#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qth s LYS 2 N 0.00 3.91 -0.00 2.12 1.02 -1.26 -5.02 119.74 120.50 2qth s LYS 2 Ca 0.00 -0.36 0.02 0.00 0.02 0.00 0.00 55.97 55.65 2qth s LYS 2 Cb 0.00 -3.39 -0.03 0.00 -0.52 0.00 0.00 37.83 33.88 2qth s LYS 2 CO 0.00 0.02 -0.04 0.95 -0.92 0.00 0.00 175.35 175.37 2qth s THR 3 N 1.09 3.87 0.01 2.17 -4.23 -1.26 0.37 115.64 117.67 2qth s THR 3 Ca 0.06 -0.68 0.05 0.00 -1.18 0.00 0.00 61.69 59.94 2qth s THR 3 Cb -0.14 -2.70 -0.02 0.00 1.34 0.00 0.00 72.50 70.99 2qth s THR 3 CO 0.04 0.40 -0.15 0.00 -0.54 0.00 0.00 174.62 174.37 2qth s ALA 4 N -1.02 1.29 -0.24 3.99 0.00 0.38 -2.04 121.76 124.12 2qth s ALA 4 Ca 0.18 -0.76 -0.15 0.00 0.00 0.00 0.00 51.96 51.23 2qth s ALA 4 Cb -0.11 -0.28 -0.04 0.00 0.00 0.00 0.00 23.12 22.69 2qth s ALA 4 CO 0.08 0.29 0.36 0.00 0.00 0.00 0.00 175.76 176.50 2qth s ALA 5 N -0.57 3.57 -0.17 0.00 0.00 -0.67 -0.76 121.76 123.17 2qth s ALA 5 Ca 0.05 -0.69 -0.01 0.00 0.00 0.00 0.00 51.96 51.30 2qth s ALA 5 Cb -0.07 -2.64 -0.01 0.00 0.00 0.00 0.00 23.12 20.41 2qth s ALA 5 CO 0.00 -0.45 -0.11 -1.17 0.00 0.00 0.00 175.76 174.03 2qth s LEU 6 N 1.63 2.71 -0.25 0.00 2.96 0.21 -0.97 118.68 124.97 2qth s LEU 6 Ca 0.16 -0.39 -0.10 0.00 -0.22 0.00 0.00 54.13 53.59 2qth s LEU 6 Cb -0.15 -1.64 -0.04 0.00 0.50 0.00 0.00 46.19 44.86 2qth s LEU 6 CO 0.08 0.08 0.14 -0.36 -1.32 0.00 0.00 176.35 174.97 2qth s PHE 7 N 0.84 3.23 -0.11 5.38 0.08 -0.12 -1.36 117.98 125.92 2qth s PHE 7 Ca -0.03 0.03 -0.24 0.00 0.12 0.00 0.00 56.93 56.81 2qth s PHE 7 Cb -0.15 -2.27 0.06 0.00 -0.57 0.00 0.00 43.02 40.09 2qth s PHE 7 CO 0.00 -0.08 0.58 0.54 -0.10 0.00 0.00 175.22 176.16 2qth s VAL 8 N 1.30 0.01 0.70 -0.44 0.11 -0.41 -0.40 120.40 121.27 2qth s VAL 8 Ca 0.06 -0.09 -0.14 0.00 -2.93 0.00 0.00 61.98 58.89 2qth s VAL 8 Cb -0.14 -0.87 0.02 0.00 -1.53 0.00 0.00 36.38 33.86 2qth s VAL 8 CO 0.06 -0.05 1.13 -0.94 -3.33 0.00 0.00 175.10 171.97 2qth s SER 9 N -0.62 4.75 0.33 3.54 1.04 -1.26 -3.37 113.70 118.11 2qth s SER 9 Ca -0.07 2.06 0.02 0.00 0.48 0.00 0.00 55.95 58.44 2qth s SER 9 Cb -0.03 -2.56 0.59 0.00 0.10 0.00 0.00 66.02 64.13 2qth s SER 9 CO 0.05 -1.87 1.96 0.11 0.98 0.00 0.00 173.24 174.47 2qth h LYS 10 N -0.25 0.91 -0.63 4.02 1.79 -2.00 0.92 116.57 121.34 2qth h LYS 10 Ca -0.46 -0.05 0.04 0.00 -2.18 0.00 0.00 60.65 57.99 2qth h LYS 10 Cb 1.26 -0.21 -0.05 0.00 -1.58 0.00 0.00 32.23 31.66 2qth h LYS 10 CO 0.52 0.60 0.37 1.49 -1.08 0.00 0.00 179.45 181.35 2qth h GLU 11 N 0.94 0.69 -0.00 3.15 4.81 -2.06 -3.11 114.58 118.99 2qth h GLU 11 Ca 0.32 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.50 2qth h GLU 11 Cb 0.08 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.31 2qth h GLU 11 CO -0.10 0.46 -0.56 1.19 -0.73 0.00 0.00 179.01 179.27 2qth n PHE 12 N -4.76 0.00 -0.08 0.92 3.72 -0.89 -4.72 117.46 111.66 2qth n PHE 12 Ca 0.07 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.36 2qth n PHE 12 Cb 0.12 -0.13 -0.05 0.00 -0.94 0.00 0.00 39.48 38.48 2qth n PHE 12 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 176.76 178.20 2qth h GLU 13 N 0.62 -0.36 -0.41 -1.08 4.81 -0.76 0.18 114.58 117.58 2qth h GLU 13 Ca 0.00 0.02 0.09 0.00 -0.13 0.00 0.00 59.36 59.34 2qth h GLU 13 Cb 0.54 0.08 -0.09 0.00 0.63 0.00 0.00 28.75 29.91 2qth h GLU 13 CO 0.00 -0.24 -0.18 1.49 -0.73 0.00 0.00 179.01 179.35 2qth h GLU 14 N -0.37 -0.10 0.30 1.92 4.81 -1.84 0.56 114.58 119.87 2qth h GLU 14 Ca 0.12 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.35 2qth h GLU 14 Cb 0.59 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.98 2qth h GLU 14 CO -0.51 -0.06 -0.20 0.93 -0.73 0.00 0.00 179.01 178.44 2qth h GLU 15 N -0.10 -0.47 -0.55 1.92 4.39 -1.70 -2.70 114.58 115.36 2qth h GLU 15 Ca 0.20 0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.93 2qth h GLU 15 Cb 0.41 0.11 -0.03 0.00 -0.10 0.00 0.00 28.75 29.14 2qth h GLU 15 CO -0.47 -0.32 0.35 0.00 -1.16 0.00 0.00 179.01 177.41 2qth h ALA 16 N 0.17 1.57 -0.20 3.43 0.00 -0.49 -0.99 119.26 122.75 2qth h ALA 16 Ca -0.03 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.84 2qth h ALA 16 Cb 0.42 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 2qth h ALA 16 CO 0.02 0.38 0.09 0.82 0.00 0.00 0.00 179.25 180.56 2qth h ILE 17 N 0.75 0.98 -0.74 0.00 2.04 -0.83 0.19 117.51 119.90 2qth h ILE 17 Ca 0.20 -0.07 -0.02 0.00 1.00 0.00 0.00 64.86 65.97 2qth h ILE 17 Cb -0.06 0.76 -0.03 0.00 -0.74 0.00 0.00 36.82 36.76 2qth h ILE 17 CO -0.04 0.04 0.38 0.00 0.00 0.00 0.00 178.15 178.53 2qth h ALA 18 N 1.11 0.95 -0.37 1.87 0.00 -1.06 -1.86 119.26 119.90 2qth h ALA 18 Ca 0.08 -0.13 0.06 0.00 0.00 0.00 0.00 54.91 54.92 2qth h ALA 18 Cb 0.03 -0.29 -0.05 0.00 0.00 0.00 0.00 17.79 17.48 2qth h ALA 18 CO -0.07 0.48 0.06 -0.07 0.00 0.00 0.00 179.25 179.65 2qth h LEU 19 N 1.02 -0.03 -0.67 0.00 3.38 -1.01 -0.42 115.31 117.58 2qth h LEU 19 Ca 0.26 0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.29 2qth h LEU 19 Cb 0.08 0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.89 2qth h LEU 19 CO -0.04 0.02 0.40 0.58 0.09 0.00 0.00 178.44 179.50 2qth h VAL 20 N 0.17 1.19 -0.34 1.22 2.07 -0.71 -1.79 116.25 118.07 2qth h VAL 20 Ca 0.18 -0.43 -0.11 0.00 0.82 0.00 0.00 66.70 67.15 2qth h VAL 20 Cb 0.22 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 30.24 2qth h VAL 20 CO -0.25 0.20 -0.25 -0.33 0.02 0.00 0.00 177.57 176.96 2qth h GLU 21 N 0.91 0.68 0.00 1.57 5.08 -1.28 -1.48 114.58 120.06 2qth h GLU 21 Ca 0.24 -0.28 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 2qth h GLU 21 Cb -0.02 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.20 2qth h GLU 21 CO -0.04 0.86 0.00 0.78 -1.00 0.00 0.00 179.01 179.61 2qth h GLY 22 N 0.99 0.00 -2.44 -3.84 0.00 -0.54 0.64 103.07 97.88 2qth h GLY 22 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.41 2qth h GLY 22 CO 0.06 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.60 2qth n ALA 23 N -1.95 2.99 -2.43 3.60 0.00 -0.62 -4.68 120.51 117.42 2qth n ALA 23 Ca -0.01 -1.18 -0.15 0.00 0.00 0.00 0.00 53.44 52.11 2qth n ALA 23 Cb 0.13 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.56 2qth n ALA 23 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2qth n ASN 24 N 0.75 -4.47 -4.64 0.00 5.15 0.22 -4.89 115.26 107.38 2qth n ASN 24 Ca 0.19 -0.07 -0.32 0.00 -0.60 0.00 0.00 54.58 53.78 2qth n ASN 24 Cb 0.71 -3.54 -0.09 0.00 -0.53 0.00 0.00 39.78 36.33 2qth n ASN 24 CO 0.00 0.00 0.00 -0.31 1.40 0.00 0.00 177.26 178.35 2qth s TYR 25 N -2.79 2.96 -0.12 1.20 2.02 -0.80 -4.37 117.35 115.44 2qth s TYR 25 Ca 0.06 0.00 -0.22 0.00 -0.37 0.00 0.00 57.07 56.55 2qth s TYR 25 Cb -0.03 -1.61 -0.03 0.00 -0.40 0.00 0.00 41.96 39.89 2qth s TYR 25 CO 0.08 0.42 0.66 0.21 -1.57 0.00 0.00 175.55 175.35 2qth s LYS 26 N -1.62 4.34 -0.42 -0.62 2.20 0.16 -3.71 119.74 120.07 2qth s LYS 26 Ca 0.19 0.74 -0.25 0.00 -0.36 0.00 0.00 55.97 56.30 2qth s LYS 26 Cb -0.11 -3.50 0.02 0.00 -1.51 0.00 0.00 37.83 32.73 2qth s LYS 26 CO 0.10 -0.05 0.88 0.08 -0.36 0.00 0.00 175.35 176.00 2qth s VAL 27 N 1.24 4.57 -0.36 4.02 1.01 -1.26 -0.47 120.40 129.15 2qth s VAL 27 Ca 0.33 0.82 0.20 0.00 0.00 0.00 0.00 61.98 63.33 2qth s VAL 27 Cb -0.17 -4.35 -0.27 0.00 0.00 0.00 0.00 36.38 31.59 2qth s VAL 27 CO 0.14 -0.67 0.59 0.35 0.00 0.00 0.00 175.10 175.50 2qth n THR 28 N 6.16 0.00 -3.75 3.92 -2.24 0.06 -4.91 114.28 113.52 2qth n THR 28 Ca 0.05 -0.30 -0.14 0.00 -2.27 0.00 0.00 64.05 61.39 2qth n THR 28 Cb 0.48 0.40 -0.09 0.00 -2.10 0.00 0.00 70.33 69.03 2qth n THR 28 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2qth s SER 29 N -3.76 -0.22 -0.04 3.42 1.04 -1.18 -5.02 113.70 107.95 2qth s SER 29 Ca -0.02 0.13 0.01 0.00 0.48 0.00 0.00 55.95 56.55 2qth s SER 29 Cb 0.14 0.33 0.02 0.00 0.10 0.00 0.00 66.02 66.60 2qth s SER 29 CO 0.82 -0.45 -0.04 -0.63 0.98 0.00 0.00 173.24 173.92 2qth s ILE 30 N -1.29 0.49 0.03 -1.02 1.01 -1.26 -0.62 121.20 118.54 2qth s ILE 30 Ca -0.13 -0.12 0.03 0.00 0.00 0.00 0.00 60.65 60.42 2qth s ILE 30 Cb -0.05 -0.50 -0.02 0.00 0.01 0.00 0.00 42.46 41.90 2qth s ILE 30 CO 0.04 0.20 -0.09 -0.31 0.00 0.00 0.00 174.94 174.78 2qth s TYR 31 N 0.74 0.79 0.97 3.97 2.02 -0.47 -4.99 117.35 120.38 2qth s TYR 31 Ca -0.09 -0.36 -0.11 0.00 -0.37 0.00 0.00 57.07 56.13 2qth s TYR 31 Cb -0.13 -0.47 0.14 0.00 -0.40 0.00 0.00 41.96 41.11 2qth s TYR 31 CO 0.00 -0.03 0.93 1.63 -1.57 0.00 0.00 175.55 176.51 2qth n LYS 32 N 1.91 -0.76 -1.80 -0.62 5.02 -1.25 -1.29 118.16 119.38 2qth n LYS 32 Ca -0.19 -0.17 -0.39 0.00 -2.02 0.00 0.00 58.31 55.54 2qth n LYS 32 Cb 0.55 -2.22 0.03 0.00 -0.02 0.00 0.00 35.03 33.38 2qth n LYS 32 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2qth s LEU 33 N -5.36 3.95 0.17 -0.35 1.43 -1.22 -4.48 118.68 112.83 2qth s LEU 33 Ca 0.65 2.81 -0.31 0.00 -1.03 0.00 0.00 54.13 56.25 2qth s LEU 33 Cb -0.23 -4.14 -0.09 0.00 0.03 0.00 0.00 46.19 41.76 2qth s LEU 33 CO 0.61 -1.41 1.43 -2.16 0.23 0.00 0.00 176.35 175.06 2qth s PRO 34 N -2.73 4.29 0.13 1.29 0.04 -1.26 -4.90 135.00 131.87 2qth s PRO 34 Ca 0.67 2.19 -0.29 0.00 0.04 0.00 0.00 61.00 63.61 2qth s PRO 34 Cb -0.41 -3.19 -0.06 0.00 0.04 0.00 0.00 34.50 30.88 2qth s PRO 34 CO 0.51 -0.45 1.58 0.87 0.04 0.00 0.00 177.00 179.55 2qth h LYS 35 N 6.22 -0.47 -3.88 4.56 1.57 -1.97 -3.32 116.57 119.28 2qth h LYS 35 Ca -0.43 0.03 -0.66 0.00 -1.87 0.00 0.00 60.65 57.71 2qth h LYS 35 Cb 1.21 0.11 -0.39 0.00 0.08 0.00 0.00 32.23 33.24 2qth h LYS 35 CO 0.85 -0.31 -0.58 -1.12 -0.57 0.00 0.00 179.45 177.71 2qth s SER 36 N -4.89 4.75 0.48 0.86 0.01 -1.26 -5.09 113.70 108.55 2qth s SER 36 Ca -0.15 -2.65 -0.24 0.00 1.31 0.00 0.00 