q8a s PHE 228 CO 0.52 -2.59 -0.17 -0.51 -0.10 0.00 0.00 175.22 172.37 1q8a s LEU 229 N -3.46 2.60 0.05 -0.37 1.43 -1.26 -1.06 118.68 116.61 1q8a s LEU 229 Ca 0.70 -0.25 0.04 0.00 -1.03 0.00 0.00 54.13 53.60 1q8a s LEU 229 Cb -0.38 -1.51 -0.02 0.00 0.03 0.00 0.00 46.19 44.31 1q8a s LEU 229 CO 0.44 0.34 -0.12 -0.69 0.23 0.00 0.00 176.35 176.55 1q8a s VAL 230 N -0.71 0.97 -0.11 -1.59 1.01 -0.69 -1.01 120.40 118.26 1q8a s VAL 230 Ca 0.11 -1.09 -0.11 0.00 0.00 0.00 0.00 61.98 60.89 1q8a s VAL 230 Cb -0.10 -0.92 0.03 0.00 0.00 0.00 0.00 36.38 35.38 1q8a s VAL 230 CO 0.00 -0.15 0.31 0.54 0.00 0.00 0.00 175.10 175.80 1q8a s VAL 231 N -1.08 0.00 -0.39 2.92 0.11 -0.84 -2.24 120.40 118.89 1q8a s VAL 231 Ca -0.02 -0.03 0.03 0.00 -2.93 0.00 0.00 61.98 59.03 1q8a s VAL 231 Cb -0.09 -0.45 0.16 0.00 -1.53 0.00 0.00 36.38 34.47 1q8a s VAL 231 CO 0.01 -0.02 0.38 -1.61 -3.33 0.00 0.00 175.10 170.54 1q8a s GLU 232 N 0.07 0.71 0.68 1.54 2.02 -0.59 -1.04 118.70 122.10 1q8a s GLU 232 Ca -0.01 -1.15 -0.14 0.00 0.02 0.00 0.00 54.97 53.70 1q8a s GLU 232 Cb -0.02 -0.85 0.01 0.00 0.10 0.00 0.00 34.13 33.36 1q8a s GLU 232 CO 0.01 -1.24 1.09 -2.14 0.02 0.00 0.00 175.26 173.00 1q8a s PRO 233 N 1.10 2.75 0.92 0.39 0.02 -1.25 -1.52 135.00 137.42 1q8a s PRO 233 Ca 0.21 1.28 -0.15 0.00 0.02 0.00 0.00 61.00 62.36 1q8a s PRO 233 Cb -0.12 -1.95 0.17 0.00 0.02 0.00 0.00 34.50 32.61 1q8a s PRO 233 CO -0.05 -1.27 1.28 -0.80 -0.33 0.00 0.00 177.00 175.84 1q8a s ASN 234 N -2.90 3.49 -0.39 2.53 0.01 -0.01 -0.94 114.94 116.73 1q8a s ASN 234 Ca 0.64 0.40 0.06 0.00 -0.71 0.00 0.00 52.86 53.25 1q8a s ASN 234 Cb -0.19 -0.56 0.62 0.00 0.41 0.00 0.00 41.25 41.53 1q8a s ASN 234 CO 0.45 -2.51 1.77 0.00 -1.51 0.00 0.00 177.10 175.30 1q8a n ALA 235 N -3.65 5.15 0.00 0.60 0.00 -0.42 -4.25 120.51 117.95 1q8a n ALA 235 Ca 0.13 -2.96 0.00 0.00 0.00 0.00 0.00 53.44 50.62 1q8a n ALA 235 Cb 0.60 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 18.84 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 -1.10 0.30 3.66 0.00 0.00 -1.26 -1.72 105.19 105.07 1q8a n GLY 236 Ca 0.51 -1.87 -0.42 0.00 0.00 0.00 0.00 46.02 44.23 1q8a n GLY 236 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1q8a s LYS 237 N -1.84 4.17 0.00 1.61 2.20 -1.26 -4.76 119.74 119.86 1q8a s LYS 237 Ca 0.00 2.30 0.00 0.00 -0.36 0.00 0.00 55.97 57.91 1q8a s LYS 237 Cb 0.00 -3.99 0.00 0.00 -1.51 0.00 0.00 37.83 32.33 1q8a s LYS 237 CO 0.00 -0.86 0.00 -0.35 -0.36 0.00 0.00 175.35 173.78 1q8a n PRO 238 N 7.08 0.00 -3.73 4.03 -0.04 -1.26 -4.46 135.00 136.63 1q8a n PRO 238 Ca 0.18 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 63.27 1q8a n PRO 238 Cb 0.42 0.00 -0.12 0.00 -0.04 0.00 0.00 33.50 33.76 1q8a n PRO 238 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1q8a s ILE 239 N -4.84 4.53 0.00 0.52 -1.16 -1.26 -3.31 121.20 115.68 1q8a s ILE 239 Ca 0.00 -0.10 0.00 0.00 -0.51 0.00 0.00 60.65 60.04 1q8a s ILE 239 Cb 0.00 -3.13 0.00 0.00 0.61 0.00 0.00 42.46 39.94 1q8a s ILE 239 CO 0.00 0.32 0.00 1.07 -2.81 0.00 0.00 174.94 173.52 1q8a n THR 245 N 4.92 0.00 -3.96 4.00 5.66 -1.26 -4.90 114.28 118.75 1q8a n THR 245 Ca -0.16 0.00 -0.28 0.00 -3.05 0.00 0.00 64.05 60.56 1q8a n THR 245 Cb 0.52 0.00 -0.17 0.00 -1.55 0.00 0.00 70.33 69.13 1q8a n THR 245 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 1q8a s VAL 246 N 0.00 1.28 0.10 1.08 0.11 -1.24 -5.09 120.40 116.65 1q8a s VAL 246 Ca 0.00 -0.47 -0.12 0.00 -2.93 0.00 0.00 61.98 58.46 1q8a s VAL 246 Cb 0.00 -1.26 -0.06 0.00 -1.53 0.00 0.00 36.38 33.53 1q8a s VAL 246 CO 0.00 0.40 0.47 -0.31 -3.33 0.00 0.00 175.10 172.32 1q8a s TYR 247 N 1.60 3.60 0.14 1.54 2.02 -1.21 -4.77 117.35 120.27 1q8a s TYR 247 Ca 0.05 0.92 -0.07 0.00 -0.37 0.00 0.00 57.07 57.59 1q8a s TYR 247 Cb -0.13 -2.26 -0.06 0.00 -0.40 0.00 0.00 41.96 39.11 1q8a s TYR 247 CO -0.09 0.49 1.36 -1.00 -1.57 0.00 0.00 175.55 174.74 1q8a h PRO 248 N 3.71 0.61 -6.28 -1.71 0.13 -1.76 -3.43 132.00 123.27 1q8a h PRO 248 Ca -0.49 -0.51 -0.58 0.00 -0.87 0.00 0.00 66.00 63.56 1q8a h PRO 248 Cb 1.19 0.11 -0.09 0.00 0.13 0.00 0.00 31.00 32.34 1q8a h PRO 248 CO 0.66 1.13 0.81 -0.51 -0.23 0.00 0.00 178.00 179.86 1q8a s LEU 249 N -8.19 3.71 0.76 1.56 1.43 -0.70 -5.00 118.68 112.25 1q8a s LEU 249 Ca -0.08 -0.09 -0.11 0.00 -1.03 0.00 0.00 54.13 52.82 1q8a s LEU 249 Cb 0.09 -3.02 0.06 0.00 0.03 0.00 0.00 46.19 43.35 1q8a s LEU 249 CO 0.88 -1.38 1.13 -0.54 0.23 0.00 0.00 176.35 176.66 1q8a s LYS 250 N 4.56 2.26 0.24 1.70 -0.14 -1.26 -4.84 119.74 122.25 1q8a s LYS 250 Ca 0.38 0.16 -0.06 0.00 -1.36 0.00 0.00 55.97 55.09 1q8a s LYS 250 Cb -0.10 -2.00 0.42 0.00 -1.68 0.00 0.00 37.83 34.47 1q8a s LYS 250 CO 0.23 -1.38 1.70 -1.35 -0.76 0.00 0.00 175.35 173.79 1q8a h PRO 251 N -0.87 0.30 0.21 -1.68 0.11 -1.93 -2.20 132.00 125.94 1q8a h PRO 251 Ca -0.46 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.63 1q8a h PRO 251 Cb 1.31 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1q8a h PRO 251 CO 0.65 0.20 -0.10 1.25 -0.21 0.00 0.00 178.00 179.78 1q8a h HIS 252 N 0.31 -0.26 -0.40 0.65 2.76 -1.94 -1.28 115.15 114.99 1q8a h HIS 252 Ca 0.39 -0.01 -0.11 0.00 -2.20 0.00 0.00 60.37 58.44 1q8a h HIS 252 Cb 0.63 0.09 -0.01 0.00 1.55 0.00 0.00 27.41 29.66 1q8a h HIS 252 CO -0.24 0.00 -0.21 0.22 -1.30 0.00 0.00 177.93 176.41 1q8a h ASP 253 N -0.51 0.79 0.30 3.26 1.82 -1.94 -2.55 116.42 117.59 1q8a h ASP 253 Ca -0.03 -0.28 -0.01 0.00 -0.39 0.00 0.00 57.03 56.32 1q8a h ASP 253 Cb 0.38 -0.22 -0.01 0.00 0.68 0.00 0.00 39.33 40.17 1q8a h ASP 253 CO 0.05 0.98 -0.20 0.15 -1.61 0.00 0.00 179.24 178.61 1q8a h PHE 254 N 0.68 -0.53 -0.47 0.28 3.04 -1.38 -2.99 116.94 115.57 1q8a h PHE 254 Ca 0.10 -0.00 0.10 0.00 3.98 0.00 0.00 57.97 62.14 1q8a h PHE 254 Cb 0.72 0.19 -0.02 0.00 2.56 0.00 0.00 35.95 39.40 1q8a h PHE 254 CO 0.04 -0.31 0.32 0.00 -2.02 0.00 0.00 178.31 176.34 1q8a h ALA 255 N 0.18 2.15 0.00 2.41 0.00 -1.09 -2.30 119.26 120.61 1q8a h ALA 255 Ca -0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1q8a h ALA 255 Cb 0.42 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1q8a h ALA 255 CO 0.01 -0.27 0.00 1.33 0.00 0.00 0.00 179.25 180.33 1q8a n VAL 256 N -4.45 0.65 1.27 0.00 0.24 -0.98 -1.86 118.33 113.20 1q8a n VAL 256 Ca 0.07 0.16 0.14 0.00 -2.04 0.00 0.00 64.34 62.67 1q8a n VAL 256 Cb 0.39 -0.89 0.53 0.00 -1.47 0.00 0.00 33.84 32.39 1q8a n VAL 256 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 1q8a n HIS 257 N -1.35 0.00 -0.36 6.34 -0.00 -0.87 -4.14 115.22 114.83 1q8a n HIS 257 Ca 0.06 0.00 0.03 0.00 -0.00 0.00 0.00 57.72 57.82 1q8a n HIS 257 Cb 0.15 -0.23 0.18 0.00 -0.00 0.00 0.00 29.99 30.09 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 0.48 1.04 -0.70 1.59 2.04 -1.56 -1.75 117.51 118.66 1q8a h ILE 258 Ca 0.00 -0.38 -0.03 0.00 1.00 0.00 0.00 64.86 65.45 1q8a h ILE 258 Cb 0.42 -0.16 -0.03 0.00 -0.74 0.00 0.00 36.82 36.30 1q8a h ILE 258 CO 0.00 0.20 0.33 0.44 0.00 0.00 0.00 178.15 179.12 1q8a h ASP 259 N 1.11 0.89 -0.56 1.72 5.19 -1.82 0.53 116.42 123.49 1q8a h ASP 259 Ca 0.44 -0.10 -0.01 0.00 -0.62 0.00 0.00 57.03 56.75 1q8a h ASP 259 Cb 0.24 -0.23 -0.03 0.00 0.18 0.00 0.00 39.33 39.49 1q8a h ASP 259 CO -0.19 0.76 0.32 0.28 -3.12 0.00 0.00 179.24 177.28 1q8a h SER 260 N 0.99 0.69 0.03 6.45 0.02 -1.59 -1.08 113.55 119.05 1q8a h SER 260 Ca 0.24 -0.08 -0.12 0.00 -0.84 0.00 0.00 61.79 60.99 1q8a h SER 260 Cb 0.10 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.46 1q8a h SER 260 CO -0.03 0.57 -0.39 1.88 -1.14 0.00 0.00 176.83 177.72 1q8a h TYR 261 N 0.75 0.55 -0.44 3.45 0.05 -1.16 -2.64 116.97 117.52 1q8a h TYR 261 Ca 0.20 -0.15 -0.01 0.00 0.05 0.00 0.00 58.73 58.81 1q8a h TYR 261 Cb 0.03 -0.12 -0.02 0.00 1.01 0.00 0.00 36.73 37.62 1q8a h TYR 261 CO -0.02 0.79 0.23 -0.92 -1.05 0.00 0.00 178.16 177.19 1q8a h TYR 262 N 0.39 0.63 0.00 4.88 5.03 -0.46 -1.89 116.97 125.54 1q8a h TYR 262 Ca 0.04 -0.02 -0.03 0.00 2.58 0.00 0.00 58.73 61.30 1q8a h TYR 262 Cb 0.85 -0.20 -0.00 0.00 1.55 0.00 0.00 36.73 38.93 1q8a h TYR 262 CO 0.03 0.49 -0.12 0.93 -1.32 0.00 0.00 178.16 178.17 1q8a h GLU 263 N 0.58 0.00 -0.00 1.82 4.39 -1.02 -1.43 114.58 118.91 1q8a h GLU 263 Ca 0.15 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.85 1q8a h GLU 263 Cb 0.09 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.74 1q8a h GLU 263 CO -0.02 0.12 -0.02 1.28 -1.16 0.00 0.00 179.01 179.21 1q8a n LEU 264 N -4.26 0.35 0.00 1.33 4.77 -0.86 -4.92 117.00 113.42 1q8a n LEU 264 Ca -0.03 -0.05 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 1q8a n LEU 264 Cb 0.20 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 1q8a n LEU 264 CO 0.34 0.06 0.00 0.61 -1.33 0.00 0.00 177.39 177.07 1q8a n GLY 265 N 1.11 0.90 3.76 -0.72 0.00 -0.54 -4.88 105.19 104.83 1q8a n GLY 265 Ca 0.20 -0.13 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 1q8a n GLY 265 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1q8a s VAL 266 N -2.00 2.09 -0.06 1.61 0.11 -0.77 -4.54 120.40 116.84 1q8a s VAL 266 Ca 0.00 0.07 0.07 0.00 -2.93 0.00 0.00 61.98 59.19 1q8a s VAL 266 Cb 0.00 -3.04 -0.09 0.00 -1.53 0.00 0.00 36.38 31.72 1q8a s VAL 266 CO 0.00 0.00 0.06 0.59 -3.33 0.00 0.00 175.10 172.42 1q8a n ASN 267 N -0.74 3.27 -3.74 3.54 4.13 -0.18 -4.71 115.26 116.83 1q8a n ASN 267 Ca 0.09 0.00 -0.15 0.00 1.68 0.00 0.00 54.58 56.20 1q8a n ASN 267 Cb 0.44 0.83 -0.15 0.00 -1.54 0.00 0.00 39.78 39.36 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 -2.25 -0.09 -0.08 2.41 1.01 -0.94 -1.22 121.20 120.04 1q8a s ILE 268 Ca -0.03 0.23 0.03 0.00 0.00 0.00 0.00 60.65 60.88 1q8a s ILE 268 Cb 0.03 -0.21 0.01 0.00 0.01 0.00 0.00 42.46 42.30 1q8a s ILE 268 CO 0.29 0.09 -0.18 0.12 0.00 0.00 0.00 174.94 175.27 1q8a s PHE 269 N 1.36 1.96 0.00 3.97 2.19 -0.45 -2.00 117.98 125.02 1q8a s PHE 269 Ca -0.07 -0.77 0.00 0.00 0.33 0.00 0.00 56.93 56.43 1q8a s PHE 269 Cb -0.12 -1.36 0.00 0.00 -1.31 0.00 0.00 43.02 40.23 1q8a s PHE 269 CO -0.05 -0.34 0.00 0.41 1.83 0.00 0.00 175.22 177.07 1q8a n GLY 270 N 3.67 3.27 3.29 13.12 0.00 -0.21 -0.49 105.19 127.84 1q8a n GLY 270 Ca -0.21 -1.24 -0.16 0.00 0.00 0.00 0.00 46.02 44.40 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 -0.70 1.23 0.00 -0.02 0.00 -0.52 -3.86 107.32 103.45 1q8a s GLY 271 Ca 0.00 -1.55 0.00 0.00 0.00 0.00 0.00 44.72 43.17 1q8a s GLY 271 CO 0.00 -1.65 0.00 0.00 0.00 0.00 0.00 173.10 171.45 1q8a n GLY 274 N 2.32 3.28 3.84 0.00 0.00 -1.26 -1.29 105.19 112.08 1q8a n GLY 274 Ca 0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.93 1q8a n GLY 274 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1q8a s THR 275 N -2.84 4.35 0.25 2.61 -4.23 -0.20 -4.81 115.64 110.77 1q8a s THR 275 Ca 0.00 0.78 0.01 0.00 -1.18 0.00 0.00 61.69 61.30 1q8a s THR 275 Cb 0.00 -3.62 -0.03 0.00 1.34 0.00 0.00 72.50 70.18 1q8a s THR 275 CO 0.00 -0.98 0.22 0.42 -0.54 0.00 0.00 174.62 173.74 1q8a s THR 276 N -3.08 0.00 0.36 3.99 -4.23 -1.26 -3.18 115.64 108.25 1q8a s THR 276 Ca 0.57 -1.95 0.09 0.00 -1.18 0.00 0.00 61.69 59.22 1q8a s THR 276 Cb -0.13 -2.49 0.32 0.00 1.34 0.00 0.00 72.50 71.54 1q8a s THR 276 CO 0.53 0.00 1.90 -0.65 -0.54 0.00 0.00 174.62 175.86 1q8a h PRO 277 N 2.41 0.67 -0.26 3.99 0.11 -1.93 0.70 132.00 137.70 1q8a h PRO 277 Ca -0.31 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 65.73 1q8a h PRO 277 Cb 1.24 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 1q8a h PRO 277 CO 0.46 0.44 0.04 1.49 -0.21 0.00 0.00 178.00 180.22 1q8a h GLU 278 N 0.69 0.37 -0.20 1.05 4.57 -1.96 -0.64 114.58 118.48 1q8a h GLU 278 Ca 0.40 -0.06 -0.01 0.00 -1.18 0.00 0.00 59.36 58.51 1q8a h GLU 278 Cb 0.59 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 29.10 1q8a h GLU 278 CO -0.16 0.37 0.08 0.45 -1.18 0.00 0.00 179.01 178.57 1q8a h HIS 279 N 0.37 0.30 -0.47 0.92 3.86 -1.22 -2.73 115.15 116.18 1q8a h HIS 279 Ca 0.09 -0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.26 1q8a h HIS 279 Cb 0.19 -0.09 -0.02 0.00 1.06 0.00 0.00 27.41 28.55 1q8a h HIS 279 CO 0.00 0.35 0.25 0.28 0.86 0.00 0.00 177.93 179.67 1q8a h VAL 280 N 0.16 1.15 -0.56 2.45 2.07 -1.09 -0.96 116.25 119.48 1q8a h VAL 280 Ca 0.07 -0.39 0.04 0.00 0.82 0.00 0.00 66.70 67.23 1q8a h VAL 280 Cb 0.17 0.53 -0.04 0.00 -1.52 0.00 0.00 31.29 30.43 1q8a h VAL 280 CO -0.01 0.17 0.32 0.11 0.02 0.00 0.00 177.57 178.18 1q8a h LYS 281 N 0.65 0.60 -0.14 1.57 1.57 -0.85 -1.46 116.57 118.50 1q8a h LYS 281 Ca 0.17 -0.04 -0.12 0.00 -1.87 0.00 0.00 60.65 58.79 1q8a h LYS 281 Cb 0.03 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.20 1q8a h LYS 281 CO -0.03 0.40 -0.42 -0.07 -0.57 0.00 0.00 179.45 178.76 1q8a h LEU 282 N 0.62 0.35 -0.84 2.94 -0.00 -1.11 -2.57 115.31 114.69 1q8a h LEU 282 Ca 0.24 -0.15 -0.02 0.00 -0.00 0.00 0.00 57.88 57.94 1q8a h LEU 282 Cb 0.09 -0.10 -0.04 0.00 -0.00 0.00 0.00 40.66 40.61 1q8a h LEU 282 CO -0.13 0.74 0.45 -0.26 -0.00 0.00 0.00 178.44 179.24 1q8a h PHE 283 N 0.28 1.17 -0.63 1.13 0.04 -0.51 -0.17 116.94 118.24 1q8a h PHE 283 Ca 0.02 -0.03 -0.05 0.00 2.80 0.00 0.00 57.97 60.71 1q8a h PHE 283 Cb 0.86 -0.37 -0.03 0.00 2.20 0.00 0.00 35.95 38.62 1q8a h PHE 283 CO 0.02 0.82 0.21 -0.09 -0.60 0.00 0.00 178.31 178.67 1q8a h ARG 284 N 1.18 0.97 -0.03 1.51 9.65 -1.07 0.18 114.38 126.76 1q8a h ARG 284 Ca 0.30 -0.20 -0.00 0.00 -1.10 0.00 0.00 59.98 58.97 1q8a h ARG 284 Cb 0.05 -0.15 -0.00 0.00 -1.39 0.00 0.00 29.97 28.48 1q8a h ARG 284 CO -0.05 0.84 0.00 -0.22 2.80 0.00 0.00 179.97 183.35 1q8a h LYS 285 N 0.90 0.05 -0.00 0.20 1.63 -1.09 -0.69 116.57 117.57 1q8a h LYS 285 Ca 0.21 -0.02 -0.00 0.00 -0.85 0.00 0.00 60.65 59.99 1q8a h LYS 285 Cb 0.26 -0.01 -0.00 0.00 -0.60 0.00 0.00 32.23 31.89 1q8a h LYS 285 CO -0.01 0.33 -0.00 0.28 -3.45 0.00 0.00 179.45 176.60 1q8a h VAL 286 N -0.23 1.29 0.05 2.00 2.07 -0.96 -3.33 116.25 117.14 1q8a h VAL 286 Ca 0.01 -0.84 -0.00 0.00 0.82 0.00 0.00 66.70 66.68 1q8a h VAL 286 Cb 0.30 1.86 0.00 0.00 -1.52 0.00 0.00 31.29 31.93 1q8a h VAL 286 CO 0.00 0.22 -0.03 0.25 0.02 0.00 0.00 177.57 178.03 1q8a h LEU 287 N -0.35 -0.06 0.00 2.57 5.85 -0.71 -3.49 115.31 119.11 1q8a h LEU 287 Ca 0.00 -0.29 0.00 0.00 0.84 0.00 0.00 57.88 58.43 1q8a h LEU 287 Cb 0.36 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.41 1q8a h LEU 287 CO 0.00 0.26 0.00 0.61 -0.34 0.00 0.00 178.44 178.97 1q8a n GLY 288 N -0.26 1.19 3.37 3.75 0.00 -0.26 -4.42 105.19 108.56 1q8a n GLY 288 Ca -0.08 -0.65 -0.37 0.00 0.00 0.00 0.00 46.02 44.92 1q8a n GLY 288 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1q8a s ASN 289 N -4.00 5.20 0.03 1.61 0.01 -1.26 -5.00 114.94 111.52 1q8a s ASN 289 Ca 0.00 -0.65 0.01 0.00 -0.71 0.00 0.00 52.86 51.52 1q8a s ASN 289 Cb 0.00 -1.90 -0.02 0.00 0.41 0.00 0.00 41.25 39.74 1q8a s ASN 289 CO 0.00 -0.18 -0.05 -0.13 -1.51 0.00 0.00 177.10 175.22 1q8a s ARG 290 N 1.53 0.41 0.01 -0.60 0.52 -1.26 -5.06 118.95 114.49 1q8a s ARG 290 Ca 0.03 -0.57 -0.22 0.00 -0.52 0.00 0.00 55.73 54.45 1q8a s ARG 290 Cb -0.17 -0.18 -0.05 0.00 0.52 0.00 0.00 34.95 35.07 1q8a s ARG 290 CO 0.03 0.03 0.66 0.21 0.02 0.00 0.00 175.30 176.25 1q8a s LYS 291 N -1.19 4.38 0.59 3.54 2.47 -1.26 -0.89 119.74 127.38 1q8a s LYS 291 Ca -0.09 0.85 -0.19 0.00 -1.56 0.00 0.00 55.97 54.98 1q8a s LYS 291 Cb -0.08 -3.35 -0.03 0.00 -1.46 0.00 0.00 37.83 32.91 1q8a s LYS 291 CO -0.00 0.34 1.25 -1.25 0.16 0.00 0.00 175.35 175.85 1q8a s PRO 292 N -0.14 2.92 0.81 4.03 0.04 -1.26 -4.82 135.00 136.57 1q8a s PRO 292 Ca 0.34 1.95 -0.11 0.00 0.04 0.00 0.00 61.00 63.21 1q8a s PRO 292 Cb -0.19 -1.97 0.08 0.00 0.04 0.00 0.00 34.50 32.45 1q8a s PRO 292 CO 0.19 -1.28 1.09 -0.51 0.04 0.00 0.00 177.00 176.53 1q8a s LEU 293 N -4.02 2.64 -0.08 -3.56 1.02 -1.26 -5.05 118.68 108.37 1q8a s LEU 293 Ca 0.77 1.48 -0.03 0.00 0.02 0.00 0.00 54.13 56.38 1q8a s LEU 293 Cb -0.34 -4.09 -0.04 0.00 0.02 0.00 0.00 46.19 41.75 1q8a s LEU 293 CO 0.37 -2.11 0.06 -1.58 0.02 0.00 0.00 176.35 173.11 1q8a s GLN 294 N -5.04 3.12 0.07 1.70 -0.44 -1.26 -4.88 119.66 112.94 1q8a s GLN 294 Ca 0.61 -0.35 -0.01 0.00 -2.50 0.00 0.00 55.36 53.12 1q8a s GLN 294 Cb -0.16 -2.91 -0.04 0.00 -1.64 0.00 0.00 33.01 28.26 1q8a s GLN 294 CO 0.55 0.71 -0.02 -0.98 0.50 0.00 0.00 175.29 176.06 1q8a s ARG 295 N -1.09 0.70 -0.16 1.67 1.70 -1.26 -5.01 118.95 115.49 1q8a s ARG 295 Ca 0.16 -1.28 -0.00 0.00 -0.47 0.00 0.00 55.73 54.13 1q8a s ARG 295 Cb -0.12 0.17 0.04 0.00 -0.57 0.00 0.00 34.95 34.47 1q8a s ARG 295 CO 0.05 -0.13 -0.07 0.21 -1.08 0.00 0.00 175.30 174.28 1q8a s LYS 296 N -3.94 1.57 0.53 3.89 2.47 -1.26 -4.96 119.74 118.04 1q8a s LYS 296 Ca 0.11 -0.53 -0.19 0.00 -1.56 0.00 0.00 55.97 53.80 1q8a s LYS 296 Cb 0.08 -2.02 -0.06 0.00 -1.46 0.00 0.00 37.83 34.37 1q8a s LYS 296 CO -0.07 -0.40 1.10 -1.59 0.16 0.00 0.00 175.35 174.55 1q8a s LYS 297 N 1.60 3.46 0.51 4.03 -2.85 -1.26 -4.99 119.74 120.24 1q8a s LYS 297 Ca 0.01 1.51 -0.20 0.00 -1.00 0.00 0.00 55.97 56.29 1q8a s LYS 297 Cb -0.15 -2.03 -0.07 0.00 -2.06 0.00 0.00 37.83 33.52 1q8a s LYS 297 CO -0.08 -0.74 1.10 0.15 0.10 0.00 0.00 175.35 175.88 1q8a s LYS 298 N -3.35 3.55 -0.07 1.78 1.02 0.16 -4.98 119.74 117.85 1q8a s LYS 298 Ca 0.70 1.55 0.05 0.00 0.02 0.00 0.00 55.97 58.30 1q8a s LYS 298 Cb -0.21 -2.08 -0.01 0.00 -0.52 0.00 0.00 37.83 35.01 1q8a s LYS 298 CO 0.26 -0.68 -0.24 0.50 -0.92 0.00 0.00 175.35 174.27 1q8a s ARG 299 N -3.19 2.63 0.12 1.68 3.52 -1.26 -4.71 118.95 117.75 1q8a s ARG 299 Ca 0.70 -0.87 -0.09 0.00 -0.13 0.00 0.00 55.73 55.34 1q8a s ARG 299 Cb -0.22 -2.15 -0.00 0.00 -1.56 0.00 0.00 34.95 31.01 1q8a s ARG 299 CO 0.25 0.31 0.23 0.96 -0.81 0.00 0.00 175.30 176.25 1q8a s ILE 300 N 0.00 0.11 -0.36 4.11 -4.36 -1.26 -5.12 121.20 114.32 1q8a s ILE 300 Ca -0.08 -1.27 -0.12 0.00 -0.26 0.00 0.00 60.65 58.92 1q8a s ILE 300 Cb -0.15 -1.57 0.01 0.00 1.25 0.00 0.00 42.46 42.01 1q8a s ILE 300 CO 0.05 -0.49 0.21 0.12 0.24 0.00 0.00 174.94 175.08 1q8a s PHE 301 N -3.91 3.23 0.05 1.37 2.19 -1.26 -5.06 117.98 114.58 1q8a s PHE 301 Ca 0.11 -0.72 -0.10 0.00 0.33 0.00 0.00 56.93 56.55 1q8a s PHE 301 Cb 0.04 -2.45 0.01 0.00 -1.31 0.00 0.00 43.02 39.31 1q8a s PHE 301 CO -0.06 -0.56 0.21 0.00 1.83 0.00 0.00 175.22 176.64 1q8a s ALA 302 N 1.61 -0.39 0.27 11.12 0.00 -1.26 -1.10 121.76 132.01 1q8a s ALA 302 Ca 0.04 -0.29 0.06 0.00 0.00 0.00 0.00 51.96 51.77 1q8a s ALA 302 Cb -0.18 0.32 -0.06 0.00 0.00 0.00 0.00 23.12 23.20 1q8a s ALA 302 CO 0.08 -0.39 -0.06 0.14 0.00 0.00 0.00 175.76 175.53 1q8a s VAL 303 N -2.75 1.58 0.18 0.00 -7.23 -0.45 -4.94 120.40 106.79 1q8a s VAL 303 Ca -0.04 -2.12 -0.14 0.00 -1.81 0.00 0.00 61.98 57.88 1q8a s VAL 303 Cb -0.00 -2.42 0.01 0.00 0.56 0.00 0.00 36.38 34.53 1q8a s VAL 303 CO -0.05 -0.32 0.42 -0.94 -0.31 0.00 0.00 175.10 173.91 1q8a s SER 304 N -3.42 -0.13 0.38 4.85 1.04 0.31 -0.45 113.70 116.28 1q8a s SER 304 Ca 0.29 -0.66 0.04 0.00 0.48 0.00 0.00 55.95 56.10 1q8a s SER 304 Cb 0.04 0.52 -0.03 0.00 0.10 0.00 0.00 66.02 66.65 1q8a s SER 304 CO 0.11 -0.99 0.12 -0.94 0.98 0.00 0.00 173.24 172.52 1q8a s SER 305 N -2.92 2.59 0.32 7.02 1.04 0.17 -2.94 113.70 118.98 1q8a s SER 305 Ca 0.13 -1.60 0.02 0.00 0.48 0.00 0.00 55.95 54.98 1q8a s SER 305 Cb 0.01 0.38 0.59 0.00 0.10 0.00 0.00 66.02 67.10 1q8a s SER 305 CO -0.01 -0.86 1.94 -0.65 0.98 0.00 0.00 173.24 174.64 1q8a h PRO 306 N 1.89 0.92 -0.00 4.02 0.11 -1.81 -3.11 132.00 134.01 1q8a h PRO 306 Ca -0.36 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1q8a h PRO 306 Cb 1.27 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1q8a h PRO 306 CO 0.59 0.61 -0.60 -1.13 -0.21 0.00 0.00 178.00 177.26 1q8a n SER 307 N -4.47 1.03 -3.99 -2.05 3.41 -1.25 -1.84 113.62 104.45 1q8a n SER 307 Ca 0.12 -1.01 -0.20 0.00 -0.26 0.00 0.00 58.87 57.51 1q8a n SER 307 Cb 0.17 0.82 -0.16 0.00 -0.26 0.00 0.00 64.21 64.79 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 -2.27 0.97 -0.25 4.33 1.02 -1.18 -4.83 119.74 117.52 1q8a s LYS 308 Ca 0.08 -0.30 -0.03 0.00 0.02 0.00 0.00 55.97 55.75 1q8a s LYS 308 Cb 0.12 -0.90 0.01 0.00 -0.52 0.00 0.00 37.83 36.54 1q8a s LYS 308 CO 0.56 0.10 -0.03 -1.17 -0.92 0.00 0.00 175.35 173.89 1q8a s LEU 309 N 0.24 3.25 -0.34 3.17 2.96 -1.26 -0.66 118.68 126.05 1q8a s LEU 309 Ca -0.04 -0.72 -0.11 0.00 -0.22 0.00 0.00 54.13 53.05 1q8a s LEU 309 Cb -0.09 -1.73 0.00 0.00 0.50 0.00 0.00 46.19 44.87 1q8a s LEU 309 CO 0.01 -0.11 0.19 -0.69 -1.32 0.00 0.00 176.35 174.42 1q8a s VAL 310 N 1.40 4.71 -0.12 1.68 1.01 0.40 -4.96 120.40 124.52 1q8a s VAL 310 Ca 0.02 -0.53 -0.11 0.00 0.00 0.00 0.00 61.98 61.36 1q8a s VAL 310 Cb -0.16 -3.48 -0.05 0.00 0.00 0.00 0.00 36.38 32.69 1q8a s VAL 310 CO -0.03 -0.05 0.22 -0.89 0.00 0.00 0.00 175.10 174.36 1q8a s THR 311 N 1.61 5.36 -1.52 3.92 2.01 -1.26 -1.35 115.64 124.42 1q8a s THR 311 Ca 0.04 0.40 -0.10 0.00 0.31 0.00 0.00 61.69 62.34 1q8a s THR 311 Cb -0.18 -3.52 -0.01 0.00 0.01 0.00 0.00 72.50 68.80 1q8a s THR 311 CO 0.07 0.53 2.66 0.49 -0.69 0.00 0.00 174.62 177.67 1q8a n PHE 312 N 2.61 2.67 -1.14 4.92 3.72 -0.26 -4.21 117.46 125.77 1q8a n PHE 312 Ca -0.16 -3.00 0.09 0.00 -0.05 0.00 0.00 57.45 54.32 1q8a n PHE 312 Cb 0.53 -2.34 0.16 0.00 -0.94 0.00 0.00 39.48 36.90 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 3.62 2.43 -3.64 4.37 3.85 -1.26 -4.93 116.55 121.00 1q8a n ASP 313 Ca 0.69 -3.21 -0.06 0.00 -0.71 0.00 0.00 54.79 