55.95 54.21 2qth s SER 36 Cb 0.09 -1.71 -0.07 0.00 0.21 0.00 0.00 66.02 64.54 2qth s SER 36 CO 0.64 -0.34 1.41 -2.84 0.41 0.00 0.00 173.24 172.53 2qth s PRO 37 N 0.23 3.50 0.01 12.44 0.02 -1.25 -4.96 135.00 144.99 2qth s PRO 37 Ca 0.14 2.38 -0.30 0.00 0.02 0.00 0.00 61.00 63.24 2qth s PRO 37 Cb -0.23 -2.53 -0.04 0.00 0.02 0.00 0.00 34.50 31.73 2qth s PRO 37 CO -0.03 -0.95 1.05 1.21 -0.33 0.00 0.00 177.00 177.95 2qth s ASN 38 N -0.62 7.27 0.47 2.53 3.84 0.76 -4.88 114.94 124.31 2qth s ASN 38 Ca 0.64 1.77 0.14 0.00 0.21 0.00 0.00 52.86 55.63 2qth s ASN 38 Cb -0.43 -2.57 1.08 0.00 -0.55 0.00 0.00 41.25 38.78 2qth s ASN 38 CO 0.54 -0.34 2.05 0.58 -2.79 0.00 0.00 177.10 177.14 2qth h VAL 39 N 4.73 1.08 0.05 -5.21 2.07 -1.92 0.15 116.25 117.20 2qth h VAL 39 Ca -0.41 -0.37 -0.34 0.00 0.82 0.00 0.00 66.70 66.40 2qth h VAL 39 Cb 1.21 1.16 -0.04 0.00 -1.52 0.00 0.00 31.29 32.10 2qth h VAL 39 CO 0.78 0.11 -1.92 0.29 0.02 0.00 0.00 177.57 176.85 2qth n LYS 40 N -4.41 0.66 0.00 1.57 5.02 -1.26 -4.70 118.16 115.04 2qth n LYS 40 Ca -0.02 0.35 0.04 0.00 -2.02 0.00 0.00 58.31 56.65 2qth n LYS 40 Cb 0.18 -1.66 0.00 0.00 -0.02 0.00 0.00 35.03 33.53 2qth n LYS 40 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 2qth n PHE 41 N -3.87 0.00 0.00 2.13 3.72 -1.03 -4.18 117.46 114.22 2qth n PHE 41 Ca -0.38 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.02 2qth n PHE 41 Cb 0.90 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.44 2qth n PHE 41 CO 0.00 0.00 0.00 0.98 -0.05 0.00 0.00 176.76 177.69 2qth n TYR 42 N -0.22 0.00 -1.70 1.38 9.36 0.51 -4.75 117.16 121.74 2qth n TYR 42 Ca 0.03 0.00 -0.29 0.00 3.32 0.00 0.00 57.90 60.96 2qth n TYR 42 Cb 0.17 0.00 0.11 0.00 -0.63 0.00 0.00 39.34 38.99 2qth n TYR 42 CO 0.00 0.00 0.00 0.96 0.22 0.00 0.00 176.86 178.04 2qth s ILE 43 N 0.00 2.10 0.43 2.97 -4.36 -1.26 -0.17 121.20 120.91 2qth s ILE 43 Ca 0.00 0.03 -0.25 0.00 -0.26 0.00 0.00 60.65 60.17 2qth s ILE 43 Cb 0.00 -2.90 -0.08 0.00 1.25 0.00 0.00 42.46 40.73 2qth s ILE 43 CO 0.00 -0.04 1.33 -1.10 0.24 0.00 0.00 174.94 175.37 2qth s GLN 44 N -5.40 3.83 0.14 0.37 -0.21 -1.26 -4.47 119.66 112.65 2qth s GLN 44 Ca 0.63 2.21 -0.18 0.00 0.02 0.00 0.00 55.36 58.04 2qth s GLN 44 Cb -0.13 -2.68 -0.03 0.00 1.00 0.00 0.00 33.01 31.17 2qth s GLN 44 CO 0.51 -0.63 1.78 -0.92 -2.12 0.00 0.00 175.29 173.92 2qth h TYR 45 N 2.47 0.39 -0.60 0.91 3.20 -1.94 -1.09 116.97 120.31 2qth h TYR 45 Ca -0.50 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.34 2qth h TYR 45 Cb 1.25 -0.13 -0.03 0.00 1.54 0.00 0.00 36.73 39.37 2qth h TYR 45 CO 0.52 0.26 0.25 0.38 -1.64 0.00 0.00 178.16 177.93 2qth h ASP 46 N 0.41 0.82 -0.67 -2.11 3.04 -1.99 -1.01 116.42 114.90 2qth h ASP 46 Ca 0.11 -0.16 0.08 0.00 -3.24 0.00 0.00 57.03 53.81 2qth h ASP 46 Cb -0.03 -0.21 -0.06 0.00 -1.04 0.00 0.00 39.33 37.99 2qth h ASP 46 CO -0.02 0.76 0.34 0.50 -2.04 0.00 0.00 179.24 178.77 2qth h LYS 47 N 0.82 0.59 -0.92 4.15 1.63 -1.89 -1.12 116.57 119.83 2qth h LYS 47 Ca 0.20 -0.04 -0.00 0.00 -0.85 0.00 0.00 60.65 59.96 2qth h LYS 47 Cb 0.19 -0.13 -0.04 0.00 -0.60 0.00 0.00 32.23 31.64 2qth h LYS 47 CO -0.02 0.39 0.56 1.25 -3.45 0.00 0.00 179.45 178.18 2qth h LEU 48 N 0.61 1.11 -0.85 5.20 5.85 -0.84 -0.86 115.31 125.52 2qth h LEU 48 Ca 0.32 -0.07 -0.07 0.00 0.84 0.00 0.00 57.88 58.90 2qth h LEU 48 Cb 0.28 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 2qth h LEU 48 CO -0.23 0.85 0.08 1.56 -0.34 0.00 0.00 178.44 180.36 2qth h GLN 49 N 1.27 0.93 -0.20 1.25 1.08 -0.46 0.30 115.11 119.30 2qth h GLN 49 Ca 0.33 -0.23 -0.03 0.00 -1.45 0.00 0.00 58.65 57.27 2qth h GLN 49 Cb -0.06 -0.12 -0.01 0.00 -0.05 0.00 0.00 27.48 27.25 2qth h GLN 49 CO -0.06 0.88 0.01 1.96 -0.95 0.00 0.00 178.83 180.66 2qth h GLN 50 N 0.88 0.34 -0.63 1.46 4.20 -0.87 -2.81 115.11 117.68 2qth h GLN 50 Ca 0.18 -0.11 -0.08 0.00 0.06 0.00 0.00 58.65 58.70 2qth h GLN 50 Cb 0.41 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.13 2qth h GLN 50 CO 0.01 0.53 0.07 0.82 -0.67 0.00 0.00 178.83 179.59 2qth h ILE 51 N 0.11 1.26 -0.95 2.54 2.04 -0.89 -1.83 117.51 119.79 2qth h ILE 51 Ca 0.06 -1.07 0.23 0.00 1.00 0.00 0.00 64.86 65.08 2qth h ILE 51 Cb 0.37 0.70 -0.12 0.00 -0.74 0.00 0.00 36.82 37.03 2qth h ILE 51 CO 0.01 0.39 0.49 0.50 0.00 0.00 0.00 178.15 179.55 2qth h LYS 52 N 0.99 0.48 -0.15 2.37 3.64 -0.27 -2.69 116.57 120.94 2qth h LYS 52 Ca 0.19 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 2qth h LYS 52 Cb 0.47 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.18 2qth h LYS 52 CO 0.02 0.32 0.00 0.09 -2.27 0.00 0.00 179.45 177.61 2qth n ASN 53 N -4.96 2.58 -4.46 4.20 5.03 -1.02 -4.85 115.26 111.77 2qth n ASN 53 Ca 0.24 -1.75 -0.43 0.00 0.87 0.00 0.00 54.58 53.51 2qth n ASN 53 Cb 0.69 -0.09 -0.05 0.00 -1.02 0.00 0.00 39.78 39.31 2qth n ASN 53 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 2qth s ASP 54 N -1.22 6.25 0.00 6.41 -1.08 -0.72 -4.91 116.67 121.40 2qth s ASP 54 Ca 0.22 -0.79 0.16 0.00 -0.52 0.00 0.00 52.55 51.62 2qth s ASP 54 Cb 0.14 -2.35 0.72 0.00 -1.46 0.00 0.00 42.92 39.97 2qth s ASP 54 CO 0.20 -1.09 1.51 -0.62 0.52 0.00 0.00 175.17 175.69 2qth n GLU 55 N 6.80 0.06 -0.00 4.34 1.02 -1.26 -1.13 120.64 130.47 2qth n GLU 55 Ca -0.04 0.20 0.15 0.00 -0.02 0.00 0.00 57.16 57.45 2qth n GLU 55 Cb 0.46 -1.50 0.90 0.00 -0.02 0.00 0.00 31.44 31.27 2qth n GLU 55 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2qth n GLU 56 N -1.45 1.03 -4.07 3.49 -0.58 -1.26 -4.75 120.64 113.05 2qth n GLU 56 Ca 0.05 -0.04 -0.32 0.00 -0.42 0.00 0.00 57.16 56.43 2qth n GLU 56 Cb 0.17 -1.48 -0.16 0.00 -0.57 0.00 0.00 31.44 29.41 2qth n GLU 56 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 2qth s ILE 57 N -2.00 1.91 -0.28 -3.67 1.01 -0.28 -4.74 121.20 113.16 2qth s ILE 57 Ca 0.46 -1.04 0.23 0.00 0.00 0.00 0.00 60.65 60.30 2qth s ILE 57 Cb 0.21 -1.85 0.04 0.00 0.01 0.00 0.00 42.46 40.87 2qth s ILE 57 CO 0.35 0.34 1.11 0.77 0.00 0.00 0.00 174.94 177.52 2qth h SER 58 N 7.93 0.00 -3.77 3.58 4.64 -1.69 -3.46 113.55 120.78 2qth h SER 58 Ca -0.36 -0.01 -0.11 0.00 -0.47 0.00 0.00 61.79 60.84 2qth h SER 58 Cb 1.11 0.00 -0.24 0.00 -0.31 0.00 0.00 62.40 62.96 2qth h SER 58 CO 0.55 0.01 -0.22 -0.89 -0.87 0.00 0.00 176.83 175.41 2qth s THR 59 N -3.34 -0.00 -0.22 2.95 2.01 -0.93 -3.37 115.64 112.73 2qth s THR 59 Ca 0.01 0.02 -0.11 0.00 0.31 0.00 0.00 61.69 61.91 2qth s THR 59 Cb 0.09 -0.62 -0.05 0.00 0.01 0.00 0.00 72.50 71.94 2qth s THR 59 CO 0.77 0.01 0.20 -0.22 -0.69 0.00 0.00 174.62 174.69 2qth s LEU 60 N 0.45 4.15 -0.13 4.42 2.96 0.84 -1.66 118.68 129.71 2qth s LEU 60 Ca -0.02 0.23 0.02 0.00 -0.22 0.00 0.00 54.13 54.14 2qth s LEU 60 Cb -0.04 -2.18 0.01 0.00 0.50 0.00 0.00 46.19 44.48 2qth s LEU 60 CO -0.02 0.07 -0.19 -0.63 -1.32 0.00 0.00 176.35 174.26 2qth s ILE 61 N 0.89 1.81 -0.25 6.68 1.01 -0.14 -0.51 121.20 130.70 2qth s ILE 61 Ca 0.10 -0.83 -0.02 0.00 0.00 0.00 0.00 60.65 59.90 2qth s ILE 61 Cb -0.13 -1.62 0.02 0.00 0.01 0.00 0.00 42.46 40.74 2qth s ILE 61 CO 0.04 0.50 -0.06 -0.63 0.00 0.00 0.00 174.94 174.79 2qth s ILE 62 N 0.91 2.95 -1.44 2.92 1.01 -0.47 -0.94 121.20 126.14 2qth s ILE 62 Ca -0.06 -0.95 -0.14 0.00 0.00 0.00 0.00 60.65 59.50 2qth s ILE 62 Cb -0.15 -2.48 0.05 0.00 0.01 0.00 0.00 42.46 39.90 2qth s ILE 62 CO -0.02 0.23 2.17 0.33 0.00 0.00 0.00 174.94 177.65 2qth n PHE 63 N 4.69 3.54 -3.84 3.97 7.35 0.46 -2.57 117.46 131.06 2qth n PHE 63 Ca -0.17 -2.96 -0.09 0.00 -0.76 0.00 0.00 57.45 53.48 2qth n PHE 63 Cb 0.48 -2.50 0.01 0.00 0.35 0.00 0.00 39.48 37.81 2qth n PHE 63 CO 0.00 0.00 0.00 -1.21 -0.76 0.00 0.00 176.76 174.79 2qth s GLU 64 N 2.98 2.11 -0.35 -4.13 0.41 -1.26 -4.79 118.70 113.67 2qth s GLU 64 Ca 0.47 -1.35 -0.14 0.00 -0.41 0.00 0.00 54.97 53.54 2qth s GLU 64 Cb 0.13 0.61 -0.01 0.00 -1.78 0.00 0.00 34.13 33.08 2qth s GLU 64 CO -0.07 -0.98 0.28 -1.14 -0.49 0.00 0.00 175.26 172.86 2qth s GLN 65 N -2.73 3.47 0.25 1.61 0.74 -1.26 -0.74 119.66 121.00 2qth s GLN 65 Ca 0.15 -0.61 -0.30 0.00 0.05 0.00 0.00 55.36 54.65 2qth s GLN 65 Cb -0.05 -3.82 -0.09 0.00 1.10 0.00 0.00 33.01 30.15 2qth s GLN 65 CO 0.11 -0.49 0.99 -0.51 -0.55 0.00 0.00 175.29 174.84 2qth s LEU 66 N 1.80 4.62 0.56 3.68 1.43 -1.26 -5.03 118.68 124.48 2qth s LEU 66 Ca 0.08 2.04 -0.20 0.00 -1.03 0.00 0.00 54.13 55.02 2qth s LEU 66 Cb -0.17 -3.61 -0.05 0.00 0.03 0.00 0.00 46.19 42.38 2qth s LEU 66 CO 0.11 0.06 1.19 -0.54 0.23 0.00 0.00 176.35 177.41 2qth s LYS 67 N -1.23 3.20 0.29 1.70 1.02 -1.26 -4.90 119.74 118.55 2qth s LYS 67 Ca 0.42 1.79 0.03 0.00 0.02 0.00 0.00 55.97 58.24 2qth s LYS 67 Cb -0.28 -2.04 0.68 0.00 -0.52 0.00 0.00 37.83 35.67 2qth s LYS 67 CO 0.35 -1.02 1.75 -1.35 -0.92 0.00 0.00 175.35 174.16 2qth h PRO 68 N 1.17 0.61 -0.67 -1.68 0.11 -1.97 -0.33 132.00 129.23 2qth h PRO 68 Ca -0.50 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.57 2qth h PRO 68 Cb 1.28 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 32.22 2qth h PRO 68 CO 0.56 0.40 0.43 0.07 -0.21 0.00 0.00 178.00 179.25 2qth h ARG 69 N 0.63 0.90 -0.19 1.05 0.11 -1.92 -1.86 114.38 113.09 2qth h ARG 69 Ca 0.54 -0.06 -0.02 0.00 0.10 0.00 0.00 59.98 60.54 2qth h ARG 69 Cb 0.87 -0.20 -0.01 0.00 1.11 0.00 0.00 29.97 31.75 2qth h ARG 69 CO -0.41 0.61 0.06 0.45 0.10 0.00 0.00 179.97 180.78 2qth h HIS 70 N 0.92 0.31 -0.33 4.08 3.86 -1.24 -2.29 115.15 120.47 2qth h HIS 70 Ca 0.25 -0.03 0.05 0.00 -1.16 0.00 0.00 60.37 59.47 2qth h HIS 70 Cb -0.07 -0.09 -0.05 0.00 1.06 0.00 0.00 27.41 28.26 2qth h HIS 70 CO 0.00 0.40 0.05 0.74 0.86 0.00 0.00 177.93 179.98 2qth h PHE 71 N 0.13 0.08 -0.30 2.45 0.04 -1.04 0.24 116.94 118.54 2qth h PHE 71 Ca 0.06 0.02 0.05 0.00 2.80 0.00 0.00 57.97 60.90 2qth h PHE 71 Cb 0.23 0.01 -0.05 0.00 2.20 0.00 0.00 35.95 38.35 2qth h PHE 71 CO 0.00 0.00 0.01 0.82 -0.60 0.00 0.00 178.31 178.55 2qth h ILE 72 N 0.16 0.80 -0.01 -0.55 2.04 -1.22 -0.26 117.51 118.46 2qth h ILE 72 Ca 0.15 -0.04 -0.02 0.00 1.00 0.00 0.00 64.86 65.96 2qth h ILE 72 Cb 0.18 0.69 0.00 0.00 -0.74 0.00 0.00 36.82 36.95 2qth h ILE 72 CO -0.22 0.02 -0.06 0.78 0.00 0.00 0.00 178.15 178.67 2qth h ASN 73 N 0.10 0.08 -0.31 1.72 -0.26 -1.02 -2.01 115.58 113.89 2qth h ASN 73 Ca 0.14 -0.66 0.06 0.00 -0.56 0.00 0.00 56.30 55.28 2qth h ASN 73 Cb 0.18 -0.02 -0.05 0.00 -1.06 0.00 0.00 38.32 37.37 2qth h ASN 73 CO -0.23 0.72 -0.02 0.40 -1.06 0.00 0.00 177.43 177.24 2qth h ILE 74 N -0.57 0.75 -0.54 2.81 2.04 -0.52 -2.50 117.51 118.98 2qth h ILE 74 Ca -0.00 -0.02 -0.02 0.00 1.00 0.00 0.00 64.86 65.81 2qth h ILE 74 Cb 0.72 0.68 -0.03 0.00 -0.74 0.00 0.00 36.82 37.46 2qth h ILE 74 CO 0.01 0.01 0.24 0.03 0.00 0.00 0.00 178.15 178.44 2qth h ARG 75 N 0.06 0.76 -1.01 2.37 3.08 -1.05 -0.83 114.38 117.76 2qth h ARG 75 Ca 0.15 -0.10 0.03 0.00 0.07 0.00 0.00 59.98 60.13 2qth h ARG 75 Cb 0.21 -0.14 -0.06 0.00 0.08 0.00 0.00 29.97 30.06 2qth h ARG 75 CO -0.27 0.61 0.66 -0.09 -1.07 0.00 0.00 179.97 179.81 2qth h ARG 76 N 0.76 1.26 0.23 0.04 2.43 -1.02 -2.67 114.38 115.40 2qth h ARG 76 Ca 0.19 -0.08 -0.35 0.00 -0.81 0.00 0.00 59.98 58.94 2qth h ARG 76 Cb 0.11 -0.28 0.03 0.00 -0.42 0.00 0.00 29.97 29.41 2qth h ARG 76 CO -0.02 0.83 -1.61 0.93 -1.51 0.00 0.00 179.97 178.59 2qth h GLU 77 N 1.30 0.48 0.00 0.20 4.39 -0.86 -3.04 114.58 117.05 2qth h GLU 77 Ca 0.39 -0.82 -0.07 0.00 0.34 0.00 0.00 59.36 59.21 2qth h GLU 77 Cb -0.03 0.31 -0.01 0.00 -0.10 0.00 0.00 28.75 28.91 2qth h GLU 77 CO -0.12 1.39 -0.32 -0.07 -1.16 0.00 0.00 179.01 178.74 2qth h LEU 78 N 0.13 0.00 -2.85 1.33 3.38 -1.21 -3.47 115.31 112.63 2qth h LEU 78 Ca -0.30 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.47 2qth h LEU 78 Cb 2.14 0.00 0.03 0.00 0.09 0.00 0.00 40.66 42.92 2qth h LEU 78 CO 0.23 0.32 -0.47 0.29 0.09 0.00 0.00 178.44 178.90 2qth n LYS 79 N -3.56 -1.43 0.00 1.13 5.02 -1.01 -2.69 118.16 115.62 2qth n LYS 79 Ca -0.00 1.13 0.00 0.00 -2.02 0.00 0.00 58.31 57.41 2qth n LYS 79 Cb 0.45 -4.65 0.00 0.00 -0.02 0.00 0.00 35.03 30.82 2qth n LYS 79 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2qth n GLY 80 N -1.69 3.22 3.78 0.72 0.00 -1.26 -5.04 105.19 104.92 2qth n GLY 80 Ca -0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.54 2qth n GLY 80 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qth s LYS 81 N -0.48 4.37 0.22 1.61 1.02 -1.09 -5.02 119.74 120.35 2qth s LYS 81 Ca 0.00 1.53 -0.22 0.00 0.02 0.00 0.00 55.97 57.30 2qth s LYS 81 Cb 0.00 -2.75 -0.08 0.00 -0.52 0.00 0.00 37.83 34.48 2qth s LYS 81 CO 0.00 0.03 0.77 -2.00 -0.92 0.00 0.00 175.35 173.23 2qth s GLU 82 N -2.16 4.40 -0.08 1.68 2.12 -1.22 -4.78 118.70 118.66 2qth s GLU 82 Ca 0.53 1.03 0.04 0.00 0.36 0.00 0.00 54.97 56.93 2qth s GLU 82 Cb -0.23 -3.00 0.00 0.00 0.26 0.00 0.00 34.13 31.16 2qth s GLU 82 CO 0.30 0.44 -0.21 0.54 -0.54 0.00 0.00 175.26 175.79 2qth s VAL 83 N -1.41 1.78 -0.12 3.70 0.11 -1.26 -0.11 120.40 123.10 2qth s VAL 83 Ca 0.41 -0.87 -0.00 0.00 -2.93 0.00 0.00 61.98 58.59 2qth s VAL 83 Cb -0.19 -1.55 -0.02 0.00 -1.53 0.00 0.00 36.38 33.09 2qth s VAL 83 CO 0.23 0.50 -0.10 -0.76 -3.33 0.00 0.00 175.10 171.64 2qth s LEU 84 N 0.34 2.91 0.00 2.54 1.43 0.34 -4.96 118.68 121.28 2qth s LEU 84 Ca -0.15 -0.22 0.00 0.00 -1.03 0.00 0.00 54.13 52.73 2qth s LEU 84 Cb -0.17 -1.66 0.00 0.00 0.03 0.00 0.00 46.19 44.40 2qth s LEU 84 CO 0.07 0.21 0.00 -0.90 0.23 0.00 0.00 176.35 175.96 2qth n ASP 85 N 3.21 0.00 0.02 2.29 5.75 -1.26 -1.37 116.55 125.19 2qth n ASP 85 Ca -0.18 -0.41 -0.05 0.00 -0.01 0.00 0.00 54.79 54.15 2qth n ASP 85 Cb 0.53 0.00 0.16 0.00 -1.03 0.00 0.00 41.12 40.78 2qth n ASP 85 CO 0.00 0.00 0.00 0.50 -0.11 0.00 0.00 177.20 177.59 2qth h LYS 86 N 0.00 0.46 -0.09 0.11 3.64 -0.66 0.60 116.57 120.63 2qth h LYS 86 Ca 0.00 -0.21 -0.04 0.00 -1.27 0.00 0.00 60.65 59.13 2qth h LYS 86 Cb 0.00 -0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 31.81 2qth h LYS 86 CO 0.00 0.76 -0.08 0.82 -2.27 0.00 0.00 179.45 178.68 2qth h ILE 87 N 0.39 1.36 -0.15 2.00 2.04 -1.91 -2.21 117.51 119.02 2qth h ILE 87 Ca 0.04 -1.23 -0.13 0.00 1.00 0.00 0.00 64.86 64.54 2qth h ILE 87 Cb 0.82 1.99 -0.01 0.00 -0.74 0.00 0.00 36.82 38.88 2qth h ILE 87 CO 0.07 0.35 -0.45 -0.07 0.00 0.00 0.00 178.15 178.04 2qth h LEU 88 N -0.21 0.40 -0.14 1.44 3.38 -1.90 -0.47 115.31 117.82 2qth h LEU 88 Ca 0.01 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.80 2qth h LEU 88 Cb 0.59 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 2qth h LEU 88 CO 0.02 0.81 0.09 0.25 0.09 0.00 0.00 178.44 179.70 2qth h LEU 89 N 0.31 0.16 -0.76 1.67 5.85 -0.84 0.13 115.31 121.83 2qth h LEU 89 Ca 0.02 -0.02 -0.12 0.00 0.84 0.00 0.00 57.88 58.60 2qth h LEU 89 Cb 0.92 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.90 2qth h LEU 89 CO 0.08 0.13 -0.33 -0.07 -0.34 0.00 0.00 178.44 177.92 2qth h LEU 90 N 0.18 0.59 -1.15 2.25 3.38 -1.15 -1.65 115.31 117.76 2qth h LEU 90 Ca 0.05 -0.23 -0.02 0.00 0.09 0.00 0.00 57.88 57.76 2qth h LEU 90 Cb -0.01 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.55 2qth h LEU 90 CO -0.01 0.88 0.30 -0.07 0.09 0.00 0.00 178.44 179.62 2qth h LEU 91 N 0.48 0.80 -0.41 1.67 3.38 -0.86 -0.83 115.31 119.55 2qth h LEU 91 Ca 0.06 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2qth h LEU 91 Cb 0.80 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.33 2qth h LEU 91 CO 0.07 0.69 0.27 -0.08 0.09 0.00 0.00 178.44 179.47 2qth h GLU 92 N 0.89 0.54 -0.64 1.13 4.57 -0.50 0.12 114.58 120.70 2qth h GLU 92 Ca 0.22 -0.03 0.08 0.00 -1.18 0.00 0.00 59.36 58.45 2qth h GLU 92 Cb 0.10 -0.12 -0.07 0.00 -0.16 0.00 0.00 28.75 28.50 2qth h GLU 92 CO -0.03 0.36 0.29 0.82 -1.18 0.00 0.00 179.01 179.28 2qth h ILE 93 N 0.56 0.85 -0.22 2.32 2.04 -1.04 -1.29 117.51 120.72 2qth h ILE 93 Ca 0.15 -0.18 -0.04 0.00 1.00 0.00 0.00 64.86 65.79 2qth h ILE 93 Cb -0.06 0.28 -0.01 0.00 -0.74 0.00 0.00 36.82 36.29 2qth h ILE 93 CO -0.03 0.10 -0.00 -0.26 0.00 0.00 0.00 178.15 177.95 2qth h PHE 94 N 0.52 0.43 -0.70 1.37 0.04 -0.63 -2.07 116.94 115.90 2qth h PHE 94 Ca 0.31 -0.08 0.09 0.00 2.80 0.00 0.00 57.97 61.09 2qth h PHE 94 Cb 0.31 -0.11 -0.05 0.00 2.20 0.00 0.00 35.95 38.30 2qth h PHE 94 CO -0.12 0.58 0.46 0.00 -0.60 0.00 0.00 178.31 178.63 2qth h ALA 95 N 0.80 1.84 0.00 2.45 0.00 -0.45 0.14 119.26 124.04 2qth h ALA 95 Ca 0.06 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2qth h ALA 95 Cb 0.41 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 2qth h ALA 95 CO 0.01 0.02 -0.05 -0.07 0.00 0.00 0.00 179.25 179.17 2qth h LEU 96 N 0.62 0.00 -0.11 0.00 3.38 -0.82 -3.27 115.31 115.10 2qth h LEU 96 Ca 0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.29 2qth h LEU 96 Cb 0.43 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.18 2qth h LEU 96 CO -0.11 0.05 -0.68 1.41 0.09 0.00 0.00 178.44 179.20 2qth n HIS 97 N -3.12 0.00 -3.13 1.13 8.25 -0.10 -3.40 115.22 114.85 2qth n HIS 97 Ca 0.03 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.10 2qth n HIS 97 Cb 0.50 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.56 2qth n HIS 97 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2qth s ALA 98 N -2.39 3.44 -0.48 -1.41 0.00 0.31 -4.71 121.76 116.52 2qth s ALA 98 Ca 0.07 -0.08 0.13 0.00 0.00 0.00 0.00 51.96 52.08 2qth s ALA 98 Cb 0.12 -2.89 -0.15 0.00 0.00 0.00 0.00 23.12 20.20 2qth s ALA 98 CO 0.61 -0.23 0.49 0.41 0.00 0.00 0.00 175.76 177.04 2qth n GLY 99 N 3.37 -0.30 3.89 0.00 0.00 -1.26 -4.56 105.19 106.32 2qth n GLY 99 Ca -0.03 -0.36 -0.30 0.00 0.00 0.00 0.00 46.02 45.34 2qth n GLY 99 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2qth s SER 100 N -2.50 6.52 0.27 1.61 1.04 -1.26 -5.00 113.70 114.39 2qth s SER 100 Ca 0.03 0.78 -0.02 0.00 0.48 0.00 0.00 55.95 57.22 2qth s SER 100 Cb 0.09 -2.17 0.38 0.00 0.10 0.00 0.00 66.02 64.42 2qth s SER 100 CO 0.54 -0.12 1.82 0.50 0.98 0.00 0.00 173.24 176.96 2qth h LYS 101 N 2.16 0.86 -0.37 4.02 3.64 -1.99 -2.03 116.57 122.86 2qth h LYS 101 Ca -0.47 -0.17 -0.04 0.00 -1.27 0.00 0.00 60.65 58.69 2qth h LYS 101 Cb 1.18 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.85 2qth h LYS 101 CO 0.68 0.76 0.06 1.49 -2.27 0.00 0.00 179.45 180.18 2qth h GLU 102 N 0.83 0.61 -0.41 1.90 4.81 -1.98 -1.14 114.58 119.19 2qth h GLU 102 Ca 0.18 -0.16 -0.05 0.00 -0.13 0.00 0.00 59.36 59.20 2qth h GLU 102 Cb 0.29 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.58 2qth h GLU 102 CO -0.00 0.67 0.06 0.00 -0.73 0.00 0.00 179.01 179.01 2qth h ALA 103 N 0.91 0.55 -0.96 2.92 0.00 -1.84 -1.14 119.26 119.70 2qth h ALA 103 Ca 0.11 -0.22 0.04 0.00 0.00 0.00 0.00 54.91 54.84 2qth h ALA 103 Cb 0.36 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 17.94 2qth h ALA 103 CO 0.01 0.27 0.63 0.87 0.00 0.00 0.00 179.25 181.03 2qth h LYS 104 N 0.54 1.16 -0.35 0.00 1.79 -1.24 -0.41 116.57 118.07 2qth h LYS 104 Ca 0.12 -0.07 -0.09 0.00 -2.18 0.00 0.00 60.65 58.44 2qth h LYS 104 Cb 0.39 -0.26 -0.01 0.00 -1.58 0.00 0.00 32.23 30.76 2qth h LYS 104 CO 0.01 0.77 -0.12 0.52 -1.08 0.00 0.00 179.45 179.55 2qth h MET 105 N 1.20 0.70 -0.71 3.15 2.86 -0.87 -2.21 114.93 119.04 2qth h MET 105 Ca 0.38 -0.28 -0.02 0.00 -2.06 0.00 0.00 59.70 57.72 2qth h MET 105 Cb 0.02 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 31.62 2qth h MET 105 CO -0.12 0.87 0.36 1.96 1.06 0.00 