51.50 1q8a n ASP 313 Cb 0.27 -0.46 -0.02 0.00 -1.35 0.00 0.00 41.12 39.56 1q8a n ASP 313 CO 0.00 0.00 0.00 -1.38 -1.01 0.00 0.00 177.20 174.81 1q8a s HIS 314 N -2.93 -0.24 0.03 2.11 -3.43 -1.26 -5.12 115.29 104.45 1q8a s HIS 314 Ca 0.34 0.01 -0.30 0.00 -0.80 0.00 0.00 55.06 54.31 1q8a s HIS 314 Cb 0.30 0.60 -0.08 0.00 -1.43 0.00 0.00 32.58 31.97 1q8a s HIS 314 CO 0.02 -0.72 1.71 0.12 -2.00 0.00 0.00 174.74 173.87 1q8a s PHE 315 N -3.26 2.10 -0.28 0.38 5.36 -1.26 -4.88 117.98 116.14 1q8a s PHE 315 Ca 0.09 0.14 -0.10 0.00 -0.96 0.00 0.00 56.93 56.09 1q8a s PHE 315 Cb -0.01 -4.01 -0.04 0.00 -0.34 0.00 0.00 43.02 38.62 1q8a s PHE 315 CO -0.03 -4.20 0.17 0.08 -1.46 0.00 0.00 175.22 169.78 1q8a s VAL 316 N 3.32 5.06 -0.32 3.12 1.01 -0.41 -4.98 120.40 127.19 1q8a s VAL 316 Ca 0.77 0.03 -0.23 0.00 0.00 0.00 0.00 61.98 62.54 1q8a s VAL 316 Cb -0.39 -3.44 0.00 0.00 0.00 0.00 0.00 36.38 32.56 1q8a s VAL 316 CO 0.33 0.23 0.75 -0.69 0.00 0.00 0.00 175.10 175.73 1q8a s VAL 317 N 1.72 4.80 -0.39 2.92 1.01 -1.26 -2.42 120.40 126.78 1q8a s VAL 317 Ca 0.07 1.02 -0.10 0.00 0.00 0.00 0.00 61.98 62.97 1q8a s VAL 317 Cb -0.16 -4.14 0.05 0.00 0.00 0.00 0.00 36.38 32.13 1q8a s VAL 317 CO 0.09 -0.29 0.22 -0.63 0.00 0.00 0.00 175.10 174.49 1q8a s ILE 318 N 2.93 4.38 0.23 2.22 1.01 -0.56 -0.52 121.20 130.89 1q8a s ILE 318 Ca 0.31 -1.09 -0.31 0.00 0.00 0.00 0.00 60.65 59.56 1q8a s ILE 318 Cb -0.14 -3.54 -0.11 0.00 0.01 0.00 0.00 42.46 38.68 1q8a s ILE 318 CO 0.14 -0.34 1.58 -0.83 0.00 0.00 0.00 174.94 175.49 1q8a s GLY 319 N 1.76 1.80 0.07 6.18 0.00 0.45 -4.04 107.32 113.54 1q8a s GLY 319 Ca 0.02 1.46 0.23 0.00 0.00 0.00 0.00 44.72 46.42 1q8a s GLY 319 CO 0.05 2.58 0.91 -1.84 0.00 0.00 0.00 173.10 174.80 1q8a n GLU 320 N 3.14 0.44 0.27 2.90 0.28 -1.26 -0.67 120.64 125.73 1q8a n GLU 320 Ca 0.11 -0.02 0.18 0.00 -0.16 0.00 0.00 57.16 57.27 1q8a n GLU 320 Cb 0.38 -1.63 0.93 0.00 1.43 0.00 0.00 31.44 32.55 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 0.00 -4.58 3.44 3.08 -1.91 -3.33 114.38 111.07 1q8a h ARG 321 Ca 0.00 0.00 -0.71 0.00 0.07 0.00 0.00 59.98 59.34 1q8a h ARG 321 Cb 0.85 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 30.80 1q8a h ARG 321 CO 0.00 0.00 2.37 -0.89 -1.07 0.00 0.00 179.97 180.38 1q8a n ILE 322 N -3.57 3.90 -3.69 2.04 5.41 -1.26 -4.78 119.36 117.42 1q8a n ILE 322 Ca -0.01 -3.88 -0.10 0.00 1.00 0.00 0.00 62.75 59.77 1q8a n ILE 322 Cb 0.22 -2.46 -0.10 0.00 -0.71 0.00 0.00 39.64 36.59 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 3.00 -0.48 0.32 4.38 3.84 -1.25 -1.74 114.94 122.99 1q8a s ASN 323 Ca 0.47 0.94 0.26 0.00 0.21 0.00 0.00 52.86 54.74 1q8a s ASN 323 Cb 0.08 0.90 0.88 0.00 -0.55 0.00 0.00 41.25 42.56 1q8a s ASN 323 CO -0.01 -0.20 1.76 -0.65 -2.79 0.00 0.00 177.10 175.21 1q8a h PRO 324 N 7.32 0.00 -6.27 0.43 0.11 -1.86 -3.44 132.00 128.28 1q8a h PRO 324 Ca -0.33 0.00 -0.66 0.00 0.11 0.00 0.00 66.00 65.12 1q8a h PRO 324 Cb 1.17 0.00 0.08 0.00 0.11 0.00 0.00 31.00 32.36 1q8a h PRO 324 CO 0.26 0.00 0.14 0.00 -0.21 0.00 0.00 178.00 178.18 1q8a n ALA 325 N -1.88 -1.32 -0.89 -0.75 0.00 -1.26 -0.65 120.51 113.76 1q8a n ALA 325 Ca 0.03 0.47 -0.05 0.00 0.00 0.00 0.00 53.44 53.89 1q8a n ALA 325 Cb 0.36 -1.95 -0.02 0.00 0.00 0.00 0.00 19.45 17.84 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 1.89 0.49 2.47 0.00 0.00 -1.26 -4.82 105.19 103.96 1q8a n GLY 326 Ca 0.15 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.54 2.13 -0.45 1.61 1.74 0.18 -4.94 116.66 116.39 1q8a n ARG 327 Ca -0.05 -4.26 0.37 0.00 -0.77 0.00 0.00 57.85 53.14 1q8a n ARG 327 Cb 0.31 -1.97 0.68 0.00 -1.02 0.00 0.00 32.46 30.46 1q8a n ARG 327 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 1q8a h LYS 328 N 3.71 0.10 0.87 5.56 3.64 -1.88 0.16 116.57 128.73 1q8a h LYS 328 Ca 0.14 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.47 1q8a h LYS 328 Cb 0.71 -0.02 0.01 0.00 -0.41 0.00 0.00 32.23 32.51 1q8a h LYS 328 CO 0.71 0.07 -0.42 -0.22 -2.27 0.00 0.00 179.45 177.33 1q8a h LYS 329 N 0.11 -1.12 -0.46 1.90 1.63 -1.92 -0.31 116.57 116.39 1q8a h LYS 329 Ca 0.76 0.08 0.06 0.00 -0.85 0.00 0.00 60.65 60.70 1q8a h LYS 329 Cb 2.56 0.26 -0.05 0.00 -0.60 0.00 0.00 32.23 34.39 1q8a h LYS 329 CO -0.25 -0.75 0.15 1.25 -3.45 0.00 0.00 179.45 176.40 1q8a h LEU 330 N -1.31 0.14 -0.56 5.20 5.85 -1.45 -1.94 115.31 121.23 1q8a h LEU 330 Ca -0.12 0.06 0.09 0.00 0.84 0.00 0.00 57.88 58.75 1q8a h LEU 330 Cb 0.89 0.05 -0.07 0.00 0.37 0.00 0.00 40.66 41.90 1q8a h LEU 330 CO 0.20 0.11 0.17 -0.25 -0.34 0.00 0.00 178.44 178.32 1q8a h TRP 331 N 0.31 0.28 0.00 1.25 2.91 -0.97 -1.14 115.95 118.60 1q8a h TRP 331 Ca 0.22 0.03 -0.06 0.00 1.13 0.00 0.00 58.89 60.21 1q8a h TRP 331 Cb 0.24 -0.04 -0.01 0.00 -0.51 0.00 0.00 29.16 28.84 1q8a h TRP 331 CO -0.17 0.05 -0.30 0.00 -1.03 0.00 0.00 178.44 176.99 1q8a h ALA 332 N 1.41 1.44 0.00 2.65 0.00 -0.58 -2.95 119.26 121.24 1q8a h ALA 332 Ca 0.28 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1q8a h ALA 332 Cb 0.37 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1q8a h ALA 332 CO -0.32 0.37 0.00 0.39 0.00 0.00 0.00 179.25 179.69 1q8a n GLU 333 N -4.09 0.70 0.00 0.00 -0.58 -0.43 -2.17 120.64 114.06 1q8a n GLU 333 Ca -0.02 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.72 1q8a n GLU 333 Cb 0.35 -1.15 0.00 0.00 -0.57 0.00 0.00 31.44 30.07 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 1.46 0.00 0.00 3.49 1.13 -1.11 -0.80 117.38 121.54 1q8a n GLN 335 Ca 0.00 0.00 0.14 0.00 -1.94 0.00 0.00 57.00 55.20 1q8a n GLN 335 Cb 0.35 -0.04 0.65 0.00 0.11 0.00 0.00 30.24 31.32 1q8a n GLN 335 CO 0.00 0.00 0.00 1.17 -1.44 0.00 0.00 177.06 176.79 1q8a n LYS 336 N 0.00 0.83 -2.36 -1.09 3.00 -0.92 -4.92 118.16 112.70 1q8a n LYS 336 Ca 0.00 -0.27 -0.07 0.00 -0.00 0.00 0.00 58.31 57.97 1q8a n LYS 336 Cb 0.00 -1.49 0.01 0.00 0.00 0.00 0.00 35.03 33.54 1q8a n LYS 336 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1q8a n GLY 337 N 1.23 0.19 3.69 3.14 0.00 -0.38 -4.98 105.19 108.07 1q8a n GLY 337 Ca 0.16 -0.52 -0.42 0.00 0.00 0.00 0.00 46.02 45.24 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 -2.81 6.94 -0.27 1.61 3.84 0.02 -4.93 114.94 119.35 1q8a s ASN 338 Ca 0.06 2.00 -0.12 0.00 0.21 0.00 0.00 52.86 55.01 1q8a s ASN 338 Cb -0.03 -2.56 -0.13 0.00 -0.55 0.00 0.00 41.25 37.98 1q8a s ASN 338 CO 0.07 -0.65 -0.30 -0.62 -2.79 0.00 0.00 177.10 172.81 1q8a n GLU 339 N 5.15 0.60 0.19 0.43 1.02 -1.26 -4.47 120.64 122.31 1q8a n GLU 339 Ca 0.12 0.26 0.18 0.00 -0.02 0.00 0.00 57.16 57.70 1q8a n GLU 339 Cb 0.45 -1.51 0.82 0.00 -0.02 0.00 0.00 31.44 31.18 1q8a n GLU 339 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1q8a h GLU 340 N -0.82 0.00 -0.01 3.49 5.08 -1.98 -0.44 114.58 119.91 1q8a h GLU 340 Ca -0.67 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 57.69 1q8a h GLU 340 Cb 1.66 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.91 1q8a h GLU 340 CO -0.36 0.00 -0.01 0.97 -1.00 0.00 0.00 179.01 178.62 1q8a h ILE 341 N 0.00 1.40 -0.67 3.13 6.09 -2.00 -0.42 117.51 125.04 1q8a h ILE 341 Ca 0.10 -1.18 -0.01 0.00 -1.37 0.00 0.00 64.86 62.40 1q8a h ILE 341 Cb 0.66 2.19 -0.03 0.00 0.47 0.00 0.00 36.82 40.10 1q8a h ILE 341 CO -0.00 0.31 0.36 0.58 -3.07 0.00 0.00 178.15 176.33 1q8a h VAL 342 N -0.48 1.20 -0.48 2.19 2.07 -1.48 -0.25 116.25 119.02 1q8a h VAL 342 Ca 0.00 -0.52 -0.04 0.00 0.82 0.00 0.00 66.70 66.96 1q8a h VAL 342 Cb 0.51 0.30 -0.02 0.00 -1.52 0.00 0.00 31.29 30.56 1q8a h VAL 342 CO 0.00 0.23 0.13 0.40 0.02 0.00 0.00 177.57 178.36 1q8a h ILE 343 N 0.94 1.20 0.42 4.57 2.04 -1.03 -1.65 117.51 124.00 1q8a h ILE 343 Ca 0.24 -0.70 -0.02 0.00 1.00 0.00 0.00 64.86 65.38 1q8a h ILE 343 Cb 0.04 0.69 -0.00 0.00 -0.74 0.00 0.00 36.82 36.81 1q8a h ILE 343 CO -0.04 0.26 -0.25 0.50 0.00 0.00 0.00 178.15 178.63 1q8a h LYS 344 N 0.70 -0.61 -0.95 2.37 3.64 0.71 -1.65 116.57 120.78 1q8a h LYS 344 Ca 0.16 0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.58 1q8a h LYS 344 Cb 0.23 0.14 -0.05 0.00 -0.41 0.00 0.00 32.23 32.15 1q8a h LYS 344 CO -0.01 -0.41 0.60 0.93 -2.27 0.00 0.00 179.45 178.30 1q8a h GLU 345 N -0.63 1.26 -0.25 1.90 4.39 -1.22 -2.00 114.58 118.03 1q8a h GLU 345 Ca -0.05 -0.09 -0.02 0.00 0.34 0.00 0.00 59.36 59.54 1q8a h GLU 345 Cb 0.51 -0.28 -0.01 0.00 -0.10 0.00 0.00 28.75 28.88 1q8a h GLU 345 CO 0.06 0.86 0.08 0.00 -1.16 0.00 0.00 179.01 178.84 1q8a h ALA 346 N 1.33 0.32 -0.23 3.43 0.00 -1.19 -1.88 119.26 121.05 1q8a h ALA 346 Ca 0.34 -0.14 -0.12 0.00 0.00 0.00 0.00 54.91 54.99 1q8a h ALA 346 Cb -0.11 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1q8a h ALA 346 CO -0.07 -0.05 -0.36 0.87 0.00 0.00 0.00 179.25 179.64 1q8a h LYS 347 N 0.23 0.51 -0.12 0.00 1.57 -1.13 -2.18 116.57 115.45 1q8a h LYS 347 Ca 0.08 -0.24 -0.02 0.00 -1.87 0.00 0.00 60.65 58.60 1q8a h LYS 347 Cb 0.24 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.54 1q8a h LYS 347 CO -0.00 0.80 0.01 1.15 -0.57 0.00 0.00 179.45 180.83 1q8a h THR 348 N 0.43 1.24 -0.44 -0.16 2.02 -1.32 -0.20 112.91 114.48 1q8a h THR 348 Ca 0.05 -0.78 0.02 0.00 0.77 0.00 0.00 66.41 66.47 1q8a h THR 348 Cb 0.83 1.52 -0.03 0.00 -1.74 0.00 0.00 68.15 68.73 1q8a h THR 348 CO 0.07 0.23 0.25 1.56 0.37 0.00 0.00 175.52 178.00 1q8a h GLN 349 N -0.04 0.49 -0.69 6.66 4.20 -1.30 0.24 115.11 124.67 1q8a h GLN 349 Ca 0.04 -0.03 -0.06 0.00 0.06 0.00 0.00 58.65 58.66 1q8a h GLN 349 Cb 0.34 -0.11 -0.03 0.00 0.30 0.00 0.00 27.48 27.98 1q8a h GLN 349 CO 0.01 0.32 0.20 0.28 -0.67 0.00 0.00 178.83 178.97 1q8a h VAL 350 N 0.51 1.26 -0.42 -0.54 2.07 -1.35 -0.27 116.25 117.51 1q8a h VAL 350 Ca 0.18 -0.91 -0.01 0.00 0.82 0.00 0.00 66.70 66.78 1q8a h VAL 350 Cb 0.04 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 30.33 1q8a h VAL 350 CO -0.10 0.35 0.21 -0.08 0.02 0.00 0.00 177.57 177.97 1q8a h GLU 351 N 1.02 0.57 -0.00 1.57 4.81 -0.37 -1.47 114.58 120.71 1q8a h GLU 351 Ca 0.22 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.39 1q8a h GLU 351 Cb 0.33 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.59 1q8a h GLU 351 CO -0.00 0.44 -0.02 1.63 -0.73 0.00 0.00 179.01 180.33 1q8a n LYS 352 N -4.41 0.96 0.00 1.92 4.76 0.01 -4.89 118.16 116.51 1q8a n LYS 352 Ca 0.03 -0.19 0.00 0.00 -2.87 0.00 0.00 58.31 55.28 1q8a n LYS 352 Cb 0.11 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.81 1q8a n LYS 352 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1q8a n GLY 353 N 1.12 1.03 3.73 0.72 0.00 -0.55 -4.93 105.19 106.31 1q8a n GLY 353 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 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 -1.95 3.54 -0.14 4.61 0.00 -0.19 -4.73 121.76 122.90 1q8a s ALA 354 Ca 0.00 1.10 0.20 0.00 0.00 0.00 0.00 51.96 53.26 1q8a s ALA 354 Cb 0.00 -3.50 -0.30 0.00 0.00 0.00 0.00 23.12 19.32 1q8a s ALA 354 CO 0.00 -0.55 0.49 0.39 0.00 0.00 0.00 175.76 176.09 1q8a n GLU 355 N 3.08 0.60 -3.97 0.00 1.02 0.32 -4.38 120.64 117.30 1q8a n GLU 355 Ca 0.08 -0.16 -0.11 0.00 -0.02 0.00 0.00 57.16 56.94 1q8a n GLU 355 Cb 0.43 -1.47 -0.13 0.00 -0.02 0.00 0.00 31.44 30.25 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 -3.33 0.15 -0.14 2.62 1.01 -1.03 -4.11 120.40 115.57 1q8a s VAL 356 Ca -0.05 -0.52 0.02 0.00 0.00 0.00 0.00 61.98 61.43 1q8a s VAL 356 Cb 0.13 -0.22 0.01 0.00 0.00 0.00 0.00 36.38 36.30 1q8a s VAL 356 CO 0.83 -0.23 -0.21 -0.76 0.00 0.00 0.00 175.10 174.73 1q8a s LEU 357 N -0.79 2.15 0.26 3.92 1.43 -0.54 -0.41 118.68 124.70 1q8a s LEU 357 Ca -0.07 -0.59 -0.29 0.00 -1.03 0.00 0.00 54.13 52.14 1q8a s LEU 357 Cb -0.05 -1.46 -0.09 0.00 0.03 0.00 0.00 46.19 44.61 1q8a s LEU 357 CO -0.00 0.07 0.99 -0.62 0.23 0.00 0.00 176.35 177.02 1q8a s ASP 358 N 0.85 7.49 -0.10 2.29 2.15 0.15 -0.58 116.67 128.93 1q8a s ASP 358 Ca -0.06 2.04 -0.01 0.00 0.43 0.00 0.00 52.55 54.95 1q8a s ASP 358 Cb -0.15 -2.61 0.03 0.00 -0.30 0.00 0.00 42.92 39.88 1q8a s ASP 358 CO -0.03 0.04 -0.02 -0.69 -0.17 0.00 0.00 175.17 174.30 1q8a s VAL 359 N -1.21 0.61 0.02 1.11 1.01 0.01 -4.06 120.40 117.90 1q8a s VAL 359 Ca 0.43 -0.08 0.03 0.00 0.00 0.00 0.00 61.98 62.37 1q8a s VAL 359 Cb -0.27 -0.75 -0.02 0.00 0.00 0.00 0.00 36.38 35.34 1q8a s VAL 359 CO 0.34 0.26 -0.11 0.21 0.00 0.00 0.00 175.10 175.80 1q8a s ASN 360 N 1.87 1.26 -0.28 3.32 3.84 -0.71 -0.44 114.94 123.80 1q8a s ASN 360 Ca 0.04 -0.35 0.09 0.00 0.21 0.00 0.00 52.86 52.85 1q8a s ASN 360 Cb -0.13 -0.08 0.49 0.00 -0.55 0.00 0.00 41.25 40.98 1q8a s ASN 360 CO -0.06 0.02 1.43 0.49 -2.79 0.00 0.00 177.10 176.18 1q8a n PHE 361 N 2.21 0.92 0.00 0.43 3.01 -1.26 -4.32 117.46 118.44 1q8a n PHE 361 Ca -0.17 -1.59 0.00 0.00 1.01 0.00 0.00 57.45 56.70 1q8a n PHE 361 Cb 0.56 -0.45 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 -1.12 3.40 3.56 1.37 0.00 -1.26 -3.61 105.19 107.54 1q8a n GLY 362 Ca 0.31 -0.04 -0.38 0.00 0.00 0.00 0.00 46.02 45.91 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 3.82 0.37 -0.61 1.09 -1.26 -4.80 121.20 119.81 1q8a s ILE 363 Ca 0.00 -0.71 0.17 0.00 -1.10 0.00 0.00 60.65 59.01 1q8a s ILE 363 Cb 0.00 -4.84 0.37 0.00 -1.06 0.00 0.00 42.46 36.94 1q8a s ILE 363 CO 0.00 -1.72 1.73 -0.33 -0.10 0.00 0.00 174.94 174.52 1q8a h GLU 364 N 10.06 0.39 -0.93 2.79 5.08 -1.94 -0.72 114.58 129.31 1q8a h GLU 364 Ca 0.19 -0.02 0.23 0.00 -1.00 0.00 0.00 59.36 58.76 1q8a h GLU 364 Cb 1.00 -0.09 -0.06 0.00 0.50 0.00 0.00 28.75 30.10 1q8a h GLU 364 CO 1.38 0.26 0.63 0.77 -1.00 0.00 0.00 179.01 181.05 1q8a h SER 365 N 0.41 0.29 0.17 1.42 0.02 -1.90 0.36 113.55 114.31 1q8a h SER 365 Ca 0.65 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.64 1q8a h SER 365 Cb 1.56 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 64.09 1q8a h SER 365 CO -0.40 0.10 -0.15 0.00 -1.14 0.00 0.00 176.83 175.24 1q8a n GLN 366 N -4.46 1.09 -4.06 3.45 6.02 -0.28 -4.88 117.38 114.27 1q8a n GLN 366 Ca 0.20 -0.60 -0.31 0.00 -0.01 0.00 0.00 57.00 56.29 1q8a n GLN 366 Cb 0.82 -1.49 -0.07 0.00 1.02 0.00 0.00 30.24 30.52 1q8a n GLN 366 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1q8a s ILE 367 N -2.33 4.53 -0.37 5.09 1.09 0.11 -4.84 121.20 124.49 1q8a s ILE 367 Ca 0.30 -0.74 -0.29 0.00 -1.10 0.00 0.00 60.65 58.82 1q8a s ILE 367 Cb 0.20 -3.17 0.02 0.00 -1.06 0.00 0.00 42.46 38.45 1q8a s ILE 367 CO 0.45 0.15 1.07 -0.62 -0.10 0.00 0.00 174.94 175.89 1q8a s ASP 368 N -2.33 6.82 0.57 3.58 -1.08 -1.26 -4.91 116.67 118.06 1q8a s ASP 368 Ca 0.29 0.84 0.37 0.00 -0.52 0.00 0.00 52.55 53.53 1q8a s ASP 368 Cb -0.12 -2.53 1.47 0.00 -1.46 0.00 0.00 42.92 40.27 1q8a s ASP 368 CO 0.21 -0.97 1.67 0.58 0.52 0.00 0.00 175.17 177.18 1q8a h VAL 369 N 5.87 0.22 0.00 1.11 2.07 -1.97 1.78 116.25 125.34 1q8a h VAL 369 Ca -0.21 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.31 1q8a h VAL 369 Cb 1.06 0.27 0.00 0.00 -1.52 0.00 0.00 31.29 31.10 1q8a h VAL 369 CO 1.05 0.00 0.00 0.08 0.02 0.00 0.00 177.57 178.72 1q8a h ARG 370 N 0.00 0.00 0.08 1.57 0.11 -1.99 -2.02 114.38 112.13 1q8a h ARG 370 Ca 0.58 0.00 -0.28 0.00 0.10 0.00 0.00 59.98 60.39 1q8a h ARG 370 Cb 2.59 0.00 0.02 0.00 1.11 0.00 0.00 29.97 33.68 1q8a h ARG 370 CO -0.01 0.00 -1.16 -0.92 0.10 0.00 0.00 179.97 177.99 1q8a h TYR 371 N 0.00 0.83 -0.01 4.08 5.03 0.23 -2.16 116.97 124.98 1q8a h TYR 371 Ca 0.00 -0.51 -0.11 0.00 2.58 0.00 0.00 58.73 60.69 1q8a h TYR 371 Cb 0.89 -0.07 -0.01 0.00 1.55 0.00 0.00 36.73 39.09 1q8a h TYR 371 CO 0.00 1.36 -0.49 -0.39 -1.32 0.00 0.00 178.16 177.32 1q8a h VAL 372 N 0.24 1.35 -0.39 1.81 -1.51 -1.38 -0.65 116.25 115.72 1q8a h VAL 372 Ca -0.15 -1.68 -0.13 0.00 -1.23 0.00 0.00 66.70 63.51 1q8a h VAL 372 Cb 1.83 1.89 -0.01 0.00 -2.13 0.00 0.00 31.29 32.87 1q8a h VAL 372 CO 0.21 0.48 -0.29 -0.33 -1.23 0.00 0.00 177.57 176.42 1q8a h GLU 373 N 0.03 0.83 -0.14 5.19 5.08 -1.27 -0.67 114.58 123.63 1q8a h GLU 373 Ca -0.00 -0.37 -0.08 0.00 -1.00 0.00 0.00 59.36 57.90 1q8a h GLU 373 Cb 0.87 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 30.11 1q8a h GLU 373 CO 0.07 1.01 -0.22 0.87 -1.00 0.00 0.00 179.01 179.74 1q8a h LYS 374 N 0.71 0.39 0.17 2.33 1.57 -1.08 -2.72 116.57 117.94 1q8a h LYS 374 Ca 0.08 -0.24 0.01 0.00 -1.87 0.00 0.00 60.65 58.64 1q8a h LYS 374 Cb 0.83 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 33.14 1q8a h LYS 374 CO 0.07 0.82 -0.24 0.82 -0.57 0.00 0.00 179.45 180.35 1q8a h ILE 375 N 0.00 0.47 -0.78 1.86 1.08 -1.02 0.34 117.51 119.45 1q8a h ILE 375 Ca 0.01 0.00 0.10 0.00 -0.39 0.00 0.00 64.86 64.58 1q8a h ILE 375 Cb 0.79 0.47 -0.05 0.00 -3.07 0.00 0.00 36.82 34.96 1q8a h ILE 375 CO 0.05 0.00 0.51 0.58 -0.69 0.00 0.00 178.15 178.60 1q8a h VAL 376 N -0.47 0.94 0.02 1.67 2.07 -1.19 -0.98 116.25 118.31 1q8a h VAL 376 Ca 0.01 -0.24 -0.24 0.00 0.82 0.00 0.00 66.70 67.05 1q8a h VAL 376 Cb 0.47 0.17 -0.03 0.00 -1.52 0.00 0.00 31.29 30.39 1q8a h VAL 376 CO -0.10 0.13 -1.19 -0.61 0.02 0.00 0.00 177.57 175.82 1q8a h GLN 377 N 0.70 0.05 0.04 1.57 4.15 -1.14 -3.40 115.11 117.09 1q8a h GLN 377 Ca 0.36 -0.08 -0.00 0.00 0.77 0.00 0.00 58.65 59.70 1q8a h GLN 377 Cb 0.46 0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.19 1q8a h GLN 377 CO -0.14 0.95 -0.02 1.15 -1.93 0.00 0.00 178.83 178.84 1q8a h THR 378 N 0.01 1.33 -0.75 2.39 2.02 0.69 -3.39 112.91 115.22 1q8a h THR 378 Ca -0.09 -1.67 0.16 0.00 0.77 0.00 0.00 66.41 65.58 1q8a h THR 378 Cb 1.85 2.37 -0.11 0.00 -1.74 0.00 0.00 68.15 70.52 1q8a h THR 378 CO 0.13 0.40 0.22 -0.07 0.37 0.00 0.00 175.52 176.57 1q8a h LEU 379 N -0.85 0.09 -1.85 2.58 3.38 -1.43 -1.27 115.31 115.96 1q8a h LEU 379 Ca -0.01 0.14 0.04 0.00 0.09 0.00 0.00 57.88 58.15 1q8a h LEU 379 Cb 0.69 0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.59 1q8a h LEU 379 CO 0.01 -0.01 0.19 -0.65 0.09 0.00 0.00 178.44 178.07 1q8a h PRO 380 N 0.31 0.18 0.11 1.13 0.11 -1.75 0.19 132.00 132.29 1q8a h PRO 380 Ca 0.43 -0.01 -0.16 0.00 0.11 0.00 0.00 66.00 66.37 1q8a h PRO 380 Cb 0.72 -0.04 0.02 0.00 0.11 0.00 0.00 31.00 31.81 1q8a h PRO 380 CO -0.49 0.12 -0.71 1.88 -0.21 0.00 0.00 178.00 178.59 1q8a h TYR 381 N 0.19 0.44 0.10 0.65 -1.99 -1.45 -2.17 116.97 112.73 1q8a h TYR 381 Ca 0.12 -0.32 -0.26 0.00 2.00 0.00 0.00 58.73 60.27 1q8a h TYR 381 Cb 0.25 -0.02 0.03 0.00 2.00 0.00 0.00 36.73 38.98 1q8a h TYR 381 CO -0.00 1.27 -1.07 -0.24 -0.00 0.00 0.00 178.16 178.12 1q8a h VAL 382 N -0.49 1.33 0.00 -2.88 3.04 -1.21 -3.31 116.25 112.73 1q8a h VAL 382 Ca -0.13 -2.39 -0.01 0.00 -1.01 0.00 0.00 66.70 63.16 1q8a h VAL 382 Cb 1.53 2.73 -0.00 0.00 -2.01 0.00 0.00 31.29 33.54 1q8a h VAL 382 CO 0.12 0.72 -0.84 0.77 -1.01 0.00 0.00 177.57 177.32 1q8a h SER 383 N 0.14 0.00 0.00 3.17 4.64 -0.83 -3.49 113.55 117.18 1q8a h SER 383 Ca -0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 1q8a h SER 383 Cb 1.77 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.86 1q8a h SER 383 CO 0.21 0.05 0.00 0.59 -0.87 0.00 0.00 176.83 176.80 1q8a n ASN 384 N -2.78 0.00 -4.95 4.97 4.13 -0.82 -4.95 115.26 110.87 1q8a n ASN 384 Ca 0.00 0.00 -0.20 0.00 1.68 0.00 0.00 54.58 56.06 1q8a n ASN 384 Cb 0.57 -0.09 -0.02 0.00 -1.54 0.00 0.00 39.78 38.71 1q8a n ASN 384 CO 0.00 0.00 0.00 0.68 0.28 0.00 0.00 177.26 178.22 1q8a s VAL 385 N -1.44 4.41 0.80 2.41 -7.23 -1.25 -4.04 120.40 114.06 1q8a s VAL 385 Ca 0.00 -1.08 -0.10 0.00 -1.81 0.00 0.00 61.98 58.98 1q8a s VAL 385 Cb 0.00 -3.52 0.08 0.00 0.56 0.00 0.00 36.38 33.49 1q8a s VAL 385 CO 0.00 -0.23 1.10 -2.84 -0.31 0.00 0.00 175.10 172.82 1q8a s PRO 386 N -4.06 2.00 0.05 4.82 0.02 -1.26 -4.31 135.00 132.26 1q8a s PRO 386 Ca 0.40 1.25 0.06 0.00 0.02 0.00 0.00 61.00 62.73 1q8a s PRO 386 Cb -0.09 -1.86 -0.03 0.00 0.02 0.00 0.00 34.50 32.54 1q8a s PRO 386 CO 0.29 -1.85 -0.12 -0.51 -0.33 0.00 0.00 177.00 174.48 1q8a s LEU 387 N -6.05 2.90 -0.40 -5.54 1.43 -1.26 -1.47 118.68 108.28 1q8a s LEU 387 Ca 0.62 -0.33 -0.12 0.00 -1.03 0.00 0.00 54.13 53.27 1q8a s LEU 387 Cb -0.18 -1.70 0.03 0.00 0.03 0.00 0.00 46.19 44.37 1q8a s LEU 387 CO 0.56 0.24 0.26 -0.55 0.23 0.00 0.00 176.35 177.09 1q8a s SER 388 N -1.67 5.88 -0.51 2.29 0.15 0.26 -2.44 113.70 117.66 1q8a s SER 388 Ca 0.17 -1.04 -0.27 0.00 0.70 0.00 0.00 55.95 55.51 1q8a s SER 388 Cb -0.11 -2.08 0.03 0.00 -1.71 0.00 0.00 66.02 62.16 1q8a s SER 388 CO 0.08 -0.44 1.03 -0.76 1.20 0.00 0.00 173.24 174.36 1q8a s LEU 389 N 1.59 3.82 -0.84 3.45 1.43 -0.38 -0.81 118.68 126.95 1q8a s LEU 389 Ca 0.03 0.10 -0.14 0.00 -1.03 0.00 0.00 54.13 53.09 1q8a s LEU 389 Cb -0.20 -3.20 0.22 0.00 0.03 0.00 0.00 46.19 43.05 1q8a s LEU 389 CO 0.07 -1.22 0.79 -0.62 0.23 0.00 0.00 176.35 175.60 1q8a s ASP 390 N 2.57 6.78 -0.01 2.29 -1.08 0.42 0.15 116.67 127.80 1q8a s ASP 390 Ca 0.39 -2.71 0.02 0.00 -0.52 0.00 0.00 52.55 49.73 1q8a s ASP 390 Cb -0.09 -2.22 -0.00 0.00 -1.46 0.00 0.00 42.92 39.15 1q8a s ASP 390 CO 0.26 -0.58 -0.06 -0.63 0.52 0.00 0.00 175.17 174.68 1q8a s ILE 391 N 0.18 0.53 -0.26 4.11 1.01 -1.26 -4.17 121.20 121.34 1q8a s ILE 391 Ca 0.19 -0.26 -0.16 0.00 0.00 0.00 0.00 60.65 60.42 1q8a s ILE 391 Cb -0.10 -0.46 -0.14 0.00 0.01 0.00 0.00 42.46 41.77 1q8a s ILE 391 CO -0.09 0.16 -0.20 0.00 0.00 0.00 0.00 174.94 174.81 1q8a n GLN 392 N 3.10 0.58 -1.69 2.79 6.02 -1.26 -4.93 117.38 121.99 1q8a n GLN 392 Ca -0.15 0.35 -0.43 0.00 -0.01 0.00 0.00 57.00 56.76 1q8a n GLN 392 Cb 0.56 -1.56 -0.03 0.00 1.02 0.00 0.00 30.24 30.23 1q8a n GLN 392 