0.00 176.91 181.04 2qth h GLN 106 N 0.48 1.00 -0.24 1.72 1.08 -0.69 -1.09 115.11 117.36 2qth h GLN 106 Ca 0.08 -0.13 -0.04 0.00 -1.45 0.00 0.00 58.65 57.12 2qth h GLN 106 Cb 0.64 -0.19 -0.01 0.00 -0.05 0.00 0.00 27.48 27.87 2qth h GLN 106 CO 0.04 0.76 -0.00 0.82 -0.95 0.00 0.00 178.83 179.50 2qth h ILE 107 N 1.00 1.26 -0.82 2.54 2.04 -1.03 -1.37 117.51 121.13 2qth h ILE 107 Ca 0.25 -0.90 -0.04 0.00 1.00 0.00 0.00 64.86 65.17 2qth h ILE 107 Cb 0.08 1.37 -0.04 0.00 -0.74 0.00 0.00 36.82 37.49 2qth h ILE 107 CO -0.03 0.28 0.35 -0.08 0.00 0.00 0.00 178.15 178.67 2qth h GLU 108 N 0.20 1.21 0.33 2.37 4.57 -1.34 -0.65 114.58 121.27 2qth h GLU 108 Ca 0.07 -0.20 -0.01 0.00 -1.18 0.00 0.00 59.36 58.03 2qth h GLU 108 Cb 0.41 -0.20 -0.00 0.00 -0.16 0.00 0.00 28.75 28.79 2qth h GLU 108 CO 0.01 0.96 -0.20 1.25 -1.18 0.00 0.00 179.01 179.86 2qth h LEU 109 N 1.19 -0.49 -0.75 1.64 5.85 -1.16 0.75 115.31 122.35 2qth h LEU 109 Ca 0.28 0.03 0.11 0.00 0.84 0.00 0.00 57.88 59.13 2qth h LEU 109 Cb 0.18 0.14 -0.08 0.00 0.37 0.00 0.00 40.66 41.28 2qth h LEU 109 CO -0.03 -0.32 0.37 0.00 -0.34 0.00 0.00 178.44 178.13 2qth h ALA 110 N 0.16 1.05 -0.64 1.25 0.00 -1.07 -1.57 119.26 118.44 2qth h ALA 110 Ca -0.03 0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 2qth h ALA 110 Cb 0.41 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 2qth h ALA 110 CO 0.04 -0.06 0.08 0.00 0.00 0.00 0.00 179.25 179.31 2qth h ARG 111 N 0.61 1.08 -0.17 0.00 3.08 -0.62 -0.55 114.38 117.81 2qth h ARG 111 Ca 0.38 -0.30 0.00 0.00 0.07 0.00 0.00 59.98 60.13 2qth h ARG 111 Cb 0.44 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.36 2qth h ARG 111 CO -0.30 1.01 0.11 -0.07 -1.07 0.00 0.00 179.97 179.65 2qth h LEU 112 N 0.99 0.20 -0.88 3.04 3.38 -0.69 -1.53 115.31 119.83 2qth h LEU 112 Ca 0.19 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 2qth h LEU 112 Cb 0.47 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.13 2qth h LEU 112 CO 0.02 0.17 0.51 0.11 0.09 0.00 0.00 178.44 179.34 2qth h LYS 113 N 0.21 1.21 0.00 1.13 1.57 -1.22 -2.33 116.57 117.14 2qth h LYS 113 Ca 0.06 -0.12 -0.05 0.00 -1.87 0.00 0.00 60.65 58.67 2qth h LYS 113 Cb 0.01 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 32.06 2qth h LYS 113 CO -0.01 0.86 -0.22 -0.92 -0.57 0.00 0.00 179.45 178.59 2qth h TYR 114 N 1.22 0.00 0.00 -1.35 3.20 -0.84 -2.96 116.97 116.23 2qth h TYR 114 Ca 0.31 0.00 -0.14 0.00 3.14 0.00 0.00 58.73 62.05 2qth h TYR 114 Cb -0.01 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.24 2qth h TYR 114 CO 0.00 0.22 -0.65 0.93 -1.64 0.00 0.00 178.16 177.03 2qth h GLU 115 N 0.00 0.00 -0.48 1.82 4.39 -0.75 -3.37 114.58 116.19 2qth h GLU 115 Ca -0.00 0.00 0.10 0.00 0.34 0.00 0.00 59.36 59.79 2qth h GLU 115 Cb 0.41 0.00 -0.10 0.00 -0.10 0.00 0.00 28.75 28.97 2qth h GLU 115 CO 0.03 0.65 -0.18 -0.07 -1.16 0.00 0.00 179.01 178.28 2qth h LEU 116 N 0.00 -0.62 -1.71 1.33 3.38 -1.29 0.30 115.31 116.70 2qth h LEU 116 Ca -0.01 0.16 -0.04 0.00 0.09 0.00 0.00 57.88 58.09 2qth h LEU 116 Cb 1.31 0.36 -0.01 0.00 0.09 0.00 0.00 40.66 42.42 2qth h LEU 116 CO 0.08 -0.21 -0.17 -0.65 0.09 0.00 0.00 178.44 177.58 2qth h PRO 117 N -0.07 0.00 0.11 1.13 0.11 -1.75 0.06 132.00 131.59 2qth h PRO 117 Ca 0.23 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.33 2qth h PRO 117 Cb 0.42 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.53 2qth h PRO 117 CO -0.53 0.17 -0.05 0.82 -0.21 0.00 0.00 178.00 178.20 2qth h ILE 118 N 0.00 1.07 -0.16 4.15 2.04 -1.45 -2.15 117.51 121.01 2qth h ILE 118 Ca -0.00 -0.77 0.03 0.00 1.00 0.00 0.00 64.86 65.12 2qth h ILE 118 Cb 0.34 1.55 -0.03 0.00 -0.74 0.00 0.00 36.82 37.94 2qth h ILE 118 CO 0.02 0.18 -0.01 0.40 0.00 0.00 0.00 178.15 178.75 2qth h ILE 119 N -0.51 0.88 -0.84 -0.67 2.04 -0.63 -2.02 117.51 115.76 2qth h ILE 119 Ca -0.02 -0.02 0.12 0.00 1.00 0.00 0.00 64.86 65.95 2qth h ILE 119 Cb 0.41 0.83 -0.08 0.00 -0.74 0.00 0.00 36.82 37.24 2qth h ILE 119 CO 0.03 0.01 0.46 0.11 0.00 0.00 0.00 178.15 178.75 2qth h LYS 120 N 0.05 0.69 0.00 2.37 1.57 -1.04 0.69 116.57 120.89 2qth h LYS 120 Ca 0.07 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 2qth h LYS 120 Cb 0.09 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.25 2qth h LYS 120 CO -0.13 0.45 0.00 0.39 -0.57 0.00 0.00 179.45 179.59 2qth n GLU 121 N -4.81 0.06 0.00 3.15 -0.58 -0.81 -5.09 120.64 112.56 2qth n GLU 121 Ca 0.15 0.26 0.00 0.00 -0.42 0.00 0.00 57.16 57.15 2qth n GLU 121 Cb 0.36 -1.60 0.00 0.00 -0.57 0.00 0.00 31.44 29.63 2qth n GLU 121 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 2qth n THR 122 N -1.71 0.00 0.00 2.62 -1.04 0.23 -5.01 114.28 109.37 2qth n THR 122 Ca 0.04 0.65 0.00 0.00 -2.04 0.00 0.00 64.05 62.69 2qth n THR 122 Cb 0.22 -1.44 0.00 0.00 -1.82 0.00 0.00 70.33 67.29 2qth n THR 122 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 2qth n SER 144 N -1.55 0.00 -0.21 8.00 2.88 -1.26 -5.06 113.62 116.42 2qth n SER 144 Ca 0.00 0.00 -0.06 0.00 -1.33 0.00 0.00 58.87 57.48 2qth n SER 144 Cb 0.00 0.00 0.09 0.00 -0.75 0.00 0.00 64.21 63.55 2qth n SER 144 CO 0.00 0.00 0.00 0.74 -1.23 0.00 0.00 175.04 174.55 2qth h THR 145 N 0.00 1.26 -0.98 2.46 2.02 -2.01 -1.16 112.91 114.50 2qth h THR 145 Ca 0.00 -0.96 0.04 0.00 0.77 0.00 0.00 66.41 66.26 2qth h THR 145 Cb 0.00 0.61 -0.06 0.00 -1.74 0.00 0.00 68.15 66.96 2qth h THR 145 CO 0.00 0.36 0.64 0.40 0.37 0.00 0.00 175.52 177.29 2qth h ILE 146 N 0.99 1.15 -0.24 3.11 5.03 -1.97 -1.28 117.51 124.30 2qth h ILE 146 Ca 0.20 -0.42 -0.13 0.00 -0.12 0.00 0.00 64.86 64.39 2qth h ILE 146 Cb 0.38 -0.17 -0.00 0.00 -3.03 0.00 0.00 36.82 34.00 2qth h ILE 146 CO 0.01 0.22 -0.37 0.11 -0.68 0.00 0.00 178.15 177.44 2qth h LYS 147 N 1.22 0.67 -0.26 2.37 1.79 -1.95 -2.46 116.57 117.95 2qth h LYS 147 Ca 0.40 -0.40 0.05 0.00 -2.18 0.00 0.00 60.65 58.51 2qth h LYS 147 Cb 0.03 0.04 -0.05 0.00 -1.58 0.00 0.00 32.23 30.67 2qth h LYS 147 CO -0.13 1.02 -0.05 0.35 -1.08 0.00 0.00 179.45 179.56 2qth h PHE 148 N 0.38 -0.10 0.18 -1.35 3.57 -0.75 -2.05 116.94 116.82 2qth h PHE 148 Ca 0.02 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.54 2qth h PHE 148 Cb 0.96 0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.79 2qth h PHE 148 CO 0.08 -0.09 -0.08 1.88 -2.23 0.00 0.00 178.31 177.86 2qth h TYR 149 N 0.02 -0.22 -0.80 0.41 -1.99 -1.14 -2.75 116.97 110.49 2qth h TYR 149 Ca 0.13 -0.01 0.07 0.00 2.00 0.00 0.00 58.73 60.92 2qth h TYR 149 Cb 0.19 0.07 -0.05 0.00 2.00 0.00 0.00 36.73 38.94 2qth h TYR 149 CO -0.24 -0.13 0.53 0.87 -0.00 0.00 0.00 178.16 179.18 2qth h LYS 150 N -0.24 0.83 -0.54 4.88 1.57 -1.40 0.12 116.57 121.79 2qth h LYS 150 Ca -0.02 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.69 2qth h LYS 150 Cb 0.18 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.28 2qth h LYS 150 CO 0.04 0.55 0.28 0.00 -0.57 0.00 0.00 179.45 179.75 2qth h ARG 151 N 0.86 0.77 -0.38 3.15 3.08 -1.25 0.56 114.38 121.18 2qth h ARG 151 Ca 0.35 -0.10 -0.04 0.00 0.07 0.00 0.00 59.98 60.25 2qth h ARG 151 Cb 0.26 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 2qth h ARG 151 CO -0.13 0.62 0.07 -0.09 -1.07 0.00 0.00 179.97 179.37 2qth h ARG 152 N 0.73 0.62 -0.39 0.04 2.43 -1.09 0.17 114.38 116.89 2qth h ARG 152 Ca 0.19 -0.16 0.05 0.00 -0.81 0.00 0.00 59.98 59.24 2qth h ARG 152 Cb 0.09 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 29.52 2qth h ARG 152 CO -0.03 0.68 0.14 0.82 -1.51 0.00 0.00 179.97 180.07 2qth h ILE 153 N 0.47 0.89 -0.45 1.20 2.04 -0.43 -1.15 117.51 120.08 2qth h ILE 153 Ca 0.12 -0.11 -0.01 0.00 1.00 0.00 0.00 64.86 65.86 2qth h ILE 153 Cb 0.35 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 36.97 2qth h ILE 153 CO 0.01 0.06 0.24 0.78 0.00 0.00 0.00 178.15 179.24 2qth h ASN 154 N 0.31 0.56 -0.37 1.72 2.35 0.31 -1.51 115.58 118.95 2qth h ASN 154 Ca 0.18 -0.09 0.07 0.00 -0.55 0.00 0.00 56.30 55.91 2qth h ASN 154 Cb 0.16 -0.14 -0.06 0.00 0.05 0.00 0.00 38.32 38.32 2qth h ASN 154 CO -0.18 0.49 -0.01 0.50 -1.65 0.00 0.00 177.43 176.58 2qth h LYS 155 N 0.59 0.09 -0.37 0.81 3.64 -0.64 0.54 116.57 121.22 2qth h LYS 155 Ca 0.16 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.49 2qth h LYS 155 Cb 0.06 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 2qth h LYS 155 CO -0.03 0.06 0.07 -0.07 -2.27 0.00 0.00 179.45 177.21 2qth h LEU 156 N 0.09 0.58 -0.61 5.20 3.38 -0.88 0.89 115.31 123.97 2qth h LEU 156 Ca 0.18 -0.25 0.04 0.00 0.09 0.00 0.00 57.88 57.94 2qth h LEU 156 Cb 0.26 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 40.81 2qth h LEU 156 CO -0.31 0.68 0.34 0.24 0.09 0.00 0.00 178.44 179.48 2qth h MET 157 N 0.45 0.63 0.07 1.13 2.86 -1.11 0.47 114.93 119.43 2qth h MET 157 Ca 0.11 -0.04 0.01 0.00 -2.06 0.00 0.00 59.70 57.72 2qth h MET 157 Cb 0.35 -0.14 -0.04 0.00 0.06 0.00 0.00 31.60 31.83 2qth h MET 157 CO 0.01 0.42 -0.40 -0.22 1.06 0.00 0.00 176.91 177.78 2qth h LYS 158 N 0.65 -0.53 -0.66 1.72 3.64 -0.65 -0.33 116.57 120.41 2qth h LYS 158 Ca 0.26 0.04 0.04 0.00 -1.27 0.00 0.00 60.65 59.72 2qth h LYS 158 Cb 0.12 0.12 -0.04 0.00 -0.41 0.00 0.00 32.23 32.02 2qth h LYS 158 CO -0.15 -0.35 0.43 0.93 -2.27 0.00 0.00 179.45 178.04 2qth h GLU 159 N -0.55 0.72 -0.15 1.90 5.08 -0.44 -1.69 114.58 119.44 2qth h GLU 159 Ca -0.00 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 2qth h GLU 159 Cb 0.56 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 2qth h GLU 159 CO -0.23 0.47 0.00 -0.07 -1.00 0.00 0.00 179.01 178.19 2qth h LEU 160 N 0.74 0.25 -1.82 1.33 3.38 0.03 -0.67 115.31 118.55 2qth h LEU 160 Ca 0.27 -0.30 0.03 0.00 0.09 0.00 0.00 57.88 57.97 2qth h LEU 160 Cb 0.14 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 2qth h LEU 160 CO -0.08 0.50 0.18 -0.08 0.09 0.00 0.00 178.44 179.05 2qth h GLU 161 N 0.00 0.22 -0.17 1.13 4.57 -0.82 -2.27 114.58 117.24 2qth h GLU 161 Ca 0.04 -0.01 -0.21 0.00 -1.18 0.00 0.00 59.36 58.00 2qth h GLU 161 Cb 0.36 -0.05 0.01 0.00 -0.16 0.00 0.00 28.75 28.91 2qth h GLU 161 CO 0.01 0.15 -0.72 1.03 -1.18 0.00 0.00 179.01 178.30 2qth h SER 162 N 0.23 0.88 1.00 1.04 0.87 -1.04 -3.05 113.55 113.48 2qth h SER 162 Ca 0.11 -0.55 0.00 0.00 -1.23 0.00 0.00 61.79 60.12 2qth h SER 162 Cb 0.17 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 61.87 2qth h SER 162 CO -0.02 1.34 0.00 0.16 -0.53 0.00 0.00 176.83 177.78 2qth h ILE 163 N 0.53 0.00 0.00 2.23 -0.00 -0.64 -2.97 117.51 116.66 2qth h ILE 163 Ca -0.03 -0.44 -0.12 0.00 -0.00 0.00 0.00 64.86 64.26 2qth h ILE 163 Cb 1.33 1.36 -0.02 0.00 -0.00 0.00 0.00 36.82 39.49 2qth h ILE 163 CO 0.15 0.00 -0.57 0.11 -0.00 0.00 0.00 178.15 177.84 2qth h LYS 164 N 0.00 0.00 -1.48 0.16 6.56 -1.31 -3.51 116.57 116.99 2qth h LYS 164 Ca 0.00 0.00 -0.27 0.00 -1.06 0.00 0.00 60.65 59.32 2qth h LYS 164 Cb 0.50 0.00 -0.12 0.00 -0.57 0.00 0.00 32.23 32.04 2qth h LYS 164 CO 0.00 0.57 0.35 -0.89 -2.06 0.00 0.00 179.45 177.42 2qth n ILE 165 N -3.68 2.55 0.00 1.86 5.41 -1.12 -5.12 119.36 119.25 2qth n ILE 165 Ca -0.01 -1.39 0.00 0.00 1.00 0.00 0.00 62.75 62.35 2qth n ILE 165 Cb 0.61 -1.25 0.00 0.00 -0.71 0.00 0.00 39.64 38.28 2qth n ILE 165 CO 0.00 0.00 0.00 2.30 0.00 0.00 0.00 176.55 178.85 2qth n ILE 179 N 0.37 0.00 -2.07 1.39 -5.35 -1.26 -5.01 119.36 107.43 2qth n ILE 179 Ca 0.26 0.00 -0.38 0.00 -0.27 0.00 0.00 62.75 62.36 2qth n ILE 179 Cb 0.64 0.00 0.01 0.00 -1.74 0.00 0.00 39.64 38.55 2qth n ILE 179 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 2qth s PRO 180 N 0.00 3.54 -0.23 6.28 0.04 -1.26 -4.73 135.00 138.64 2qth s PRO 180 Ca 0.00 1.97 -0.04 0.00 0.04 0.00 0.00 61.00 62.97 2qth s PRO 180 Cb 0.00 -2.37 0.00 0.00 0.04 0.00 0.00 34.50 32.17 2qth s PRO 180 CO 0.00 -0.78 -0.04 -1.12 0.04 0.00 0.00 177.00 175.10 2qth s SER 181 N -1.17 4.36 -0.19 6.66 0.01 -1.26 -0.22 113.70 121.89 2qth s SER 181 Ca 0.66 -0.52 -0.00 0.00 1.31 0.00 0.00 55.95 57.39 2qth s SER 181 Cb -0.34 -1.73 0.01 0.00 0.21 0.00 0.00 66.02 64.17 2qth s SER 181 CO 0.40 -0.06 -0.15 -0.63 0.41 0.00 0.00 173.24 173.21 2qth s ILE 182 N 1.45 2.48 -0.04 1.44 -1.09 -0.13 -0.49 121.20 124.82 2qth s ILE 182 Ca 0.04 -0.80 -0.12 0.00 -2.23 0.00 0.00 60.65 57.54 2qth s ILE 182 Cb -0.15 -2.07 -0.05 0.00 -1.58 0.00 0.00 42.46 38.61 2qth s ILE 182 CO -0.03 0.51 0.32 -0.83 -1.23 0.00 0.00 174.94 173.67 2qth s GLY 183 N 1.28 2.37 -0.24 6.18 0.00 -0.30 -1.81 107.32 114.79 2qth s GLY 183 Ca 0.04 -0.37 -0.08 0.00 0.00 0.00 0.00 44.72 44.31 2qth s GLY 183 CO -0.09 -0.04 0.09 -0.42 0.00 0.00 0.00 173.10 172.64 2qth s ILE 184 N -1.07 4.57 0.36 0.90 1.09 -0.63 0.11 121.20 126.54 2qth s ILE 184 Ca 0.21 -0.09 0.04 0.00 -1.10 0.00 0.00 60.65 59.72 2qth s ILE 184 Cb -0.15 -3.13 -0.06 0.00 -1.06 0.00 0.00 42.46 38.05 2qth s ILE 184 CO 0.10 0.34 0.05 0.68 -0.10 0.00 0.00 174.94 176.01 2qth s VAL 185 N 1.45 1.32 0.00 2.92 -7.23 0.24 -3.34 120.40 115.77 2qth s VAL 185 Ca 0.06 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.23 2qth s VAL 185 Cb -0.15 -2.77 0.00 0.00 0.56 0.00 0.00 36.38 34.02 2qth s VAL 185 CO 0.05 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.45 2qth n GLY 186 N -0.80 4.00 3.76 2.32 0.00 -1.26 -1.21 105.19 112.00 2qth n GLY 186 Ca -0.04 -1.52 -0.32 0.00 0.00 0.00 0.00 46.02 44.14 2qth n GLY 186 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2qth s TYR 187 N -2.00 2.53 0.41 1.61 1.51 -1.26 -1.55 117.35 118.60 2qth s TYR 187 Ca 0.00 1.57 -0.25 0.00 -1.01 0.00 0.00 57.07 57.38 2qth s TYR 187 Cb 0.00 -3.14 -0.10 0.00 -0.11 0.00 0.00 41.96 38.61 2qth s TYR 187 CO 0.00 -1.83 1.16 2.41 -1.11 0.00 0.00 175.55 176.17 2qth n THR 188 N -3.02 2.50 -1.26 -0.71 -1.04 -0.83 -2.07 114.28 107.85 2qth n THR 188 Ca 0.10 -0.50 -0.09 0.00 -2.04 0.00 0.00 64.05 61.52 2qth n THR 188 Cb 0.52 -1.38 -0.04 0.00 -1.82 0.00 0.00 70.33 67.62 2qth n THR 188 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 2qth n ASN 189 N 0.36 -4.23 0.06 8.00 5.15 -1.26 -4.88 115.26 118.46 2qth n ASN 189 Ca 0.08 0.22 0.12 0.00 -0.60 0.00 0.00 54.58 54.40 2qth n ASN 189 Cb 0.39 -2.51 0.13 0.00 -0.53 0.00 0.00 39.78 37.26 2qth n ASN 189 CO 0.00 0.00 0.00 0.77 1.40 0.00 0.00 177.26 179.43 2qth h SER 190 N 0.00 0.00 0.00 1.20 4.64 -1.78 -3.47 113.55 114.14 2qth h SER 190 Ca -0.18 -0.21 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 2qth h SER 190 Cb 0.63 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.72 2qth h SER 190 CO 0.27 0.10 0.00 0.61 -0.87 0.00 0.00 176.83 176.94 2qth n GLY 191 N 1.32 1.87 0.30 -0.77 0.00 -1.26 -4.50 105.19 102.15 2qth n GLY 191 Ca 0.03 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.02 2qth n GLY 191 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qth h LYS 192 N 0.00 0.97 -0.15 1.61 1.57 -1.92 -0.42 116.57 118.22 2qth h LYS 192 Ca 0.00 -0.06 -0.20 0.00 -1.87 0.00 0.00 60.65 58.53 2qth h LYS 192 Cb 0.00 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.09 2qth h LYS 192 CO 0.00 0.64 -0.69 1.15 -0.57 0.00 0.00 179.45 179.98 2qth h THR 193 N 0.99 1.31 -0.52 -0.16 2.02 -1.99 -1.67 112.91 112.90 2qth h THR 193 Ca 0.31 -1.96 -0.02 0.00 0.77 0.00 0.00 66.41 65.51 2qth h THR 193 Cb -0.01 1.93 -0.02 0.00 -1.74 0.00 0.00 68.15 68.31 2qth h THR 193 CO -0.10 0.61 0.26 0.28 0.37 0.00 0.00 175.52 176.94 2qth h SER 194 N 0.46 0.68 -0.25 4.18 0.02 -1.92 0.62 113.55 117.33 2qth h SER 194 Ca -0.03 -0.12 -0.01 0.00 -0.84 0.00 0.00 61.79 60.79 2qth h SER 194 Cb 1.29 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 63.64 2qth h SER 194 CO 0.13 0.60 0.11 0.25 -1.14 0.00 0.00 176.83 176.79 2qth h LEU 195 N 0.70 0.35 -0.33 5.07 6.46 -0.89 -0.65 115.31 126.01 2qth h LEU 195 Ca 0.18 -0.16 0.03 0.00 -0.12 0.00 0.00 57.88 57.81 2qth h LEU 195 Cb 0.10 -0.09 -0.03 0.00 -0.73 0.00 0.00 40.66 39.91 2qth h LEU 195 CO -0.02 0.41 0.15 0.15 -0.62 0.00 0.00 178.44 178.51 2qth h PHE 196 N 0.26 0.28 -0.79 1.25 3.57 -0.98 -1.94 116.94 118.60 2qth h PHE 196 Ca 0.09 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.56 2qth h PHE 196 Cb 0.16 -0.08 -0.04 0.00 2.79 0.00 0.00 35.95 38.79 2qth h PHE 196 CO -0.01 0.15 0.33 -0.91 -2.23 0.00 0.00 178.31 175.64 2qth h ASN 197 N 0.32 1.08 -0.46 0.41 2.35 -0.74 0.49 115.58 119.03 2qth h ASN 197 Ca 0.14 -0.17 -0.07 0.00 -0.55 0.00 0.00 56.30 55.66 2qth h ASN 197 Cb 0.07 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.14 2qth h ASN 197 CO -0.11 0.95 0.05 -1.28 -1.65 0.00 0.00 177.43 175.39 2qth h SER 198 N 1.14 0.81 -0.06 5.81 0.87 -0.82 0.23 113.55 121.53 2qth h SER 198 Ca 0.27 -0.18 -0.23 0.00 -1.23 0.00 0.00 61.79 60.41 2qth h SER 198 Cb 0.20 -0.21 0.02 0.00 -0.44 0.00 0.00 62.40 61.96 2qth h SER 198 CO -0.02 0.84 -0.86 -0.07 -0.53 0.00 0.00 176.83 176.19 2qth h LEU 199 N 0.80 0.85 -0.12 2.23 3.38 -0.90 -3.33 115.31 118.23 2qth h LEU 199 Ca 0.16 -0.70 -0.21 0.00 0.09 0.00 0.00 57.88 57.22 2qth h LEU 199 Cb 0.41 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 2qth h LEU 199 CO 0.01 1.43 -0.98 0.71 0.09 0.00 0.00 178.44 179.71 2qth h THR 200 N 0.35 1.61 0.00 0.22 1.35 -0.77 -3.47 112.91 112.20 2qth h THR 200 Ca -0.09 -3.06 0.00 0.00 -0.55 0.00 0.00 66.41 62.70 2qth h THR 200 Cb 1.51 2.71 0.00 0.00 -1.73 0.00 0.00 68.15 70.65 2qth h THR 200 CO 0.17 0.88 0.00 0.61 -0.25 0.00 0.00 175.52 176.93 2qth n GLY 201 N 1.17 0.68 0.00 5.82 0.00 0.76 -5.08 105.19 108.54 2qth n GLY 201 Ca -0.02 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2qth n GLY 201 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2qth n LEU 202 N 0.00 0.00 -1.39 0.99 4.77 -1.03 -5.03 117.00 115.31 2qth n LEU 202 Ca 0.00 0.00 0.18 0.00 -0.03 0.00 0.00 56.01 56.16 2qth n LEU 202 Cb 0.00 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.03 2qth n LEU 202 CO 0.00 -0.10 -0.42 0.23 -1.33 0.00 0.00 177.39 175.78 2qth n MET 214 N 0.00 -3.00 -3.69 3.23 2.00 -1.26 -4.67 117.12 109.74 2qth n MET 214 Ca 0.00 2.21 -0.11 0.00 0.00 0.00 0.00 57.70 59.80 2qth n MET 214 Cb 0.00 -3.58 -0.09 0.00 0.00 0.00 0.00 33.22 29.54 2qth n MET 214 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 175.97 174.43 2qth s SER 215 N -7.14 -0.61 0.79 7.83 1.04 -1.26 -4.47 113.70 109.88 2qth s SER 215 Ca 0.00 1.06 -0.12 0.00 0.48 0.00 0.00 55.95 57.37 2qth s SER 215 Cb 0.00 0.98 0.07 0.00 0.10 0.00 0.00 66.02 67.17 2qth s SER 215 CO 0.00 -0.20 1.14 -2.16 0.98 0.00 0.00 173.24 173.00 2qth s PRO 216 N 1.07 1.90 -0.50 4.02 0.04 -1.22 -5.02 135.00 135.30 2qth s PRO 216 Ca -0.06 1.47 -0.23 0.00 0.04 0.00 0.00 61.00 62.22 2qth s PRO 216 Cb -0.06 -1.83 0.04 0.00 0.04 0.00 0.00 34.50 32.68 2qth s PRO 216 CO -0.10 -1.96 0.80 0.15 0.04 0.00 0.00 177.00 175.94 2qth s LYS 217 N -4.46 3.31 -0.08 4.56 1.02 -1.26 -5.01 119.74 117.82 2qth s LYS 217 Ca 0.67 -0.33 0.01 0.00 0.02 0.00 0.00 55.97 56.34 2qth s LYS 217 Cb -0.22 -4.01 0.02 0.00 -0.52 0.00 0.00 37.83 33.09 2qth s LYS 217 CO 0.52 -1.26 -0.11 1.03 -0.92 0.00 0.00 175.35 174.61 2qth s ARG 218 N 3.37 1.64 -0.09 1.68 0.52 -1.26 -0.13 118.95 124.68 2qth s ARG 218 Ca 0.27 -0.36 -0.04 0.00 -0.52 0.00 0.00 55.73 55.08 2qth s ARG 218 Cb -0.14 -1.45 0.05 0.00 0.52 0.00 0.00 34.95 33.94 2qth s ARG 218 CO 0.19 -0.06 0.18 -0.47 0.02 0.00 0.00 175.30 175.16 2qth s TYR 219 N 0.96 -0.23 0.22 -0.53 5.04 0.40 -4.94 117.35 118.27 2qth s TYR 219 Ca -0.09 0.68 -0.30 0.00 -2.44 0.00 0.00 57.07 54.92 