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 1q8a n ASN 393 N -4.31 4.03 0.22 1.08 2.85 -1.26 -4.88 115.26 113.00 1q8a n ASN 393 Ca -0.47 0.98 0.06 0.00 -0.11 0.00 0.00 54.58 55.03 1q8a n ASN 393 Cb 0.82 -1.54 0.51 0.00 1.24 0.00 0.00 39.78 40.81 1q8a n ASN 393 CO 0.00 0.00 0.00 1.62 -2.11 0.00 0.00 177.26 176.77 1q8a h VAL 394 N 4.78 1.08 -0.19 3.44 3.04 -1.99 -0.79 116.25 125.61 1q8a h VAL 394 Ca -0.47 -0.74 -0.21 0.00 -1.01 0.00 0.00 66.70 64.28 1q8a h VAL 394 Cb 1.23 1.40 0.01 0.00 -2.01 0.00 0.00 31.29 31.92 1q8a h VAL 394 CO 0.95 0.21 -0.71 0.44 -1.01 0.00 0.00 177.57 177.45 1q8a h ASP 395 N 0.00 0.93 0.26 3.17 5.19 -2.00 -2.20 116.42 121.77 1q8a h ASP 395 Ca -0.00 -0.58 -0.13 0.00 -0.62 0.00 0.00 57.03 55.70 1q8a h ASP 395 Cb 0.39 -0.27 -0.01 0.00 0.18 0.00 0.00 39.33 39.61 1q8a h ASP 395 CO 0.03 1.37 -0.52 0.25 -3.12 0.00 0.00 179.24 177.25 1q8a h LEU 396 N 0.57 0.31 -0.04 1.55 5.85 -1.86 -2.11 115.31 119.58 1q8a h LEU 396 Ca -0.03 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.53 1q8a h LEU 396 Cb 1.33 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 42.26 1q8a h LEU 396 CO 0.15 0.78 0.03 0.74 -0.34 0.00 0.00 178.44 179.79 1q8a h THR 397 N 0.23 1.01 -0.17 1.05 2.02 -1.07 0.29 112.91 116.26 1q8a h THR 397 Ca 0.01 -0.02 0.00 0.00 0.77 0.00 0.00 66.41 67.17 1q8a h THR 397 Cb 0.99 0.95 -0.01 0.00 -1.74 0.00 0.00 68.15 68.34 1q8a h THR 397 CO 0.08 0.01 0.11 -0.08 0.37 0.00 0.00 175.52 176.01 1q8a h GLU 398 N 0.05 0.23 -0.92 6.66 4.81 -1.22 -0.58 114.58 123.62 1q8a h GLU 398 Ca 0.01 -0.02 0.07 0.00 -0.13 0.00 0.00 59.36 59.30 1q8a h GLU 398 Cb -0.01 -0.05 -0.07 0.00 0.63 0.00 0.00 28.75 29.26 1q8a h GLU 398 CO -0.00 0.18 0.57 0.00 -0.73 0.00 0.00 179.01 179.03 1q8a h ARG 399 N 0.22 1.00 -0.25 1.92 -0.00 -1.12 -1.42 114.38 114.72 1q8a h ARG 399 Ca 0.06 -0.06 -0.17 0.00 -0.50 0.00 0.00 59.98 59.31 1q8a h ARG 399 Cb 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 29.97 29.75 1q8a h ARG 399 CO -0.01 0.66 -0.50 0.00 0.00 0.00 0.00 179.97 180.11 1q8a h ALA 400 N 1.44 0.40 -0.37 0.04 0.00 -0.62 -2.97 119.26 117.18 1q8a h ALA 400 Ca 0.41 -0.50 -0.09 0.00 0.00 0.00 0.00 54.91 54.73 1q8a h ALA 400 Cb 0.22 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1q8a h ALA 400 CO -0.19 0.59 -0.13 -0.07 0.00 0.00 0.00 179.25 179.45 1q8a h LEU 401 N 0.54 0.75 -1.21 0.00 3.38 -0.89 -2.37 115.31 115.52 1q8a h LEU 401 Ca 0.01 -0.39 -0.07 0.00 0.09 0.00 0.00 57.88 57.52 1q8a h LEU 401 Cb 1.11 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.64 1q8a h LEU 401 CO 0.11 0.96 -0.22 0.08 0.09 0.00 0.00 178.44 179.46 1q8a h ARG 402 N 0.53 0.27 -0.14 1.13 0.11 -1.31 -2.85 114.38 112.12 1q8a h ARG 402 Ca 0.09 -0.08 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1q8a h ARG 402 Cb 0.66 -0.03 0.00 0.00 1.11 0.00 0.00 29.97 31.71 1q8a h ARG 402 CO 0.04 0.49 0.00 0.00 0.10 0.00 0.00 179.97 180.60 1q8a n ALA 403 N -2.48 2.50 -2.55 0.08 0.00 -1.12 -4.93 120.51 112.01 1q8a n ALA 403 Ca -0.01 -0.63 -0.43 0.00 0.00 0.00 0.00 53.44 52.37 1q8a n ALA 403 Cb 0.35 -1.01 -0.02 0.00 0.00 0.00 0.00 19.45 18.77 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 -1.84 3.27 -1.24 0.00 6.14 -0.90 -4.50 117.35 118.28 1q8a s TYR 404 Ca 0.34 1.34 -0.16 0.00 0.64 0.00 0.00 57.07 59.23 1q8a s TYR 404 Cb 0.20 -3.34 -0.03 0.00 0.42 0.00 0.00 41.96 39.21 1q8a s TYR 404 CO 0.30 -0.92 2.18 -0.35 0.64 0.00 0.00 175.55 177.40 1q8a n PRO 405 N 5.42 2.47 -1.44 4.97 -0.04 -1.26 -4.79 135.00 140.33 1q8a n PRO 405 Ca 0.11 -2.31 0.00 0.00 -0.04 0.00 0.00 63.50 61.26 1q8a n PRO 405 Cb 0.47 -3.12 0.00 0.00 -0.04 0.00 0.00 33.50 30.81 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 4.18 0.25 3.28 0.55 0.00 -1.26 -3.36 105.19 108.83 1q8a n GLY 406 Ca 0.53 -1.44 -0.39 0.00 0.00 0.00 0.00 46.02 44.71 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 2.60 0.66 1.61 3.52 -1.15 -4.88 118.95 119.31 1q8a s ARG 407 Ca 0.00 -1.31 -0.01 0.00 -0.13 0.00 0.00 55.73 54.27 1q8a s ARG 407 Cb 0.00 -3.63 0.08 0.00 -1.56 0.00 0.00 34.95 29.84 1q8a s ARG 407 CO 0.00 -0.81 0.92 -1.54 -0.81 0.00 0.00 175.30 173.06 1q8a s SER 408 N 1.73 4.75 -0.19 -2.12 1.04 -1.26 -0.53 113.70 117.12 1q8a s SER 408 Ca 0.01 -0.07 -0.05 0.00 0.48 0.00 0.00 55.95 56.32 1q8a s SER 408 Cb -0.21 -0.54 -0.03 0.00 0.10 0.00 0.00 66.02 65.34 1q8a s SER 408 CO 0.03 -1.57 0.00 -0.22 0.98 0.00 0.00 173.24 172.46 1q8a s LEU 409 N -5.04 3.35 -0.25 2.42 2.96 -1.02 -0.21 118.68 120.89 1q8a s LEU 409 Ca 0.62 -0.14 -0.13 0.00 -0.22 0.00 0.00 54.13 54.26 1q8a s LEU 409 Cb -0.08 -1.84 -0.04 0.00 0.50 0.00 0.00 46.19 44.73 1q8a s LEU 409 CO 0.42 0.11 0.28 0.12 -1.32 0.00 0.00 176.35 175.96 1q8a s PHE 410 N 0.75 3.28 -0.61 5.38 5.36 0.22 -1.25 117.98 131.11 1q8a s PHE 410 Ca 0.00 0.34 -0.28 0.00 -0.96 0.00 0.00 56.93 56.03 1q8a s PHE 410 Cb -0.14 -2.44 0.03 0.00 -0.34 0.00 0.00 43.02 40.13 1q8a s PHE 410 CO 0.02 -0.09 1.22 1.21 -1.46 0.00 0.00 175.22 176.12 1q8a s ASN 411 N 1.40 6.39 0.22 6.13 3.84 0.12 -1.69 114.94 131.34 1q8a s ASN 411 Ca 0.12 0.02 0.00 0.00 0.21 0.00 0.00 52.86 53.21 1q8a s ASN 411 Cb -0.15 -2.55 0.00 0.00 -0.55 0.00 0.00 41.25 38.00 1q8a s ASN 411 CO 0.08 -1.55 0.00 -1.54 -2.79 0.00 0.00 177.10 171.30 1q8a n SER 412 N 8.65 -6.76 -3.83 -4.21 3.41 -1.21 -4.15 113.62 105.52 1q8a n SER 412 Ca 0.08 0.88 -0.20 0.00 -0.26 0.00 0.00 58.87 59.37 1q8a n SER 412 Cb 0.49 -3.13 -0.17 0.00 -0.26 0.00 0.00 64.21 61.15 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 -1.29 0.54 0.82 7.33 0.00 -0.66 -4.98 121.76 123.53 1q8a s ALA 413 Ca 0.00 0.01 -0.08 0.00 0.00 0.00 0.00 51.96 51.89 1q8a s ALA 413 Cb 0.00 -0.48 0.15 0.00 0.00 0.00 0.00 23.12 22.79 1q8a s ALA 413 CO 0.00 -0.16 1.13 0.15 0.00 0.00 0.00 175.76 176.88 1q8a s LYS 414 N 1.26 1.30 -1.32 0.00 1.02 -1.26 -1.17 119.74 119.57 1q8a s LYS 414 Ca -0.06 -0.72 -0.10 0.00 0.02 0.00 0.00 55.97 55.10 1q8a s LYS 414 Cb -0.13 -2.11 0.14 0.00 -0.52 0.00 0.00 37.83 35.20 1q8a s LYS 414 CO -0.02 -1.83 1.96 0.28 -0.92 0.00 0.00 175.35 174.82 1q8a n VAL 415 N -3.24 4.14 -3.84 3.17 0.31 -1.24 -4.54 118.33 113.10 1q8a n VAL 415 Ca 0.14 -4.07 -0.27 0.00 -0.01 0.00 0.00 64.34 60.13 1q8a n VAL 415 Cb 0.60 -2.42 -0.17 0.00 -0.91 0.00 0.00 33.84 30.95 1q8a n VAL 415 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1q8a s ASP 416 N 1.40 2.74 0.29 4.52 -1.08 -1.26 -4.97 116.67 118.31 1q8a s ASP 416 Ca 0.41 -0.66 -0.01 0.00 -0.52 0.00 0.00 52.55 51.78 1q8a s ASP 416 Cb 0.11 -0.78 0.65 0.00 -1.46 0.00 0.00 42.92 41.44 1q8a s ASP 416 CO -0.02 -0.22 1.61 -0.33 0.52 0.00 0.00 175.17 176.73 1q8a h GLU 417 N 8.17 0.08 -0.32 4.34 5.08 -1.99 -0.19 114.58 129.75 1q8a h GLU 417 Ca -0.21 -0.01 -0.05 0.00 -1.00 0.00 0.00 59.36 58.10 1q8a h GLU 417 Cb 1.11 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.33 1q8a h GLU 417 CO 0.37 0.06 0.01 0.93 -1.00 0.00 0.00 179.01 179.38 1q8a h GLU 418 N 0.09 0.56 -0.45 2.33 5.08 -1.97 -1.26 114.58 118.95 1q8a h GLU 418 Ca 0.53 -0.17 -0.08 0.00 -1.00 0.00 0.00 59.36 58.65 1q8a h GLU 418 Cb 1.06 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.24 1q8a h GLU 418 CO -0.78 0.68 -0.04 1.49 -1.00 0.00 0.00 179.01 179.36 1q8a h GLU 419 N 0.36 0.77 -0.02 2.33 4.81 -1.59 -3.22 114.58 118.02 1q8a h GLU 419 Ca 0.09 -0.22 -0.02 0.00 -0.13 0.00 0.00 59.36 59.08 1q8a h GLU 419 Cb 0.42 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.72 1q8a h GLU 419 CO 0.01 0.80 -0.05 -0.07 -0.73 0.00 0.00 179.01 178.97 1q8a h LEU 420 N 0.71 0.09 -1.18 1.64 3.38 -1.02 -1.71 115.31 117.21 1q8a h LEU 420 Ca 0.13 -0.58 0.00 0.00 0.09 0.00 0.00 57.88 57.53 1q8a h LEU 420 Cb 0.49 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1q8a h LEU 420 CO 0.03 0.65 0.00 1.21 0.09 0.00 0.00 178.44 180.41 1q8a n GLU 421 N -4.74 0.00 0.00 1.13 2.13 -0.48 0.43 120.64 119.11 1q8a n GLU 421 Ca -0.08 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.74 1q8a n GLU 421 Cb 0.32 -0.93 0.00 0.00 0.27 0.00 0.00 31.44 31.10 1q8a n GLU 421 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1q8a n LYS 423 N 0.45 0.00 -0.21 5.31 5.02 -0.65 -1.01 118.16 127.08 1q8a n LYS 423 Ca 0.00 0.00 -0.09 0.00 -2.02 0.00 0.00 58.31 56.20 1q8a n LYS 423 Cb 0.00 0.00 0.02 0.00 -0.02 0.00 0.00 35.03 35.03 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 1.26 -0.80 -0.18 2.04 -0.27 -1.60 117.51 117.96 1q8a h ILE 424 Ca 0.00 -1.06 -0.04 0.00 1.00 0.00 0.00 64.86 64.76 1q8a h ILE 424 Cb 0.00 0.77 -0.04 0.00 -0.74 0.00 0.00 36.82 36.81 1q8a h ILE 424 CO 0.00 0.39 0.34 0.78 0.00 0.00 0.00 178.15 179.66 1q8a h ASN 425 N 0.92 1.08 -0.61 1.72 2.35 -1.28 0.77 115.58 120.54 1q8a h ASN 425 Ca 0.18 -0.16 -0.04 0.00 -0.55 0.00 0.00 56.30 55.73 1q8a h ASN 425 Cb 0.48 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 38.54 1q8a h ASN 425 CO 0.02 0.94 0.21 -0.07 -1.65 0.00 0.00 177.43 176.88 1q8a h LEU 426 N 1.16 0.87 -0.76 1.61 3.38 -1.74 -1.92 115.31 117.91 1q8a h LEU 426 Ca 0.27 -0.19 -0.12 0.00 0.09 0.00 0.00 57.88 57.92 1q8a h LEU 426 Cb 0.19 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1q8a h LEU 426 CO -0.03 0.83 -0.40 -0.07 0.09 0.00 0.00 178.44 178.87 1q8a h LEU 427 N 0.86 0.49 -1.09 1.67 3.38 -0.78 0.12 115.31 119.97 1q8a h LEU 427 Ca 0.20 -0.21 -0.06 0.00 0.09 0.00 0.00 57.88 57.90 1q8a h LEU 427 Cb 0.26 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 1q8a h LEU 427 CO -0.01 0.84 -0.00 0.11 0.09 0.00 0.00 178.44 179.47 1q8a h LYS 428 N 0.39 0.64 0.00 1.13 1.57 -0.65 0.60 116.57 120.24 1q8a h LYS 428 Ca 0.03 -0.15 -0.01 0.00 -1.87 0.00 0.00 60.65 58.65 1q8a h LYS 428 Cb 0.87 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.10 1q8a h LYS 428 CO 0.07 0.66 -0.04 -0.22 -0.57 0.00 0.00 179.45 179.35 1q8a h LYS 429 N 0.60 0.03 -0.02 3.15 3.64 -1.02 -3.38 116.57 119.57 1q8a h LYS 429 Ca 0.12 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 1q8a h LYS 429 Cb 0.38 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 1q8a h LYS 429 CO 0.01 0.87 -0.36 0.66 -2.27 0.00 0.00 179.45 178.36 1q8a n TYR 430 N -4.65 0.00 0.00 1.91 4.01 0.00 -4.78 117.16 113.65 1q8a n TYR 430 Ca -0.10 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.64 1q8a n TYR 430 Cb 0.43 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.45 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 1.40 -0.97 0.00 2.72 0.00 0.21 -4.88 105.19 103.66 1q8a n GLY 431 Ca 0.11 -1.61 0.00 0.00 0.00 0.00 0.00 46.02 44.52 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 -0.71 3.04 3.69 -0.02 0.00 -1.25 -4.67 105.19 105.26 1q8a n GLY 432 Ca 0.00 -1.96 -0.24 0.00 0.00 0.00 0.00 46.02 43.83 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 -2.22 2.96 -0.04 2.61 -4.23 0.71 -4.89 115.64 110.54 1q8a s THR 433 Ca 0.00 -1.81 0.03 0.00 -1.18 0.00 0.00 61.69 58.73 1q8a s THR 433 Cb 0.00 -2.91 0.01 0.00 1.34 0.00 0.00 72.50 70.94 1q8a s THR 433 CO 0.00 -0.21 -0.10 -0.22 -0.54 0.00 0.00 174.62 173.55 1q8a s LEU 434 N -3.78 1.74 -0.20 4.79 2.96 -0.05 0.69 118.68 124.82 1q8a s LEU 434 Ca 0.36 -0.22 -0.23 0.00 -0.22 0.00 0.00 54.13 53.81 1q8a s LEU 434 Cb -0.02 -0.65 -0.02 0.00 0.50 0.00 0.00 46.19 46.01 1q8a s LEU 434 CO 0.21 0.06 0.75 -0.63 -1.32 0.00 0.00 176.35 175.42 1q8a s ILE 435 N 0.32 4.93 -0.32 6.68 1.01 -0.68 -1.04 121.20 132.10 1q8a s ILE 435 Ca -0.06 1.43 -0.07 0.00 0.00 0.00 0.00 60.65 61.95 1q8a s ILE 435 Cb -0.11 -4.05 0.02 0.00 0.01 0.00 0.00 42.46 38.33 1q8a s ILE 435 CO 0.01 0.04 0.11 -0.69 0.00 0.00 0.00 174.94 174.41 1q8a s VAL 436 N 2.18 4.05 -0.24 2.92 1.01 0.17 -1.65 120.40 128.85 1q8a s VAL 436 Ca 0.34 -0.79 -0.26 0.00 0.00 0.00 0.00 61.98 61.26 1q8a s VAL 436 Cb -0.16 -3.16 0.00 0.00 0.00 0.00 0.00 36.38 33.06 1q8a s VAL 436 CO 0.11 -0.02 0.91 -0.22 0.00 0.00 0.00 175.10 175.88 1q8a s LEU 437 N 1.49 4.09 0.00 3.92 2.96 -0.32 -1.20 118.68 129.62 1q8a s LEU 437 Ca 0.02 1.16 0.00 0.00 -0.22 0.00 0.00 54.13 55.09 1q8a s LEU 437 Cb -0.18 -3.32 0.00 0.00 0.50 0.00 0.00 46.19 43.19 1q8a s LEU 437 CO 0.03 -0.58 0.00 0.18 -1.32 0.00 0.00 176.35 174.67 1q8a n LEU 438 N 6.13 0.00 0.00 -0.68 4.77 -0.40 -3.59 117.00 123.23 1q8a n LEU 438 Ca 0.08 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 1q8a n LEU 438 Cb 0.47 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 1q8a n LEU 438 CO 0.49 0.00 0.00 -0.24 -1.33 0.00 0.00 177.39 176.31 1q8a n SER 446 N 0.00 0.00 0.07 -1.43 2.88 -1.26 -4.83 113.62 109.04 1q8a n SER 446 Ca 0.00 0.00 -0.21 0.00 -1.33 0.00 0.00 58.87 57.33 1q8a n SER 446 Cb 0.00 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.33 1q8a n SER 446 CO 0.00 0.00 0.00 0.15 -1.23 0.00 0.00 175.04 173.96 1q8a h PHE 447 N 0.00 0.94 -0.27 0.66 3.57 -1.97 -2.57 116.94 117.30 1q8a h PHE 447 Ca 0.00 -0.57 -0.07 0.00 3.53 0.00 0.00 57.97 60.86 1q8a h PHE 447 Cb 0.00 -0.08 -0.02 0.00 2.79 0.00 0.00 35.95 38.64 1q8a h PHE 447 CO 0.00 1.42 -0.12 0.93 -2.23 0.00 0.00 178.31 178.30 1q8a h GLU 448 N 0.20 0.45 -0.12 1.11 3.07 -1.99 -1.93 114.58 115.37 1q8a h GLU 448 Ca -0.16 -0.13 -0.04 0.00 -0.50 0.00 0.00 59.36 58.53 1q8a h GLU 448 Cb 1.79 -0.05 -0.00 0.00 -0.84 0.00 0.00 28.75 29.65 1q8a h GLU 448 CO 0.21 0.58 -0.08 0.93 -1.40 0.00 0.00 179.01 179.25 1q8a h GLU 449 N 0.42 0.25 -0.68 2.33 5.08 -2.00 -2.15 114.58 117.83 1q8a h GLU 449 Ca 0.08 -0.12 0.05 0.00 -1.00 0.00 0.00 59.36 58.37 1q8a h GLU 449 Cb 0.47 -0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.68 1q8a h GLU 449 CO 0.03 0.62 0.45 0.00 -1.00 0.00 0.00 179.01 179.11 1q8a h ARG 450 N -0.12 0.72 -0.28 2.33 3.08 -1.26 -1.85 114.38 117.01 1q8a h ARG 450 Ca 0.02 -0.04 -0.15 0.00 0.07 0.00 0.00 59.98 59.88 1q8a h ARG 450 Cb 0.56 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.44 1q8a h ARG 450 CO 0.02 0.48 -0.43 -0.22 -1.07 0.00 0.00 179.97 178.75 1q8a h LYS 451 N 0.74 0.69 -0.30 0.04 3.64 -1.19 0.47 116.57 120.67 1q8a h LYS 451 Ca 0.28 -0.37 -0.10 0.00 -1.27 0.00 0.00 60.65 59.19 1q8a h LYS 451 Cb 0.19 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.01 1q8a h LYS 451 CO -0.09 0.99 -0.23 1.05 -2.27 0.00 0.00 179.45 178.90 1q8a h GLU 452 N 0.56 0.57 -0.27 1.90 4.11 -0.77 0.19 114.58 120.87 1q8a h GLU 452 Ca 0.04 -0.22 -0.10 0.00 0.07 0.00 0.00 59.36 59.15 1q8a h GLU 452 Cb 0.97 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.17 1q8a h GLU 452 CO 0.09 0.76 -0.26 1.88 0.07 0.00 0.00 179.01 181.55 1q8a h TYR 453 N 0.50 0.59 0.17 2.06 0.99 -1.06 0.82 116.97 121.05 1q8a h TYR 453 Ca 0.07 -0.13 -0.01 0.00 2.00 0.00 0.00 58.73 60.66 1q8a h TYR 453 Cb 0.68 -0.14 0.00 0.00 1.00 0.00 0.00 36.73 38.26 1q8a h TYR 453 CO 0.03 0.74 -0.08 0.35 -0.00 0.00 0.00 178.16 179.20 1q8a h PHE 454 N 0.46 -0.21 -0.43 4.88 3.57 0.23 -0.87 116.94 124.58 1q8a h PHE 454 Ca 0.06 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.50 1q8a h PHE 454 Cb 0.70 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.49 1q8a h PHE 454 CO 0.03 0.00 0.04 0.93 -2.23 0.00 0.00 178.31 177.07 1q8a h GLU 455 N -0.40 0.67 0.64 1.11 3.07 -0.49 -0.08 114.58 119.10 1q8a h GLU 455 Ca -0.02 -0.15 -0.03 0.00 -0.50 0.00 0.00 59.36 58.66 1q8a h GLU 455 Cb 0.31 -0.09 0.01 0.00 -0.84 0.00 0.00 28.75 28.13 1q8a h GLU 455 CO 0.04 0.66 -0.31 -0.22 -1.40 0.00 0.00 179.01 177.79 1q8a h LYS 456 N 0.64 -0.82 -0.96 2.33 3.64 -0.71 -2.23 116.57 118.46 1q8a h LYS 456 Ca 0.14 0.06 0.24 0.00 -1.27 0.00 0.00 60.65 59.82 1q8a h LYS 456 Cb 0.35 0.19 -0.06 0.00 -0.41 0.00 0.00 32.23 32.29 1q8a h LYS 456 CO 0.01 -0.55 0.65 0.00 -2.27 0.00 0.00 179.45 177.29 1q8a h ALA 457 N -1.53 2.44 -0.31 5.00 0.00 -1.06 -0.28 119.26 123.52 1q8a h ALA 457 Ca -0.09 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1q8a h ALA 457 Cb 0.66 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1q8a h ALA 457 CO 0.14 -0.75 0.16 1.25 0.00 0.00 0.00 179.25 180.05 1q8a h LEU 458 N 0.27 0.39 -0.59 0.00 5.85 -0.72 0.31 115.31 120.82 1q8a h LEU 458 Ca 0.50 -0.11 -0.04 0.00 0.84 0.00 0.00 57.88 59.08 1q8a h LEU 458 Cb 1.47 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 42.38 1q8a h LEU 458 CO -0.15 0.38 0.23 0.11 -0.34 0.00 0.00 178.44 178.67 1q8a h LYS 459 N 0.37 0.88 0.88 1.25 1.57 -0.46 -1.39 116.57 119.68 1q8a h LYS 459 Ca 0.11 -0.16 -0.04 0.00 -1.87 0.00 0.00 60.65 58.68 1q8a h LYS 459 Cb 0.09 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.26 1q8a h LYS 459 CO -0.02 0.76 -0.46 0.82 -0.57 0.00 0.00 179.45 179.98 1q8a h ILE 460 N 0.82 0.06 -0.82 1.86 2.04 -1.26 -1.32 117.51 118.89 1q8a h ILE 460 Ca 0.20 0.00 0.23 0.00 1.00 0.00 0.00 64.86 66.28 1q8a h ILE 460 Cb 0.21 0.06 -0.04 0.00 -0.74 0.00 0.00 36.82 36.31 1q8a h ILE 460 CO -0.02 0.00 0.58 -0.07 0.00 0.00 0.00 178.15 178.65 1q8a h LEU 461 N -1.24 0.08 -0.23 1.44 4.07 -0.87 0.96 115.31 119.52 1q8a h LEU 461 Ca -0.12 0.01 -0.11 0.00 0.08 0.00 0.00 57.88 57.74 1q8a h LEU 461 Cb 0.96 -0.01 -0.00 0.00 1.08 0.00 0.00 40.66 42.70 1q8a h LEU 461 CO 0.17 0.03 -0.30 -0.33 -1.08 0.00 0.00 178.44 176.93 1q8a h GLU 462 N 0.07 0.60 -0.62 1.13 4.39 -0.87 0.18 114.58 119.47 1q8a h GLU 462 Ca 0.40 -0.35 0.13 0.00 0.34 0.00 0.00 59.36 59.88 1q8a h GLU 462 Cb 1.47 0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 30.11 1q8a h GLU 462 CO -0.04 0.95 0.42 0.00 -1.16 0.00 0.00 179.01 179.19 1q8a h ARG 463 N 0.30 0.27 -0.40 2.33 3.08 0.35 -1.72 114.38 118.59 1q8a h ARG 463 Ca 0.03 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1q8a h ARG 463 Cb 0.87 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.86 1q8a h ARG 463 CO 0.07 0.18 0.00 0.72 -1.07 0.00 0.00 179.97 179.87 1q8a n HIS 464 N -4.45 1.34 -4.12 3.04 8.25 -0.99 -4.97 115.22 113.33 1q8a n HIS 464 Ca 0.11 -0.79 -0.32 0.00 -0.26 0.00 0.00 57.72 56.46 1q8a n HIS 464 Cb 0.50 -0.36 -0.06 0.00 1.12 0.00 0.00 29.99 31.18 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 0.04 -0.37 0.00 0.41 4.64 -0.65 -4.79 116.55 115.84 1q8a n ASP 465 Ca 0.23 -1.16 0.00 0.00 -1.38 0.00 0.00 54.79 52.48 1q8a n ASP 465 Cb 0.97 -1.43 0.00 0.00 -1.04 0.00 0.00 41.12 39.62 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 -4.36 0.00 -0.34 -0.67 -0.00 -0.00 -4.80 117.46 107.28 1q8a n PHE 466 Ca -0.24 -0.13 0.17 0.00 -0.00 0.00 0.00 57.45 57.25 1q8a n PHE 466 Cb 0.60 -0.01 0.38 0.00 -0.00 0.00 0.00 39.48 40.44 1q8a n PHE 466 CO 0.00 0.00 0.00 0.77 -0.00 0.00 0.00 176.76 177.53 1q8a h SER 467 N 0.00 0.61 -0.06 -2.13 0.02 -1.85 -1.24 113.55 108.89 1q8a h SER 467 Ca 0.00 0.14 0.00 0.00 -0.84 0.00 0.00 61.79 61.09 1q8a h SER 467 Cb 0.18 0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.77 1q8a h SER 467 CO 0.00 0.08 0.00 -0.90 -1.14 0.00 0.00 176.83 174.87 1q8a n ASP 468 N -4.92 0.39 -0.81 3.07 5.75 -1.26 -3.76 116.55 115.01 1q8a n ASP 468 Ca 0.26 -1.80 0.03 0.00 -0.01 0.00 0.00 54.79 53.27 1q8a n ASP 468 Cb 0.74 -0.04 0.18 0.00 -1.03 0.00 0.00 41.12 40.97 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 -0.38 1.61 -4.12 0.11 1.74 -0.47 -4.93 116.66 110.22 1q8a n ARG 469 Ca 0.07 -3.27 -0.15 0.00 -0.77 0.00 0.00 57.85 53.74 1q8a n ARG 469 Cb 0.09 -1.53 -0.11 0.00 -1.02 0.00 0.00 32.46 29.88 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 -3.07 0.81 -0.05 1.55 -7.23 -1.25 -0.87 120.40 110.30 1q8a s VAL 470 Ca 0.39 -1.31 0.05 0.00 -1.81 0.00 0.00 61.98 59.30 1q8a s VAL 470 Cb 0.37 -0.96 -0.01 0.00 0.56 0.00 0.00 36.38 36.35 1q8a s VAL 470 CO -0.07 -0.39 -0.19 -0.63 -0.31 0.00 0.00 175.10 173.50 1q8a s ILE 471 N -1.67 1.60 -0.05 -0.62 1.01 -0.21 -4.49 121.20 116.77 1q8a s ILE 471 Ca -0.03 -0.81 -0.12 0.00 0.00 0.00 0.00 60.65 59.68 1q8a s ILE 471 Cb -0.08 -1.37 -0.05 0.00 0.01 0.00 0.00 42.46 40.97 1q8a s ILE 471 CO 0.01 0.46 0.32 -0.36 0.00 0.00 0.00 174.94 175.36 1q8a s PHE 472 N -0.04 3.67 -0.30 3.97 0.40 -0.42 -0.66 117.98 124.60 1q8a s PHE 472 Ca -0.03 0.82 -0.05 0.00 -0.60 0.00 0.00 56.93 57.08 1q8a s PHE 472 Cb -0.12 -2.19 0.03 0.00 0.51 0.00 0.00 43.02 41.25 1q8a s PHE 472 CO 0.02 0.64 0.04 0.34 0.70 0.00 0.00 175.22 176.97 1q8a s ASP 473 N -0.92 4.99 0.55 1.36 3.68 -0.34 -1.34 116.67 124.65 1q8a s ASP 473 Ca 0.21 -1.01 0.24 0.00 2.13 0.00 0.00 52.55 54.11 1q8a s ASP 473 Cb -0.15 -1.80 1.55 0.00 -1.45 0.00 0.00 42.92 41.07 1q8a s ASP 473 CO 0.10 -0.24 2.18 1.55 0.13 0.00 0.00 175.17 178.89 1q8a h PRO 474 N 8.14 0.00 -0.50 4.34 0.13 -1.85 -1.06 132.00 141.20 1q8a h PRO 474 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1q8a h PRO 474 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1q8a h PRO 474 CO 0.58 0.03 0.00 0.41 -0.23 0.00 0.00 178.00 178.79 1q8a n GLY 475 N -1.29 0.44 3.67 1.56 0.00 -1.26 -4.49 105.19 103.82 1q8a n GLY 475 Ca -0.03 -0.56 -0.43 0.00 0.00 0.00 0.00 46.02 45.00 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 -0.16 4.51 0.14 1.61 1.01 -1.26 -4.97 120.40 121.29 1q8a s VAL 476 Ca 0.00 1.82 0.05 0.00 0.00 0.00 0.00 61.98 63.84 1q8a s VAL 476 Cb 0.00 -4.17 -0.04 0.00 0.00 0.00 0.00 36.38 32.17 1q8a s VAL 476 CO 0.00 -0.09 0.11 -0.76 0.00 0.00 0.00 175.10 174.36 1q8a s LEU 477 N 2.80 3.75 -0.05 3.92 1.43 -1.26 -4.63 118.68 124.64 1q8a s LEU 477 Ca 0.50 -0.12 -0.30 0.00 -1.03 0.00 0.00 54.13 53.18 1q8a s LEU 477 Cb -0.19 -2.38 -0.07 0.00 0.03 0.00 0.00 46.19 43.57 1q8a s LEU 477 CO 0.14 0.10 1.86 -2.84 0.23 0.00 0.00 176.35 175.85 1q8a s PRO 478 N -2.88 4.01 0.58 1.29 0.02 -1.21 -4.43 135.00 132.38 1q8a s PRO 478 Ca 0.30 2.32 