2qth s TYR 219 Cb -0.15 -0.20 -0.08 0.00 0.35 0.00 0.00 41.96 41.88 2qth s TYR 219 CO 0.00 -0.28 1.02 0.00 -1.34 0.00 0.00 175.55 174.95 2qth s ALA 220 N 2.24 3.35 0.05 3.97 0.00 -1.26 -0.66 121.76 129.45 2qth s ALA 220 Ca 0.02 0.73 0.03 0.00 0.00 0.00 0.00 51.96 52.73 2qth s ALA 220 Cb -0.12 -3.28 -0.03 0.00 0.00 0.00 0.00 23.12 19.70 2qth s ALA 220 CO -0.06 -0.00 -0.09 0.96 0.00 0.00 0.00 175.76 176.57 2qth s ILE 221 N -0.85 0.65 -0.10 0.00 -4.36 0.32 -4.94 121.20 111.92 2qth s ILE 221 Ca 0.44 -1.22 -0.21 0.00 -0.26 0.00 0.00 60.65 59.41 2qth s ILE 221 Cb -0.28 -0.80 -0.04 0.00 1.25 0.00 0.00 42.46 42.59 2qth s ILE 221 CO 0.35 -0.42 0.60 -2.16 0.24 0.00 0.00 174.94 173.55 2qth s PRO 222 N -1.87 4.38 -0.12 0.37 0.04 -1.26 0.07 135.00 136.61 2qth s PRO 222 Ca -0.06 0.68 -0.00 0.00 0.04 0.00 0.00 61.00 61.65 2qth s PRO 222 Cb -0.08 -3.45 0.02 0.00 0.04 0.00 0.00 34.50 31.03 2qth s PRO 222 CO 0.00 0.07 -0.09 0.42 0.04 0.00 0.00 177.00 177.45 2qth s ILE 223 N 0.83 1.14 0.00 0.56 1.01 0.43 -4.96 121.20 120.20 2qth s ILE 223 Ca 0.32 -0.36 0.00 0.00 0.00 0.00 0.00 60.65 60.61 2qth s ILE 223 Cb -0.16 -1.13 0.00 0.00 0.01 0.00 0.00 42.46 41.17 2qth s ILE 223 CO 0.14 0.39 0.00 0.59 0.00 0.00 0.00 174.94 176.06 2qth n ASN 224 N 4.91 0.00 -1.76 3.58 3.02 -1.26 -1.26 115.26 122.49 2qth n ASN 224 Ca -0.13 0.00 -0.01 0.00 -0.03 0.00 0.00 54.58 54.40 2qth n ASN 224 Cb 0.50 0.00 0.31 0.00 -0.61 0.00 0.00 39.78 39.98 2qth n ASN 224 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 2qth n ASN 225 N 5.50 4.73 -4.19 6.41 6.94 -1.26 -4.96 115.26 128.43 2qth n ASN 225 Ca 0.00 -3.18 -0.24 0.00 -0.02 0.00 0.00 54.58 51.14 2qth n ASN 225 Cb 0.00 -0.70 -0.15 0.00 -2.36 0.00 0.00 39.78 36.58 2qth n ASN 225 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 2qth s ARG 226 N -2.95 1.34 -0.17 -3.83 0.52 -0.39 -5.12 118.95 108.35 2qth s ARG 226 Ca 0.53 -0.76 -0.07 0.00 -0.52 0.00 0.00 55.73 54.90 2qth s ARG 226 Cb 0.42 -1.36 -0.04 0.00 0.52 0.00 0.00 34.95 34.49 2qth s ARG 226 CO 0.12 0.36 0.06 0.21 0.02 0.00 0.00 175.30 176.08 2qth s LYS 227 N -0.80 3.89 -0.08 3.54 2.20 -1.26 -0.43 119.74 126.81 2qth s LYS 227 Ca 0.06 -0.33 0.03 0.00 -0.36 0.00 0.00 55.97 55.37 2qth s LYS 227 Cb -0.08 -3.19 0.01 0.00 -1.51 0.00 0.00 37.83 33.06 2qth s LYS 227 CO 0.00 0.34 -0.15 0.42 -0.36 0.00 0.00 175.35 175.60 2qth s ILE 228 N 0.19 1.38 -0.32 5.43 1.01 0.11 -4.20 121.20 124.81 2qth s ILE 228 Ca 0.04 -0.62 -0.20 0.00 0.00 0.00 0.00 60.65 59.87 2qth s ILE 228 Cb -0.12 -1.24 -0.01 0.00 0.01 0.00 0.00 42.46 41.10 2qth s ILE 228 CO 0.00 0.41 0.62 -0.32 0.00 0.00 0.00 174.94 175.65 2qth s MET 229 N 0.59 3.82 -0.13 2.79 -2.45 0.69 -0.52 119.30 124.09 2qth s MET 229 Ca -0.15 0.19 -0.16 0.00 -1.25 0.00 0.00 55.69 54.31 2qth s MET 229 Cb -0.16 -3.76 -0.04 0.00 1.25 0.00 0.00 34.83 32.12 2qth s MET 229 CO 0.05 -0.62 0.40 -0.51 1.05 0.00 0.00 175.02 175.39 2qth s LEU 230 N 2.61 4.27 -0.21 4.11 1.43 0.16 -0.96 118.68 130.10 2qth s LEU 230 Ca 0.24 0.70 0.02 0.00 -1.03 0.00 0.00 54.13 54.06 2qth s LEU 230 Cb -0.15 -2.57 0.04 0.00 0.03 0.00 0.00 46.19 43.55 2qth s LEU 230 CO 0.13 0.05 -0.14 -0.69 0.23 0.00 0.00 176.35 175.93 2qth s VAL 231 N 0.49 1.96 -0.68 -1.59 1.01 -0.75 -0.45 120.40 120.39 2qth s VAL 231 Ca 0.22 -1.18 -0.26 0.00 0.00 0.00 0.00 61.98 60.76 2qth s VAL 231 Cb -0.14 -1.94 -0.01 0.00 0.00 0.00 0.00 36.38 34.29 2qth s VAL 231 CO 0.08 0.24 1.68 -0.62 0.00 0.00 0.00 175.10 176.48 2qth s ASP 232 N 1.26 5.56 0.33 3.32 2.15 0.82 -1.60 116.67 128.52 2qth s ASP 232 Ca -0.01 -0.01 -0.22 0.00 0.43 0.00 0.00 52.55 52.73 2qth s ASP 232 Cb -0.16 -2.54 -0.10 0.00 -0.30 0.00 0.00 42.92 39.82 2qth s ASP 232 CO -0.09 -2.22 0.88 0.42 -0.17 0.00 0.00 175.17 173.99 2qth s THR 233 N 8.03 4.38 0.46 1.71 -4.23 -1.21 -4.52 115.64 120.25 2qth s THR 233 Ca 0.57 1.54 -0.21 0.00 -1.18 0.00 0.00 61.69 62.41 2qth s THR 233 Cb -0.11 -3.83 -0.12 0.00 1.34 0.00 0.00 72.50 69.78 2qth s THR 233 CO 0.17 0.00 0.55 0.55 -0.54 0.00 0.00 174.62 175.35 2qth n VAL 234 N 0.19 1.85 -1.45 2.29 3.14 -1.26 -4.83 118.33 118.25 2qth n VAL 234 Ca 0.03 -0.50 -0.30 0.00 -2.96 0.00 0.00 64.34 60.60 2qth n VAL 234 Cb 0.52 -0.59 0.10 0.00 -1.06 0.00 0.00 33.84 32.80 2qth n VAL 234 CO 0.00 0.00 0.00 -0.83 -6.46 0.00 0.00 176.83 169.54 2qth s GLY 235 N -0.98 1.63 0.21 7.55 0.00 -1.26 -4.77 107.32 109.69 2qth s GLY 235 Ca 0.64 -0.09 -0.31 0.00 0.00 0.00 0.00 44.72 44.96 2qth s GLY 235 CO 0.57 0.32 1.46 -1.36 0.00 0.00 0.00 173.10 174.10 2qth s PHE 236 N -3.07 3.07 -0.05 1.90 0.08 -0.59 -4.91 117.98 114.41 2qth s PHE 236 Ca 0.61 0.94 0.06 0.00 0.12 0.00 0.00 56.93 58.65 2qth s PHE 236 Cb -0.15 -3.81 -0.01 0.00 -0.57 0.00 0.00 43.02 38.47 2qth s PHE 236 CO 0.55 -2.76 -0.23 0.42 -0.10 0.00 0.00 175.22 173.11 2qth s ILE 237 N 0.40 1.85 0.29 0.64 1.01 -1.26 -1.96 121.20 122.17 2qth s ILE 237 Ca 0.62 -0.96 -0.28 0.00 0.00 0.00 0.00 60.65 60.04 2qth s ILE 237 Cb -0.41 -1.57 -0.09 0.00 0.01 0.00 0.00 42.46 40.39 2qth s ILE 237 CO 0.39 0.52 0.96 -0.13 0.00 0.00 0.00 174.94 176.68 2qth s ARG 238 N -0.13 4.66 -0.97 2.79 0.52 -1.26 -4.46 118.95 120.10 2qth s ARG 238 Ca -0.03 1.45 -0.04 0.00 -0.52 0.00 0.00 55.73 56.59 2qth s ARG 238 Cb -0.13 -3.00 0.00 0.00 0.52 0.00 0.00 34.95 32.35 2qth s ARG 238 CO 0.03 0.34 0.84 0.41 0.02 0.00 0.00 175.30 176.93 2qth n GLY 239 N 0.95 -0.17 3.66 -3.53 0.00 -1.26 -4.91 105.19 99.94 2qth n GLY 239 Ca 0.00 -0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 2qth n GLY 239 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qth s ILE 240 N -3.25 4.38 0.22 -0.61 1.01 -1.26 -4.97 121.20 116.72 2qth s ILE 240 Ca 0.26 1.67 -0.31 0.00 0.00 0.00 0.00 60.65 62.27 2qth s ILE 240 Cb -0.12 -4.08 -0.15 0.00 0.01 0.00 0.00 42.46 38.13 2qth s ILE 240 CO 0.55 -0.12 1.15 -2.65 0.00 0.00 0.00 174.94 173.87 2qth n PRO 241 N 6.30 1.36 -0.24 2.79 -0.02 -1.26 -4.85 135.00 139.08 2qth n PRO 241 Ca 0.13 0.48 0.19 0.00 -2.02 0.00 0.00 63.50 62.28 2qth n PRO 241 Cb 0.45 -1.96 0.51 0.00 -0.02 0.00 0.00 33.50 32.48 2qth n PRO 241 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 2qth h PRO 242 N 3.06 0.39 0.00 0.52 0.13 -2.02 -2.29 132.00 131.80 2qth h PRO 242 Ca -0.42 -0.02 -0.02 0.00 -0.87 0.00 0.00 66.00 64.67 2qth h PRO 242 Cb 1.33 -0.09 -0.00 0.00 0.13 0.00 0.00 31.00 32.37 2qth h PRO 242 CO 0.68 0.26 -0.08 1.96 -0.23 0.00 0.00 178.00 180.59 2qth h GLN 243 N 0.40 0.00 -0.16 0.86 7.50 -2.03 -3.05 115.11 118.63 2qth h GLN 243 Ca 0.47 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.62 2qth h GLN 243 Cb 1.18 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.71 2qth h GLN 243 CO -0.18 0.08 0.00 0.44 -1.50 0.00 0.00 178.83 177.67 2qth n ILE 244 N -3.69 0.78 -0.28 2.54 -5.35 -0.86 -4.67 119.36 107.82 2qth n ILE 244 Ca -0.02 -0.89 -0.05 0.00 -0.27 0.00 0.00 62.75 61.51 2qth n ILE 244 Cb 0.18 0.64 0.06 0.00 -1.74 0.00 0.00 39.64 38.79 2qth n ILE 244 CO 0.00 0.00 0.00 0.58 -1.76 0.00 0.00 176.55 175.37 2qth h VAL 245 N 1.21 1.25 -0.46 7.28 2.07 -1.54 0.53 116.25 126.58 2qth h VAL 245 Ca 0.00 -0.70 -0.13 0.00 0.82 0.00 0.00 66.70 66.69 2qth h VAL 245 Cb 0.55 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 30.58 2qth h VAL 245 CO 0.00 0.30 -0.22 0.44 0.02 0.00 0.00 177.57 178.11 2qth h ASP 246 N 1.10 0.97 -0.49 0.57 3.32 -1.83 -1.88 116.42 118.18 2qth h ASP 246 Ca 0.27 -0.36 -0.02 0.00 0.02 0.00 0.00 57.03 56.93 2qth h ASP 246 Cb 0.12 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.38 2qth h ASP 246 CO -0.03 1.14 0.24 0.00 -1.72 0.00 0.00 179.24 178.87 2qth h ALA 247 N 0.92 1.43 0.77 3.45 0.00 -1.75 -1.66 119.26 122.42 2qth h ALA 247 Ca 0.11 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 2qth h ALA 247 Cb 0.78 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 18.36 2qth h ALA 247 CO 0.06 0.44 -0.37 0.35 0.00 0.00 0.00 179.25 179.74 2qth h PHE 248 N 0.74 -0.95 -0.99 0.00 3.57 -0.43 -1.99 116.94 116.89 2qth h PHE 248 Ca 0.18 -0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.71 2qth h PHE 248 Cb 0.11 0.32 -0.06 0.00 2.79 0.00 0.00 35.95 39.10 2qth h PHE 248 CO 0.01 -0.58 0.64 0.74 -2.23 0.00 0.00 178.31 176.89 2qth h PHE 249 N -1.16 1.19 -0.53 0.41 0.04 -1.38 0.21 116.94 115.71 2qth h PHE 249 Ca -0.11 0.03 -0.11 0.00 2.80 0.00 0.00 57.97 60.59 2qth h PHE 249 Cb 0.81 -0.39 -0.02 0.00 2.20 0.00 0.00 35.95 38.55 2qth h PHE 249 CO -0.00 0.65 -0.10 0.28 -0.60 0.00 0.00 178.31 178.53 2qth h VAL 250 N 1.19 1.27 -0.20 -0.55 2.07 -1.29 0.11 116.25 118.85 2qth h VAL 250 Ca 0.41 -1.24 -0.01 0.00 0.82 0.00 0.00 66.70 66.68 2qth h VAL 250 Cb 0.10 0.95 -0.01 0.00 -1.52 0.00 0.00 31.29 30.82 2qth h VAL 250 CO -0.15 0.44 0.10 0.74 0.02 0.00 0.00 177.57 178.72 2qth h THR 251 N 0.89 1.12 -0.62 2.57 2.02 -0.89 -3.09 112.91 114.90 2qth h THR 251 Ca 0.14 -0.32 -0.05 0.00 0.77 0.00 0.00 66.41 66.95 2qth h THR 251 Cb 0.65 0.98 -0.03 0.00 -1.74 0.00 0.00 68.15 68.01 2qth h THR 251 CO 0.05 0.11 0.19 0.25 0.37 0.00 0.00 175.52 176.49 2qth h LEU 252 N 0.20 0.91 -2.41 2.58 5.85 -0.43 -2.77 115.31 119.24 2qth h LEU 252 Ca 0.07 -0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.58 2qth h LEU 252 Cb 0.09 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 40.88 2qth h LEU 252 CO -0.01 0.88 0.09 0.28 -0.34 0.00 0.00 178.44 179.34 2qth h SER 253 N 0.89 0.00 0.00 1.25 0.02 -0.70 0.31 113.55 115.33 2qth h SER 253 Ca 0.20 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.15 2qth h SER 253 Cb 0.29 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.83 2qth h SER 253 CO -0.01 0.00 0.16 -0.33 -1.14 0.00 0.00 176.83 175.51 2qth h GLU 254 N 