0.30 0.00 0.02 0.00 0.00 61.00 63.94 1q8a s PRO 478 Cb -0.11 -4.12 1.77 0.00 0.02 0.00 0.00 34.50 32.06 1q8a s PRO 478 CO 0.22 -1.08 2.22 1.37 -0.33 0.00 0.00 177.00 179.40 1q8a h LEU 479 N 11.10 0.00 -1.15 -5.54 -0.00 -1.71 0.11 115.31 118.13 1q8a h LEU 479 Ca -0.44 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.44 1q8a h LEU 479 Cb 1.21 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.87 1q8a h LEU 479 CO 0.95 0.02 0.00 0.61 -0.00 0.00 0.00 178.44 180.03 1q8a n GLY 480 N -1.19 1.12 2.70 0.17 0.00 -1.26 -2.58 105.19 104.15 1q8a n GLY 480 Ca -0.03 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.94 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 0.22 2.23 -1.20 4.61 0.00 0.34 -4.95 120.51 121.76 1q8a n ALA 481 Ca 0.00 -1.57 -0.07 0.00 0.00 0.00 0.00 53.44 51.80 1q8a n ALA 481 Cb 0.20 -0.92 -0.03 0.00 0.00 0.00 0.00 19.45 18.71 1q8a n ALA 481 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1q8a n GLU 482 N -0.87 -0.90 -0.31 0.00 -0.58 -1.07 -4.82 120.64 112.09 1q8a n GLU 482 Ca -0.06 0.66 0.14 0.00 -0.42 0.00 0.00 57.16 57.48 1q8a n GLU 482 Cb 0.85 -4.57 0.30 0.00 -0.57 0.00 0.00 31.44 27.45 1q8a n GLU 482 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 1q8a h GLY 483 N 0.00 1.32 -5.79 0.62 0.00 -1.43 -3.47 103.07 94.33 1q8a h GLY 483 Ca -0.14 0.05 -0.34 0.00 0.00 0.00 0.00 47.33 46.90 1q8a h GLY 483 CO 0.21 -0.45 -0.86 0.28 0.00 0.00 0.00 176.54 175.71 1q8a n LYS 484 N -5.35 -2.97 0.03 4.80 5.02 -1.26 -4.57 118.16 113.86 1q8a n LYS 484 Ca 0.22 0.72 0.22 0.00 -2.02 0.00 0.00 58.31 57.45 1q8a n LYS 484 Cb 0.74 -5.28 0.70 0.00 -0.02 0.00 0.00 35.03 31.17 1q8a n LYS 484 CO 0.00 0.00 0.00 -1.35 -0.52 0.00 0.00 177.40 175.53 1q8a h PRO 485 N -1.53 0.00 -0.93 1.97 0.11 -1.90 -0.53 132.00 129.19 1q8a h PRO 485 Ca -0.62 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.50 1q8a h PRO 485 Cb 1.34 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.40 1q8a h PRO 485 CO 0.48 0.00 0.62 0.28 -0.21 0.00 0.00 178.00 179.17 1q8a h VAL 486 N 0.00 1.23 -0.58 3.15 2.07 -2.00 -0.96 116.25 119.16 1q8a h VAL 486 Ca 0.25 -0.43 -0.05 0.00 0.82 0.00 0.00 66.70 67.30 1q8a h VAL 486 Cb 1.39 -0.13 -0.03 0.00 -1.52 0.00 0.00 31.29 31.00 1q8a h VAL 486 CO -0.00 0.23 0.18 -0.33 0.02 0.00 0.00 177.57 177.66 1q8a h GLU 487 N 1.26 0.88 -0.32 1.57 4.39 -1.43 -1.84 114.58 119.08 1q8a h GLU 487 Ca 0.34 -0.17 -0.09 0.00 0.34 0.00 0.00 59.36 59.79 1q8a h GLU 487 Cb -0.13 -0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 28.37 1q8a h GLU 487 CO -0.08 0.76 -0.16 0.28 -1.16 0.00 0.00 179.01 178.66 1q8a h VAL 488 N 0.85 1.29 -0.95 3.13 2.07 -1.43 -2.11 116.25 119.10 1q8a h VAL 488 Ca 0.19 -1.27 0.02 0.00 0.82 0.00 0.00 66.70 66.46 1q8a h VAL 488 Cb 0.25 1.42 -0.05 0.00 -1.52 0.00 0.00 31.29 31.40 1q8a h VAL 488 CO -0.01 0.41 0.63 -0.07 0.02 0.00 0.00 177.57 178.55 1q8a h LEU 489 N 0.44 1.07 -0.81 2.57 3.38 -0.91 -0.75 115.31 120.31 1q8a h LEU 489 Ca 0.07 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 1q8a h LEU 489 Cb 0.69 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 41.14 1q8a h LEU 489 CO 0.05 0.76 0.41 0.11 0.09 0.00 0.00 178.44 179.86 1q8a h LYS 490 N 1.26 1.15 -0.64 1.13 1.57 -1.14 -2.48 116.57 117.43 1q8a h LYS 490 Ca 0.36 -0.16 -0.04 0.00 -1.87 0.00 0.00 60.65 58.94 1q8a h LYS 490 Cb -0.10 -0.21 -0.03 0.00 0.08 0.00 0.00 32.23 31.97 1q8a h LYS 490 CO -0.09 0.88 0.25 1.15 -0.57 0.00 0.00 179.45 181.06 1q8a h THR 491 N 1.14 1.24 -0.55 -0.16 2.02 -0.60 -1.95 112.91 114.05 1q8a h THR 491 Ca 0.28 -0.75 0.02 0.00 0.77 0.00 0.00 66.41 66.74 1q8a h THR 491 Cb 0.09 0.53 -0.04 0.00 -1.74 0.00 0.00 68.15 67.00 1q8a h THR 491 CO -0.04 0.29 0.33 0.40 0.37 0.00 0.00 175.52 176.88 1q8a h ILE 492 N 0.90 1.07 -0.04 3.11 2.04 -0.88 -0.35 117.51 123.35 1q8a h ILE 492 Ca 0.21 -0.23 0.00 0.00 1.00 0.00 0.00 64.86 65.85 1q8a h ILE 492 Cb 0.21 0.35 -0.00 0.00 -0.74 0.00 0.00 36.82 36.64 1q8a h ILE 492 CO -0.02 0.12 0.03 -0.08 0.00 0.00 0.00 178.15 178.20 1q8a h GLU 493 N 0.66 0.05 -0.06 2.37 4.81 -1.15 -1.05 114.58 120.22 1q8a h GLU 493 Ca 0.22 -0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.48 1q8a h GLU 493 Cb 0.01 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.35 1q8a h GLU 493 CO -0.09 0.04 -0.13 0.35 -0.73 0.00 0.00 179.01 178.44 1q8a h PHE 494 N 0.05 -0.33 -0.68 0.92 3.57 -0.94 0.11 116.94 119.64 1q8a h PHE 494 Ca 0.01 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.52 1q8a h PHE 494 Cb -0.00 0.16 -0.03 0.00 2.79 0.00 0.00 35.95 38.86 1q8a h PHE 494 CO -0.08 -0.20 0.37 0.82 -2.23 0.00 0.00 178.31 177.00 1q8a h ILE 495 N -0.19 1.21 -0.89 1.41 2.04 -0.98 -1.90 117.51 118.21 1q8a h ILE 495 Ca 0.07 -0.54 -0.02 0.00 1.00 0.00 0.00 64.86 65.37 1q8a h ILE 495 Cb 0.28 0.33 -0.04 0.00 -0.74 0.00 0.00 36.82 36.66 1q8a h ILE 495 CO -0.18 0.23 0.48 0.28 0.00 0.00 0.00 178.15 178.97 1q8a h SER 496 N 0.93 1.12 0.03 1.72 0.02 -0.85 -1.18 113.55 115.34 1q8a h SER 496 Ca 0.24 -0.11 -0.00 0.00 -0.84 0.00 0.00 61.79 61.08 1q8a h SER 496 Cb 0.05 -0.29 -0.00 0.00 0.14 0.00 0.00 62.40 62.30 1q8a h SER 496 CO -0.04 0.91 -0.01 0.77 -1.14 0.00 0.00 176.83 177.32 1q8a h SER 497 N 1.25 0.00 0.05 3.07 4.64 -0.00 -0.49 113.55 122.07 1q8a h SER 497 Ca 0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.63 1q8a h SER 497 Cb 0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 1q8a h SER 497 CO -0.05 0.01 -0.03 0.29 -0.87 0.00 0.00 176.83 176.18 1q8a n LYS 498 N -4.01 1.34 -0.47 4.77 4.76 -0.46 -4.94 118.16 119.16 1q8a n LYS 498 Ca -0.03 -0.63 0.00 0.00 -2.87 0.00 0.00 58.31 54.78 1q8a n LYS 498 Cb 0.10 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 31.80 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 1.16 0.76 3.86 0.72 0.00 -0.19 -5.07 105.19 106.43 1q8a n GLY 499 Ca 0.19 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.08 3.40 0.67 1.61 0.40 -1.11 -5.03 117.98 115.83 1q8a s PHE 500 Ca 0.00 0.19 -0.12 0.00 -0.60 0.00 0.00 56.93 56.40 1q8a s PHE 500 Cb 0.00 -1.71 -0.00 0.00 0.51 0.00 0.00 43.02 41.81 1q8a s PHE 500 CO 0.00 0.57 1.06 -0.80 0.70 0.00 0.00 175.22 176.75 1q8a s ASN 501 N -2.41 5.46 0.07 1.36 0.01 -1.26 -4.14 114.94 114.03 1q8a s ASN 501 Ca 0.32 1.70 -0.01 0.00 -0.71 0.00 0.00 52.86 54.16 1q8a s ASN 501 Cb -0.13 -2.51 -0.04 0.00 0.41 0.00 0.00 41.25 38.98 1q8a s ASN 501 CO 0.25 -1.39 -0.02 0.42 -1.51 0.00 0.00 177.10 174.85 1q8a s THR 502 N -2.83 0.24 0.22 1.60 -4.23 -1.26 -1.30 115.64 108.09 1q8a s THR 502 Ca 0.60 -1.84 -0.16 0.00 -1.18 0.00 0.00 61.69 59.10 1q8a s THR 502 Cb -0.15 -1.65 0.02 0.00 1.34 0.00 0.00 72.50 72.06 1q8a s THR 502 CO 0.49 -0.88 0.54 0.28 -0.54 0.00 0.00 174.62 174.51 1q8a s THR 503 N -3.92 0.02 0.08 3.99 -1.32 -0.45 -2.04 115.64 112.00 1q8a s THR 503 Ca 0.11 -1.02 -0.13 0.00 -1.21 0.00 0.00 61.69 59.44 1q8a s THR 503 Cb 0.08 -1.84 0.02 0.00 -1.51 0.00 0.00 72.50 69.24 1q8a s THR 503 CO -0.07 -0.07 0.30 0.68 -2.21 0.00 0.00 174.62 173.25 1q8a s VAL 504 N -3.93 0.10 -0.90 5.08 -7.23 -1.24 -3.90 120.40 108.38 1q8a s VAL 504 Ca 0.14 -0.79 -0.16 0.00 -1.81 0.00 0.00 61.98 59.36 1q8a s VAL 504 Cb -0.02 -1.11 0.18 0.00 0.56 0.00 0.00 36.38 35.99 1q8a s VAL 504 CO 0.02 -0.43 0.96 -0.83 -0.31 0.00 0.00 175.10 174.51 1q8a s GLY 505 N -2.49 2.34 0.17 2.32 0.00 -1.26 -0.55 107.32 107.85 1q8a s GLY 505 Ca -0.00 -3.09 -0.20 0.00 0.00 0.00 0.00 44.72 41.43 1q8a s GLY 505 CO -0.08 1.63 1.63 -2.00 0.00 0.00 0.00 173.10 174.28 1q8a h LEU 506 N 9.00 -0.70 -2.79 0.66 5.85 -1.71 -2.80 115.31 122.82 1q8a h LEU 506 Ca 0.14 0.15 0.00 0.00 0.84 0.00 0.00 57.88 59.01 1q8a h LEU 506 Cb 1.02 0.37 -0.00 0.00 0.37 0.00 0.00 40.66 42.42 1q8a h LEU 506 CO 0.94 -0.24 0.07 0.28 -0.34 0.00 0.00 178.44 179.15 1q8a h SER 507 N -0.15 0.00 0.34 1.25 0.02 -1.91 -2.18 113.55 110.91 1q8a h SER 507 Ca 0.18 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 61.09 1q8a h SER 507 Cb 0.43 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.97 1q8a h SER 507 CO -0.46 0.00 -0.22 -1.13 -1.14 0.00 0.00 176.83 173.88 1q8a h ASN 508 N 0.00 0.00 -0.42 3.07 -1.24 -1.82 -2.95 115.58 112.22 1q8a h ASN 508 Ca 0.00 0.00 0.07 0.00 0.71 0.00 0.00 56.30 57.08 1q8a h ASN 508 Cb 0.14 0.00 -0.06 0.00 0.73 0.00 0.00 38.32 39.13 1q8a h ASN 508 CO -0.00 0.22 0.05 0.25 -1.29 0.00 0.00 177.43 176.67 1q8a h LEU 509 N 0.00 -0.06 -3.24 0.34 5.85 -1.57 -2.74 115.31 113.89 1q8a h LEU 509 Ca -0.00 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.80 1q8a h LEU 509 Cb 0.45 0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.61 1q8a h LEU 509 CO 0.03 0.01 0.00 -1.54 -0.34 0.00 0.00 178.44 176.59 1q8a n SER 510 N -5.14 5.12 -4.71 1.25 3.41 -1.12 -2.19 113.62 110.24 1q8a n SER 510 Ca 0.03 -2.67 -0.42 0.00 -0.26 0.00 0.00 58.87 55.55 1q8a n SER 510 Cb 0.21 -0.63 -0.03 0.00 -0.26 0.00 0.00 64.21 63.50 1q8a n SER 510 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1q8a s PHE 511 N -2.29 2.78 0.00 7.33 2.19 -1.04 -2.07 117.98 124.88 1q8a s PHE 511 Ca 0.51 0.35 0.00 0.00 0.33 0.00 0.00 56.93 58.12 1q8a s PHE 511 Cb 0.36 -4.08 0.00 0.00 -1.31 0.00 0.00 43.02 37.99 1q8a s PHE 511 CO 0.19 -4.15 0.00 0.41 1.83 0.00 0.00 175.22 173.51 1q8a n GLY 512 N 3.97 2.74 3.93 13.12 0.00 -1.26 -4.77 105.19 122.92 1q8a n GLY 512 Ca 0.16 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.91 1q8a n GLY 512 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1q8a s LEU 513 N 0.00 4.19 0.63 0.99 1.43 -0.88 -5.10 118.68 119.94 1q8a s LEU 513 Ca 0.00 0.44 -0.08 0.00 -1.03 0.00 0.00 54.13 53.45 1q8a s LEU 513 Cb 0.00 -3.22 0.00 0.00 0.03 0.00 0.00 46.19 43.01 1q8a s LEU 513 CO 0.00 -0.08 0.98 -2.16 0.23 0.00 0.00 176.35 175.32 1q8a s PRO 514 N -3.43 3.00 -1.41 1.29 0.04 -1.26 -3.98 135.00 129.25 1q8a s PRO 514 Ca 0.39 0.26 -0.06 0.00 0.04 0.00 0.00 61.00 61.63 1q8a s PRO 514 Cb -0.11 -2.16 0.04 0.00 0.04 0.00 0.00 34.50 32.30 1q8a s PRO 514 CO 0.29 -0.78 0.51 -0.25 0.04 0.00 0.00 177.00 176.81 1q8a n ASP 515 N -2.74 -4.89 -0.25 6.66 8.00 -1.26 -4.85 116.55 117.22 1q8a n ASP 515 Ca 0.05 -0.30 0.13 0.00 0.71 0.00 0.00 54.79 55.38 1q8a n ASP 515 Cb 0.57 -4.00 0.42 0.00 -0.02 0.00 0.00 41.12 38.09 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 -1.10 0.59 -1.00 -1.24 0.11 -1.86 -1.94 114.38 107.94 1q8a h ARG 516 Ca -0.47 -0.04 0.08 0.00 0.10 0.00 0.00 59.98 59.66 1q8a h ARG 516 Cb 1.32 -0.13 -0.07 0.00 1.11 0.00 0.00 29.97 32.20 1q8a h ARG 516 CO 0.54 0.39 0.64 1.03 0.10 0.00 0.00 179.97 182.67 1q8a h SER 517 N 0.61 1.00 0.22 0.08 0.87 -1.94 0.26 113.55 114.65 1q8a h SER 517 Ca 0.44 0.02 -0.16 0.00 -1.23 0.00 0.00 61.79 60.86 1q8a h SER 517 Cb 0.79 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.56 1q8a h SER 517 CO -0.19 0.60 -0.60 1.88 -0.53 0.00 0.00 176.83 177.99 1q8a h TYR 518 N 1.11 0.48 -0.28 2.24 -1.99 -1.73 -0.96 116.97 115.84 1q8a h TYR 518 Ca 0.45 -0.18 -0.12 0.00 2.00 0.00 0.00 58.73 60.88 1q8a h TYR 518 Cb 0.28 -0.09 -0.00 0.00 2.00 0.00 0.00 36.73 38.92 1q8a h TYR 518 CO -0.00 0.88 -0.29 1.88 -0.00 0.00 0.00 178.16 180.64 1q8a h TYR 519 N 0.28 0.83 -0.35 4.88 -1.99 -1.17 -2.05 116.97 117.40 1q8a h TYR 519 Ca -0.01 -0.25 0.01 0.00 2.00 0.00 0.00 58.73 60.49 1q8a h TYR 519 Cb 1.13 -0.17 -0.02 0.00 2.00 0.00 0.00 36.73 39.67 1q8a h TYR 519 CO 0.03 0.99 0.21 -0.91 -0.00 0.00 0.00 178.16 178.49 1q8a h ASN 520 N 0.42 0.35 -0.36 3.88 2.35 -0.42 -2.00 115.58 119.81 1q8a h ASN 520 Ca 0.04 -0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.79 1q8a h ASN 520 Cb 0.86 -0.08 -0.02 0.00 0.05 0.00 0.00 38.32 39.13 1q8a h ASN 520 CO 0.07 0.25 0.20 0.74 -1.65 0.00 0.00 177.43 177.04 1q8a h THR 521 N 0.43 1.14 -0.62 2.81 2.02 -1.14 -1.12 112.91 116.44 1q8a h THR 521 Ca 0.14 -0.38 -0.04 0.00 0.77 0.00 0.00 66.41 66.89 1q8a h THR 521 Cb -0.01 0.73 -0.03 0.00 -1.74 0.00 0.00 68.15 67.11 1q8a h THR 521 CO -0.06 0.15 0.21 0.00 0.37 0.00 0.00 175.52 176.20 1q8a h ALA 522 N 1.06 0.81 -0.41 6.16 0.00 -1.24 -1.65 119.26 123.99 1q8a h ALA 522 Ca 0.13 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 1q8a h ALA 522 Cb 0.06 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1q8a h ALA 522 CO -0.02 0.46 -0.00 0.35 0.00 0.00 0.00 179.25 180.04 1q8a h PHE 523 N 0.88 0.79 -0.66 0.00 3.57 -1.25 -1.96 116.94 118.31 1q8a h PHE 523 Ca 0.20 -0.14 0.00 0.00 3.53 0.00 0.00 57.97 61.57 1q8a h PHE 523 Cb 0.26 -0.21 -0.03 0.00 2.79 0.00 0.00 35.95 38.76 1q8a h PHE 523 CO 0.02 0.80 0.43 1.25 -2.23 0.00 0.00 178.31 178.58 1q8a h LEU 524 N 0.56 0.76 -0.20 0.59 5.85 -0.97 0.42 115.31 122.32 1q8a h LEU 524 Ca 0.12 -0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.79 1q8a h LEU 524 Cb 0.49 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 1q8a h LEU 524 CO 0.02 0.56 0.07 0.58 -0.34 0.00 0.00 178.44 179.33 1q8a h VAL 525 N 0.89 1.18 -0.72 1.05 2.07 -1.21 -0.42 116.25 119.08 1q8a h VAL 525 Ca 0.24 -0.56 0.01 0.00 0.82 0.00 0.00 66.70 67.21 1q8a h VAL 525 Cb -0.09 1.18 -0.04 0.00 -1.52 0.00 0.00 31.29 30.82 1q8a h VAL 525 CO -0.05 0.18 0.47 -0.07 0.02 0.00 0.00 177.57 178.12 1q8a h LEU 526 N 0.16 0.80 -0.38 2.57 3.38 -0.99 -1.55 115.31 119.30 1q8a h LEU 526 Ca 0.07 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 1q8a h LEU 526 Cb 0.21 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 1q8a h LEU 526 CO -0.00 0.58 0.14 1.23 0.09 0.00 0.00 178.44 180.47 1q8a h GLY 527 N 0.95 0.62 1.32 0.83 0.00 0.17 -2.57 103.07 104.39 1q8a h GLY 527 Ca 0.27 -0.35 -0.00 0.00 0.00 0.00 0.00 47.33 47.24 1q8a h GLY 527 CO -0.07 0.33 0.40 -2.22 0.00 0.00 0.00 176.54 174.98 1q8a h ILE 528 N 0.47 1.19 0.00 2.60 2.04 -0.90 -0.54 117.51 122.37 1q8a h ILE 528 Ca 0.12 -0.41 0.00 0.00 1.00 0.00 0.00 64.86 65.57 1q8a h ILE 528 Cb 0.22 0.24 0.00 0.00 -0.74 0.00 0.00 36.82 36.55 1q8a h ILE 528 CO -0.01 0.20 0.00 0.77 0.00 0.00 0.00 178.15 179.11 1q8a h SER 529 N 0.92 0.00 0.11 1.72 4.64 -0.89 -1.59 113.55 118.45 1q8a h SER 529 Ca 0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 1q8a h SER 529 Cb -0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.05 1q8a h SER 529 CO -0.05 0.00 -0.47 0.29 -0.87 0.00 0.00 176.83 175.74 1q8a n LYS 530 N -2.94 0.85 0.00 4.77 4.01 -0.32 -4.96 118.16 119.58 1q8a n LYS 530 Ca -0.01 -0.64 0.00 0.00 -0.51 0.00 0.00 58.31 57.15 1q8a n LYS 530 Cb 0.16 -1.49 0.00 0.00 -0.51 0.00 0.00 35.03 33.20 1q8a n LYS 530 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1q8a n GLY 531 N 1.41 0.84 3.62 0.72 0.00 -0.60 -3.74 105.19 107.45 1q8a n GLY 531 Ca 0.09 0.00 -0.56 0.00 0.00 0.00 0.00 46.02 45.56 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 1.59 0.06 0.99 7.94 -0.54 -4.77 117.00 122.27 1q8a n LEU 532 Ca 0.00 1.12 0.02 0.00 -1.11 0.00 0.00 56.01 56.04 1q8a n LEU 532 Cb 0.00 -1.12 -0.05 0.00 0.53 0.00 0.00 43.42 42.78 1q8a n LEU 532 CO 0.00 -0.99 -0.13 0.28 -1.11 0.00 0.00 177.39 175.44 1q8a h SER 533 N 5.09 0.00 -5.42 1.96 0.02 -1.88 -3.43 113.55 109.90 1q8a h SER 533 Ca -0.48 0.00 0.19 0.00 -0.84 0.00 0.00 61.79 60.66 1q8a h SER 533 Cb 1.35 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 63.83 1q8a h SER 533 CO 0.82 0.49 0.58 -0.94 -1.14 0.00 0.00 176.83 176.64 1q8a s SER 534 N -5.83 -0.06 -0.18 3.07 1.04 -0.87 -1.29 113.70 109.57 1q8a s SER 534 Ca -0.02 -0.53 -0.25 0.00 0.48 0.00 0.00 55.95 55.64 1q8a s SER 534 Cb 0.09 0.46 0.07 0.00 0.10 0.00 0.00 66.02 66.73 1q8a s SER 534 CO 0.80 -0.89 0.66 0.00 0.98 0.00 0.00 173.24 174.79 1q8a s ALA 535 N -2.58 -1.66 -0.13 5.32 0.00 -1.01 -3.71 121.76 117.98 1q8a s ALA 535 Ca 0.18 1.66 -0.23 0.00 0.00 0.00 0.00 51.96 53.57 1q8a s ALA 535 Cb -0.01 -0.72 -0.03 0.00 0.00 0.00 0.00 23.12 22.35 1q8a s ALA 535 CO 0.03 -0.33 0.73 0.42 0.00 0.00 0.00 175.76 176.61 1q8a s ILE 536 N -0.18 4.99 -0.46 0.00 1.01 0.29 -1.49 121.20 125.36 1q8a s ILE 536 Ca -0.04 1.44 -0.10 0.00 0.00 0.00 0.00 60.65 61.95 1q8a s ILE 536 Cb -0.03 -4.05 0.11 0.00 0.01 0.00 0.00 42.46 38.49 1q8a s ILE 536 CO 0.04 0.14 0.33 0.21 0.00 0.00 0.00 174.94 175.66 1q8a s ASN 538 N 1.02 5.74 0.00 3.58 3.84 -1.26 -1.72 114.94 126.14 1q8a s ASN 538 Ca 0.36 -1.75 0.13 0.00 0.21 0.00 0.00 52.86 51.81 1q8a s ASN 538 Cb -0.17 -2.03 0.61 0.00 -0.55 0.00 0.00 41.25 39.11 1q8a s ASN 538 CO 0.14 -0.66 1.35 -0.81 -2.79 0.00 0.00 177.10 174.34 1q8a n PRO 539 N 4.95 0.11 0.00 0.43 -0.04 -1.26 -1.94 135.00 137.25 1q8a n PRO 539 Ca -0.09 0.21 0.13 0.00 -0.04 0.00 0.00 63.50 63.71 1q8a n PRO 539 Cb 0.41 -1.50 0.40 0.00 -0.04 0.00 0.00 33.50 32.78 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 -1.37 1.09 -4.50 1.53 4.32 -1.26 -4.66 117.00 112.15 1q8a n LEU 540 Ca 0.05 -0.29 -0.42 0.00 -0.02 0.00 0.00 56.01 55.32 1q8a n LEU 540 Cb 0.12 -0.11 -0.03 0.00 -1.62 0.00 0.00 43.42 41.78 1q8a n LEU 540 CO 0.11 0.20 1.07 -0.62 -1.22 0.00 0.00 177.39 176.92 1q8a s ASP 541 N -2.43 6.31 0.18 -1.43 3.68 -0.82 -4.88 116.67 117.28 1q8a s ASP 541 Ca 0.26 -1.09 -0.14 0.00 2.13 0.00 0.00 52.55 53.72 1q8a s ASP 541 Cb 0.19 -2.49 0.16 0.00 -1.45 0.00 0.00 42.92 39.34 1q8a s ASP 541 CO 0.49 -1.52 1.71 -0.08 0.13 0.00 0.00 175.17 175.90 1q8a h GLU 542 N 9.64 0.18 -0.27 4.34 4.81 -1.88 -2.23 114.58 129.18 1q8a h GLU 542 Ca -0.11 -0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.16 1q8a h GLU 542 Cb 1.04 -0.04 -0.05 0.00 0.63 0.00 0.00 28.75 30.33 1q8a h GLU 542 CO 1.25 0.12 -0.09 1.15 -0.73 0.00 0.00 179.01 180.71 1q8a h THR 543 N 0.19 0.68 0.00 0.32 2.02 -1.98 0.18 112.91 114.32 1q8a h THR 543 Ca 0.23 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.41 1q8a h THR 543 Cb 0.32 0.68 0.00 0.00 -1.74 0.00 0.00 68.15 67.41 1q8a h THR 543 CO -0.33 0.00 0.00 -0.11 0.37 0.00 0.00 175.52 175.45 1q8a n LEU 544 N -5.26 0.00 0.00 2.58 7.94 -0.84 -1.57 117.00 119.86 1q8a n LEU 544 Ca -0.01 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.89 1q8a n LEU 544 Cb 0.18 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.13 1q8a n LEU 544 CO 0.20 0.00 0.00 0.29 -1.11 0.00 0.00 177.39 176.77 1q8a n LYS 546 N 0.12 0.00 0.09 1.96 4.76 0.64 -1.05 118.16 124.67 1q8a n LYS 546 Ca 0.00 0.00 -0.03 0.00 -2.87 0.00 0.00 58.31 55.41 1q8a n LYS 546 Cb 0.00 0.00 0.19 0.00 -1.84 0.00 0.00 35.03 33.38 1q8a n LYS 546 CO 0.00 0.00 0.00 1.15 -1.37 0.00 0.00 177.40 177.18 1q8a h THR 547 N 0.00 1.33 -0.18 -0.18 2.02 -1.51 -1.50 112.91 112.90 1q8a h THR 547 Ca 0.00 -1.66 -0.01 0.00 0.77 0.00 0.00 66.41 65.51 1q8a h THR 547 Cb 0.00 1.78 -0.01 0.00 -1.74 0.00 0.00 68.15 68.18 1q8a h THR 547 CO 0.00 0.49 0.07 0.25 0.37 0.00 0.00 175.52 176.71 1q8a h LEU 548 N 0.19 0.24 -0.27 2.58 5.85 -1.33 0.49 115.31 123.05 1q8a h LEU 548 Ca 0.01 -0.15 0.06 0.00 0.84 0.00 0.00 57.88 58.64 1q8a h LEU 548 Cb 0.90 -0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.81 1q8a h LEU 548 CO 0.07 0.32 -0.13 -1.13 -0.34 0.00 0.00 178.44 177.23 1q8a h ASN 549 N 0.14 -0.45 -0.65 1.25 -1.24 -1.77 -1.37 115.58 111.49 1q8a h ASN 549 Ca 0.06 0.11 0.03 0.00 0.71 0.00 0.00 56.30 57.20 1q8a h ASN 549 Cb 0.16 0.25 -0.04 0.00 0.73 0.00 0.00 38.32 39.41 1q8a h ASN 549 CO -0.01 -0.17 0.41 0.00 -1.29 0.00 0.00 177.43 176.37 1q8a h ALA 550 N 1.12 0.85 -0.60 1.57 0.00 -1.05 -1.76 119.26 119.40 1q8a h ALA 550 Ca 0.14 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.07 1q8a h ALA 550 Cb 0.31 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 1q8a h ALA 550 CO -0.34 0.17 0.35 1.15 0.00 0.00 0.00 179.25 180.58 1q8a h THR 551 N 0.80 1.03 -0.40 0.00 2.02 -0.12 -0.31 112.91 115.93 1q8a h THR 551 Ca 0.26 -0.23 -0.11 0.00 0.77 0.00 0.00 66.41 67.10 1q8a h THR 551 Cb 0.01 0.29 -0.01 0.00 -1.74 0.00 0.00 68.15 66.70 1q8a h THR 551 CO -0.10 0.12 -0.21 -0.07 0.37 0.00 0.00 175.52 175.63 1q8a h LEU 552 N 0.67 0.80 -0.19 2.58 3.38 -0.77 -1.22 115.31 120.56 1q8a h LEU 552 Ca 0.25 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 1q8a h LEU 552 Cb 0.08 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 1q8a h LEU 552 CO -0.13 0.99 0.05 0.58 0.09 0.00 0.00 178.44 180.02 1q8a h VAL 553 N 0.69 1.20 -0.77 1.22 2.07 -0.94 0.18 116.25 119.91 1q8a h VAL 553 Ca 0.10 -0.65 -0.02 0.00 0.82 0.00 0.00 66.70 66.95 1q8a h VAL 553 Cb 0.72 1.27 -0.04 0.00 -1.52 0.00 0.00 31.29 31.72 1q8a h VAL 553 CO 0.06 0.20 0.41 0.40 0.02 0.00 0.00 177.57 178.66 1q8a h ILE 554 N 0.13 1.23 -0.00 4.57 2.04 -0.98 -1.81 117.51 122.68 1q8a h ILE 554 Ca 0.06 -0.59 0.00 0.00 1.00 0.00 0.00 64.86 65.33 1q8a h ILE 554 Cb 0.26 0.22 0.00 0.00 -0.74 0.00 0.00 36.82 36.57 1q8a h ILE 554 CO 0.00 0.26 0.00 0.18 0.00 0.00 0.00 178.15 178.59 1q8a n LEU 555 N -4.43 0.00 -3.14 1.44 4.77 -0.47 -4.90 117.00 110.27 1q8a n LEU 555 Ca 0.07 -0.00 -0.19 0.00 -0.03 0.00 0.00 56.01 55.86 1q8a n LEU 555 Cb 0.10 -0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.26 1q8a n LEU 555 CO 0.38 0.00 0.17 -0.62 -1.33 0.00 0.00 177.39 176.00 1q8a n GLU 556 N -0.75 -6.48 0.00 3.23 1.02 -0.68 -4.90 120.64 112.08 1q8a n GLU 556 Ca 0.12 0.72 0.03 0.00 -0.02 0.00 0.00 57.16 58.01 1q8a n GLU 556 Cb 0.06 -5.41 0.02 0.00 -0.02 0.00 0.00 31.44 26.08 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 -4.15 0.38 0.00 3.49 5.02 0.59 -5.03 118.16 118.46 1q8a n LYS 557 Ca -0.08 -0.74 0.00 0.00 -2.02 0.00 0.00 58.31 55.46 1q8a n LYS 557 Cb 0.58 -1.07 0.00 0.00 -0.02 0.00 0.00 35.03 34.53 1q8a n LYS 557 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05