0.00 0.00 0.00 3.45 5.08 -1.45 -1.82 114.58 119.84 2qth h GLU 254 Ca 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 2qth h GLU 254 Cb 0.19 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.44 2qth h GLU 254 CO 0.00 0.00 -0.04 0.00 -1.00 0.00 0.00 179.01 177.97 2qth h ALA 255 N 1.59 1.23 0.00 3.43 0.00 -0.58 -1.50 119.26 123.44 2qth h ALA 255 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2qth h ALA 255 Cb 0.32 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2qth h ALA 255 CO 0.00 0.05 0.00 0.36 0.00 0.00 0.00 179.25 179.66 2qth n LYS 256 N -3.47 0.26 0.24 0.00 2.85 -0.69 -2.87 118.16 114.49 2qth n LYS 256 Ca -0.02 0.12 0.13 0.00 -1.05 0.00 0.00 58.31 57.49 2qth n LYS 256 Cb 0.15 -1.50 0.47 0.00 -0.65 0.00 0.00 35.03 33.50 2qth n LYS 256 CO 0.00 0.00 0.00 1.88 -0.05 0.00 0.00 177.40 179.23 2qth h TYR 257 N 0.00 0.00 -3.51 5.58 0.05 -1.50 -3.45 116.97 114.14 2qth h TYR 257 Ca 0.00 0.00 -0.53 0.00 0.05 0.00 0.00 58.73 58.25 2qth h TYR 257 Cb 0.12 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 37.83 2qth h TYR 257 CO 0.00 0.10 0.08 -1.12 -1.05 0.00 0.00 178.16 176.17 2qth s SER 258 N -6.00 7.06 0.41 3.88 0.01 -1.14 -4.95 113.70 112.96 2qth s SER 258 Ca 0.02 1.38 0.18 0.00 1.31 0.00 0.00 55.95 58.84 2qth s SER 258 Cb 0.08 -2.41 0.88 0.00 0.21 0.00 0.00 66.02 64.79 2qth s SER 258 CO 0.61 0.07 1.86 0.44 0.41 0.00 0.00 173.24 176.64 2qth h ASP 259 N 3.60 0.00 -5.12 2.44 3.32 -1.11 -3.46 116.42 116.09 2qth h ASP 259 Ca -0.48 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.55 2qth h ASP 259 Cb 1.20 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 40.66 2qth h ASP 259 CO 0.65 0.31 0.01 0.00 -1.72 0.00 0.00 179.24 178.50 2qth s ALA 260 N -4.05 -0.77 0.05 3.45 0.00 -0.91 -4.23 121.76 115.29 2qth s ALA 260 Ca -0.02 -0.43 0.04 0.00 0.00 0.00 0.00 51.96 51.55 2qth s ALA 260 Cb 0.13 0.91 -0.02 0.00 0.00 0.00 0.00 23.12 24.14 2qth s ALA 260 CO 0.68 -0.85 -0.13 -0.51 0.00 0.00 0.00 175.76 174.96 2qth s LEU 261 N -2.92 2.22 -0.22 0.00 1.43 -0.72 -1.15 118.68 117.32 2qth s LEU 261 Ca 0.13 -0.51 -0.06 0.00 -1.03 0.00 0.00 54.13 52.66 2qth s LEU 261 Cb -0.02 -0.48 -0.03 0.00 0.03 0.00 0.00 46.19 45.70 2qth s LEU 261 CO 0.02 -0.05 0.04 -0.63 0.23 0.00 0.00 176.35 175.96 2qth s ILE 262 N -1.06 4.17 -0.26 -0.59 1.01 0.12 -0.52 121.20 124.07 2qth s ILE 262 Ca -0.02 -0.23 -0.08 0.00 0.00 0.00 0.00 60.65 60.32 2qth s ILE 262 Cb -0.09 -2.91 -0.03 0.00 0.01 0.00 0.00 42.46 39.44 2qth s ILE 262 CO 0.01 0.39 0.09 -0.22 0.00 0.00 0.00 174.94 175.22 2qth s LEU 263 N 1.23 3.56 -0.14 2.97 2.96 0.26 -0.59 118.68 128.92 2qth s LEU 263 Ca 0.04 -0.19 -0.09 0.00 -0.22 0.00 0.00 54.13 53.67 2qth s LEU 263 Cb -0.15 -1.96 -0.04 0.00 0.50 0.00 0.00 46.19 44.54 2qth s LEU 263 CO 0.02 -0.05 0.16 -0.69 -1.32 0.00 0.00 176.35 174.48 2qth s VAL 264 N 1.64 5.44 -0.03 1.68 1.01 -0.35 -0.34 120.40 129.45 2qth s VAL 264 Ca 0.06 0.26 0.01 0.00 0.00 0.00 0.00 61.98 62.31 2qth s VAL 264 Cb -0.15 -3.46 0.02 0.00 0.00 0.00 0.00 36.38 32.79 2qth s VAL 264 CO 0.05 0.54 -0.02 -0.63 0.00 0.00 0.00 175.10 175.04 2qth s ILE 265 N -0.44 0.29 -0.42 2.22 -1.09 -0.80 -4.26 121.20 116.70 2qth s ILE 265 Ca 0.13 -0.02 -0.28 0.00 -2.23 0.00 0.00 60.65 58.25 2qth s ILE 265 Cb -0.12 -0.33 0.00 0.00 -1.58 0.00 0.00 42.46 40.43 2qth s ILE 265 CO 0.02 0.15 1.51 -0.62 -1.23 0.00 0.00 174.94 174.78 2qth s ASP 266 N 0.74 6.17 0.37 3.58 -1.08 -1.26 -0.55 116.67 124.64 2qth s ASP 266 Ca -0.08 0.84 0.25 0.00 -0.52 0.00 0.00 52.55 53.05 2qth s ASP 266 Cb -0.11 -2.54 1.33 0.00 -1.46 0.00 0.00 42.92 40.14 2qth s ASP 266 CO -0.01 -1.56 1.78 0.77 0.52 0.00 0.00 175.17 176.67 2qth h SER 267 N 11.38 0.00 0.43 -0.34 4.64 -1.27 -2.93 113.55 125.46 2qth h SER 267 Ca -0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 2qth h SER 267 Cb 1.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 2qth h SER 267 CO 1.09 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 177.40 2qth n THR 268 N -2.39 0.20 -2.61 2.95 -2.24 -1.26 -4.83 114.28 104.09 2qth n THR 268 Ca -0.01 0.05 -0.40 0.00 -2.27 0.00 0.00 64.05 61.42 2qth n THR 268 Cb 0.07 -0.64 -0.05 0.00 -2.10 0.00 0.00 70.33 67.61 2qth n THR 268 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 2qth s PHE 269 N -2.53 3.76 0.80 4.78 0.08 -1.11 -4.99 117.98 118.76 2qth s PHE 269 Ca 0.24 1.80 -0.16 0.00 0.12 0.00 0.00 56.93 58.93 2qth s PHE 269 Cb 0.17 -3.13 -0.07 0.00 -0.57 0.00 0.00 43.02 39.41 2qth s PHE 269 CO 0.37 -0.08 0.06 -1.13 -0.10 0.00 0.00 175.22 174.34 2qth n SER 270 N 1.26 -3.00 -0.23 1.36 3.41 -1.26 -4.48 113.62 110.68 2qth n SER 270 Ca -0.01 0.45 0.03 0.00 -0.26 0.00 0.00 58.87 59.08 2qth n SER 270 Cb 0.46 -1.04 0.15 0.00 -0.26 0.00 0.00 64.21 63.52 2qth n SER 270 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2qth h GLU 271 N -0.70 0.27 -0.28 4.33 5.08 -1.96 0.22 114.58 121.54 2qth h GLU 271 Ca -0.44 -0.02 -0.13 0.00 -1.00 0.00 0.00 59.36 57.77 2qth h GLU 271 Cb 1.34 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.52 2qth h GLU 271 CO 0.36 0.18 -0.38 -0.91 -1.00 0.00 0.00 179.01 177.26 2qth h ASN 272 N 0.27 0.68 -0.68 1.42 -0.26 -2.00 -1.54 115.58 113.47 2qth h ASN 272 Ca 0.37 -0.29 -0.05 0.00 -0.56 0.00 0.00 56.30 55.76 2qth h ASN 272 Cb 0.59 -0.19 -0.03 0.00 -1.06 0.00 0.00 38.32 37.63 2qth h ASN 272 CO -0.46 0.99 0.21 0.25 -1.06 0.00 0.00 177.43 177.36 2qth h LEU 273 N 0.53 0.99 -0.48 1.61 5.85 -1.80 -2.68 115.31 119.33 2qth h LEU 273 Ca 0.05 -0.21 0.08 0.00 0.84 0.00 0.00 57.88 58.65 2qth h LEU 273 Cb 0.89 -0.26 -0.07 0.00 0.37 0.00 0.00 40.66 41.59 2qth h LEU 273 CO 0.08 0.93 0.08 -0.07 -0.34 0.00 0.00 178.44 179.12 2qth h LEU 274 N 0.99 -0.04 -0.35 2.25 3.38 -0.34 -0.68 115.31 120.53 2qth h LEU 274 Ca 0.22 0.09 -0.00 0.00 0.09 0.00 0.00 57.88 58.28 2qth h LEU 274 Cb 0.30 0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 2qth h LEU 274 CO -0.01 0.01 0.21 0.40 0.09 0.00 0.00 178.44 179.14 2qth h ILE 275 N 0.21 1.12 -0.04 1.22 2.04 -1.11 -1.79 117.51 119.15 2qth h ILE 275 Ca 0.24 -0.28 -0.00 0.00 1.00 0.00 0.00 64.86 65.82 2qth h ILE 275 Cb 0.33 0.68 -0.00 0.00 -0.74 0.00 0.00 36.82 37.08 2qth h ILE 275 CO -0.33 0.12 0.02 -0.08 0.00 0.00 0.00 178.15 177.88 2qth h GLU 276 N 0.45 0.05 -0.65 2.37 4.81 -1.39 0.49 114.58 120.71 2qth h GLU 276 Ca 0.12 -0.01 0.09 0.00 -0.13 0.00 0.00 59.36 59.44 2qth h GLU 276 Cb 0.01 -0.01 -0.07 0.00 0.63 0.00 0.00 28.75 29.31 2qth h GLU 276 CO -0.02 0.13 0.28 1.15 -0.73 0.00 0.00 179.01 179.81 2qth h THR 277 N -0.04 0.80 -0.10 0.32 2.02 -0.99 0.32 112.91 115.24 2qth h THR 277 Ca 0.01 -0.16 -0.11 0.00 0.77 0.00 0.00 66.41 66.92 2qth h THR 277 Cb 0.09 0.28 0.00 0.00 -1.74 0.00 0.00 68.15 66.78 2qth h THR 277 CO -0.00 0.09 -0.35 -0.07 0.37 0.00 0.00 175.52 175.55 2qth h LEU 278 N 0.48 0.48 -0.25 2.58 3.38 -1.15 0.28 115.31 121.12 2qth h LEU 278 Ca 0.32 -0.62 0.05 0.00 0.09 0.00 0.00 57.88 57.73 2qth h LEU 278 Cb 0.38 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.94 2qth h LEU 278 CO -0.29 1.02 -0.05 1.56 0.09 0.00 0.00 178.44 180.77 2qth h GLN 279 N -0.02 0.02 -0.36 1.13 4.20 0.14 -2.20 115.11 118.02 2qth h GLN 279 Ca -0.02 -0.00 -0.10 0.00 0.06 0.00 0.00 58.65 58.60 2qth h GLN 279 Cb 0.98 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.75 2qth h GLN 279 CO 0.07 0.01 -0.16 1.03 -0.67 0.00 0.00 178.83 179.12 2qth h SER 280 N 0.02 0.75 -0.60 1.46 0.87 -0.16 -1.71 113.55 114.18 2qth h SER 280 Ca 0.12 -0.40 0.12 0.00 -1.23 0.00 0.00 61.79 60.40 2qth h SER 280 Cb 0.17 -0.21 -0.10 0.00 -0.44 0.00 0.00 62.40 61.83 2qth h SER 280 CO -0.24 0.99 0.05 0.28 -0.53 0.00 0.00 176.83 177.37 2qth h SER 281 N 0.52 -0.17 1.26 6.23 0.02 -0.33 -0.31 113.55 120.77 2qth h SER 281 Ca 0.08 0.14 -0.14 0.00 -0.84 0.00 0.00 61.79 61.03 2qth h SER 281 Cb 0.69 0.23 -0.02 0.00 0.14 0.00 0.00 62.40 63.44 2qth h SER 281 CO 0.05 -0.07 -0.65 -0.26 -1.14 0.00 0.00 176.83 174.76 2qth h PHE 282 N 0.16 0.00 -0.01 3.45 0.04 -1.37 -1.81 116.94 117.40 2qth h PHE 282 Ca 0.32 0.00 0.03 0.00 2.80 0.00 0.00 57.97 61.11 2qth h PHE 282 Cb 0.50 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.62 2qth h PHE 282 CO -0.32 0.65 -0.18 1.49 -0.60 0.00 0.00 178.31 179.36 2qth h GLU 283 N 0.00 -0.27 -0.37 1.51 4.81 -0.96 -2.09 114.58 117.21 2qth h GLU 283 Ca -0.01 0.02 -0.12 0.00 -0.13 0.00 0.00 59.36 59.12 2qth h GLU 283 Cb 1.46 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.89 2qth h GLU 283 CO 0.08 -0.18 -0.25 0.82 -0.73 0.00 0.00 179.01 178.75 2qth h ILE 284 N -0.28 1.28 -0.48 2.32 2.04 -0.88 -2.06 117.51 119.44 2qth h ILE 284 Ca 0.06 -1.40 -0.05 0.00 1.00 0.00 0.00 64.86 64.46 2qth h ILE 284 Cb 0.36 1.37 -0.02 0.00 -0.74 0.00 0.00 36.82 37.79 2qth h ILE 284 CO -0.17 0.47 0.10 -0.07 0.00 0.00 0.00 178.15 178.47 2qth h LEU 285 N 0.62 0.75 -0.70 1.44 3.38 -1.35 -0.74 115.31 118.71 2qth h LEU 285 Ca 0.07 -0.25 0.05 0.00 0.09 0.00 0.00 57.88 57.85 2qth h LEU 285 Cb 0.82 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 41.32 2qth h LEU 285 CO 0.07 0.80 0.41 -0.09 0.09 0.00 0.00 178.44 179.72 2qth h ARG 286 N 0.67 0.76 0.00 1.13 2.43 -1.27 -1.23 114.38 116.87 2qth h ARG 286 Ca 0.15 -0.05 -0.06 0.00 -0.81 0.00 0.00 59.98 59.21 2qth h ARG 286 Cb 0.36 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.73 2qth h ARG 286 CO 0.01 0.50 -0.28 0.93 -1.51 0.00 0.00 179.97 179.61 2qth h GLU 287 N 0.78 0.00 -0.00 0.20 4.39 -0.57 -2.52 114.58 116.86 2qth h GLU 287 Ca 0.30 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.00 2qth h GLU 287 Cb 0.12 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.77 2qth h GLU 287 CO -0.15 0.28 -0.15 0.44 -1.16 0.00 0.00 179.01 178.28 2qth n ILE 288 N -3.26 0.00 -0.13 3.13 -5.35 -0.38 -4.93 119.36 108.45 2qth n ILE 288 Ca 0.02 -0.04 0.00 0.00 -0.27 0.00 0.00 62.75 62.45 2qth n ILE 288 Cb 0.57 -0.11 0.00 0.00 -1.74 0.00 0.00 39.64 38.35 2qth n ILE 288 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2qth n GLY 289 N 1.35 1.18 3.68 3.28 0.00 -0.95 -4.89 105.19 108.84 2qth n GLY 289 Ca 0.12 -0.11 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 2qth n GLY 289 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qth s VAL 290 N -2.00 4.14 -0.12 1.61 1.01 -0.48 -4.99 120.40 119.58 2qth s VAL 290 Ca 0.00 1.47 -0.06 0.00 0.00 0.00 0.00 61.98 63.39 2qth s VAL 290 Cb 0.00 -3.95 0.05 0.00 0.00 0.00 0.00 36.38 32.48 2qth s VAL 290 CO 0.00 -0.02 0.28 -0.94 0.00 0.00 0.00 175.10 174.42 2qth s SER 291 N 1.63 -0.32 -1.90 3.32 1.04 -1.26 -4.41 113.70 111.80 2qth s SER 291 Ca 0.57 0.60 0.00 0.00 0.48 0.00 0.00 55.95 57.61 2qth s SER 291 Cb -0.26 0.49 0.00 0.00 0.10 0.00 0.00 66.02 66.35 2qth s SER 291 CO 0.22 -0.17 0.00 0.61 0.98 0.00 0.00 173.24 174.88 2qth n GLY 292 N 4.22 1.04 3.70 7.32 0.00 -1.26 -4.98 105.19 115.24 2qth n GLY 292 Ca -0.25 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.40 2qth n GLY 292 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qth s LYS 293 N -4.10 4.24 0.38 1.61 1.02 -1.26 -4.78 119.74 116.84 2qth s LYS 293 Ca 0.00 0.20 -0.28 0.00 0.02 0.00 0.00 55.97 55.91 2qth s LYS 293 Cb 0.00 -3.48 -0.11 0.00 -0.52 0.00 0.00 37.83 33.72 2qth s LYS 293 CO 0.00 0.10 1.41 -2.30 -0.92 0.00 0.00 175.35 173.65 2qth n PRO 294 N 3.98 2.44 -4.34 -1.68 -0.02 -1.26 -4.44 135.00 129.68 2qth n PRO 294 Ca -0.10 0.86 -0.32 0.00 -2.02 0.00 0.00 63.50 61.92 2qth n PRO 294 Cb 0.51 -2.55 -0.16 0.00 -0.02 0.00 0.00 33.50 31.28 2qth n PRO 294 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2qth s ILE 295 N -1.12 1.93 -0.26 4.25 1.01 -0.50 -1.75 121.20 124.76 2qth s ILE 295 Ca 0.55 -0.88 -0.12 0.00 0.00 0.00 0.00 60.65 60.20 2qth s ILE 295 Cb -0.50 -1.74 -0.05 0.00 0.01 0.00 0.00 42.46 40.19 2qth s ILE 295 CO 0.62 0.52 0.24 -0.22 0.00 0.00 0.00 174.94 176.10 2qth s LEU 296 N 1.12 4.06 -0.19 2.97 2.96 0.32 -0.59 118.68 129.32 2qth s LEU 296 Ca -0.01 0.13 -0.13 0.00 -0.22 0.00 0.00 54.13 53.90 2qth s LEU 296 Cb -0.14 -2.21 -0.05 0.00 0.50 0.00 0.00 46.19 44.29 2qth s LEU 296 CO -0.07 -0.05 0.27 -0.69 -1.32 0.00 0.00 176.35 174.49 2qth s VAL 297 N 1.59 5.30 -0.20 1.68 1.01 -0.38 -0.57 120.40 128.82 2qth s VAL 297 Ca 0.10 0.47 -0.01 0.00 0.00 0.00 0.00 61.98 62.53 2qth s VAL 297 Cb -0.15 -3.61 0.01 0.00 0.00 0.00 0.00 36.38 32.62 2qth s VAL 297 CO 0.09 0.35 -0.12 0.42 0.00 0.00 0.00 175.10 175.84 2qth s THR 298 N 0.81 2.73 -0.48 3.92 -4.23 0.54 -1.13 115.64 117.79 2qth s THR 298 Ca 0.14 -0.71 -0.23 0.00 -1.18 0.00 0.00 61.69 59.71 2qth s THR 298 Cb -0.13 -2.20 0.03 0.00 1.34 0.00 0.00 72.50 71.53 2qth s THR 298 CO 0.04 0.48 0.80 -0.22 -0.54 0.00 0.00 174.62 175.19 2qth s LEU 299 N 1.39 4.29 0.42 4.79 2.96 0.54 -1.91 118.68 131.15 2qth s LEU 299 Ca 0.05 -0.25 0.08 0.00 -0.22 0.00 0.00 54.13 53.79 2qth s LEU 299 Cb -0.14 -2.88 -0.01 0.00 0.50 0.00 0.00 46.19 43.66 2qth s LEU 299 CO -0.08 -0.98 0.42 0.21 -1.32 0.00 0.00 176.35 174.60 2qth s ASN 300 N 2.35 5.21 -1.11 3.68 2.47 0.29 -0.57 114.94 127.26 2qth s ASN 300 Ca 0.28 -0.66 0.00 0.00 0.42 0.00 0.00 52.86 52.91 2qth s ASN 300 Cb -0.13 -0.60 0.00 0.00 -1.45 0.00 0.00 41.25 39.07 2qth s ASN 300 CO 0.21 -0.67 0.00 0.29 -3.72 0.00 0.00 177.10 173.20 2qth n LYS 301 N -1.62 -0.88 0.29 0.43 5.02 -1.03 -0.79 118.16 119.58 2qth n LYS 301 Ca 0.05 0.73 0.17 0.00 -2.02 0.00 0.00 58.31 57.24 2qth n LYS 301 Cb 0.61 -4.81 0.96 0.00 -0.02 0.00 0.00 35.03 31.77 2qth n LYS 301 CO 0.00 0.00 0.00 -0.84 -0.52 0.00 0.00 177.40 176.04 2qth h ILE 302 N 0.00 0.38 -0.38 -0.18 3.07 -1.76 -0.18 117.51 118.47 2qth h ILE 302 Ca -0.26 0.00 -0.00 0.00 1.55 0.00 0.00 64.86 66.15 2qth h ILE 302 Cb 1.00 0.95 -0.02 0.00 -0.27 0.00 0.00 36.82 38.48 2qth h ILE 302 CO 0.34 0.00 0.23 -2.24 -1.05 0.00 0.00 178.15 175.43 2qth h ASP 303 N 0.00 0.44 -0.03 2.16 2.03 -1.90 -2.76 116.42 116.36 2qth h ASP 303 Ca 0.02 -0.02 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 2qth h ASP 303 Cb 0.14 -0.11 0.00 0.00 -0.83 0.00 0.00 39.33 38.52 2qth h ASP 303 CO -0.00 0.34 0.00 0.29 -1.03 0.00 0.00 179.24 178.84 2qth n LYS 304 N -4.46 1.55 0.00 4.15 5.02 -0.08 -4.35 118.16 119.99 2qth n LYS 304 Ca 0.03 -0.80 -0.11 0.00 -2.02 0.00 0.00 58.31 55.41 2qth n LYS 304 Cb 0.08 -1.47 -0.05 0.00 -0.02 0.00 0.00 35.03 33.57 2qth n LYS 304 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 2qth h ILE 305 N 1.88 1.03 -6.25 -0.18 2.04 -1.54 -3.47 117.51 111.03 2qth h ILE 305 Ca 0.00 -0.07 -0.38 0.00 1.00 0.00 0.00 64.86 65.41 2qth h ILE 305 Cb 0.40 0.92 0.01 0.00 -0.74 0.00 0.00 36.82 37.41 2qth h ILE 305 CO 0.00 0.03 -1.09 0.59 0.00 0.00 0.00 178.15 177.68 2qth n ASN 306 N -5.02 -4.78 0.00 1.72 4.13 -1.26 -4.88 115.26 105.16 2qth n ASN 306 Ca -0.05 -0.33 0.00 0.00 1.68 0.00 0.00 54.58 55.87 2qth n ASN 306 Cb 0.03 -1.44 0.00 0.00 -1.54 0.00 0.00 39.78 36.84 2qth n ASN 306 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2qth n GLY 307 N -0.50 -0.50 3.42 7.41 0.00 -1.26 -5.10 105.19 108.66 2qth n GLY 307 Ca -0.13 -1.08 -0.44 0.00 0.00 0.00 0.00 46.02 44.36 2qth n GLY 307 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2qth s ASP 308 N -4.00 6.39 0.03 1.61 3.68 -1.26 -4.91 116.67 118.21 2qth s ASP 308 Ca 0.00 -1.64 -0.23 0.00 2.13 0.00 0.00 52.55 52.80 2qth s ASP 308 Cb 0.00 -2.36 -0.16 0.00 -1.45 0.00 0.00 42.92 38.95 2qth s ASP 308 CO 0.00 -1.14 1.45 0.25 0.13 0.00 0.00 175.17 175.86 2qth h LEU 309 N 10.33 0.11 -0.87 -1.34 5.85 -1.99 -2.87 115.31 124.53 2qth h LEU 309 Ca -0.09 -0.32 0.06 0.00 0.84 0.00 0.00 57.88 58.37 2qth h LEU 309 Cb 1.06 -0.03 -0.06 0.00 0.37 0.00 0.00 40.66 41.99 2qth h LEU 309 CO 1.10 0.40 0.55 0.22 -0.34 0.00 0.00 178.44 180.37 2qth h TYR 310 N -0.18 1.01 -0.61 1.25 3.20 -1.99 0.22 116.97 119.87 2qth h TYR 310 Ca 0.02 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 61.87 2qth h TYR 310 Cb 0.35 -0.33 -0.03 0.00 1.54 0.00 0.00 36.73 38.26 2qth h TYR 310 CO 0.04 0.53 0.22 0.87 -1.64 0.00 0.00 178.16 178.17 2qth h LYS 311 N 1.01 0.94 -0.13 1.82 1.57 -1.99 -0.14 116.57 119.64 2qth h LYS 311 Ca 0.37 -0.19 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 2qth h LYS 311 Cb 0.14 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 2qth h LYS 311 CO -0.16 0.81 0.08 0.87 -0.57 0.00 0.00 179.45 180.48 2qth h LYS 312 N 0.87 0.17 -0.86 3.15 1.57 -1.13 -1.72 116.57 118.62 2qth h LYS 312 Ca 0.20 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 2qth h LYS 312 Cb 0.25 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.48 2qth h LYS 312 CO -0.01 0.11 0.54 1.25 -0.57 0.00 0.00 179.45 180.77 2qth h LEU 313 N 0.17 1.01 -0.05 2.94 5.85 -0.41 -1.32 115.31 123.51 2qth h LEU 313 Ca 0.05 -0.05 -0.25 0.00 0.84 0.00 0.00 57.88 58.47 2qth h LEU 313 Cb -0.01 -0.25 0.01 0.00 0.37 0.00 0.00 40.66 40.77 2qth h LEU 313 CO -0.02 0.76 -1.05 -0.78 -0.34 0.00 0.00 178.44 177.02 2qth h ASP 314 N 1.17 0.69 -0.42 1.25 1.82 -0.91 -1.19 116.42 118.84 2qth h ASP 314 Ca 0.31 -0.58 0.08 0.00 -0.39 0.00 0.00 57.03 56.45 2qth h ASP 314 Cb -0.09 -0.21 -0.07 0.00 0.68 0.00 0.00 39.33 39.64 2qth h ASP 314 CO -0.06 1.39 0.00 0.25 -1.61 0.00 0.00 179.24 179.21 2qth h LEU 315 N 0.28 -0.17 -0.69 2.28 7.12 -1.21 -0.41 115.31 122.51 2qth h LEU 315 Ca -0.12 0.10 -0.06 0.00 0.13 0.00 0.00 57.88 57.93 2qth h LEU 315 Cb 1.70 0.17 -0.03 0.00 -0.53 0.00 0.00 40.66 41.97 2qth h LEU 315 CO 0.19 -0.05 0.20 0.58 -0.13 0.00 0.00 178.44 179.23 2qth h VAL 316 N 0.11 1.26 0.08 1.05 2.07 -1.07 -1.41 116.25 118.34 2qth h VAL 316 Ca 0.21 -0.91 -0.00 0.00 0.82 0.00 0.00 66.70 66.82 2qth h VAL 316 Cb 0.30 0.54 0.00 0.00 -1.52 0.00 0.00 31.29 30.60 2qth h VAL 316 CO -0.34 0.35 -0.04 -0.08 0.02 0.00 0.00 177.57 177.48 2qth h GLU 317 N 1.02 -0.11 -0.46 1.57 4.81 -1.07 0.19 114.58 120.54 2qth h GLU 317 Ca 0.22 0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.47 2qth h GLU 317 Cb 0.32 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.70 2qth h GLU 317 CO -0.00 0.18 0.29 0.87 -0.73 0.00 0.00 179.01 179.61 2qth h LYS 318 N -0.39 0.57 -0.17 1.92 1.57 -0.97 -2.28 116.57 116.82 2qth h LYS 318 Ca -0.01 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.70 2qth h LYS 318 Cb 0.34 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 2qth h LYS 318 CO 0.02 0.38 -0.03 1.25 -0.57 0.00 0.00 179.45 180.49 2qth h LEU 319 N 0.58 0.32 -0.97 2.94 5.85 -1.26 -0.64 115.31 122.14 2qth h LEU 319 Ca 0.17 -0.36 0.05 0.00 0.84 0.00 0.00 57.88 58.59 2qth h LEU 319 Cb -0.03 -0.09 -0.06 0.00 0.37 0.00 0.00 40.66 40.85 2qth h LEU 319 CO -0.06 0.60 0.63 0.28 -0.34 0.00 0.00 178.44 179.55 2qth h SER 320 N 0.03 1.02 0.69 1.25 0.02 -0.87 0.02 113.55 115.72 2qth h SER 320 Ca 0.04 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.89 2qth h SER 320 Cb 0.46 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.76 2qth h SER 320 CO 0.01 0.68 -0.51 0.11 -1.14 0.00 0.00 176.83 175.98 2qth h LYS 321 N 1.18 0.00 -0.44 3.45 1.57 -1.28 -0.78 116.57 120.27 2qth h LYS 321 Ca 0.41 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 59.11 2qth h LYS 321 Cb 0.09 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.39 2qth h LYS 321 CO -0.15 0.51 -0.04 0.93 -0.57 0.00 0.00 179.45 180.13 2qth h GLU 322 N 0.00 0.73 0.00 3.15 5.08 0.00 -3.33 114.58 120.22 2qth h GLU 322 Ca -0.01 -0.20 -0.08 0.00 -1.00 0.00 0.00 59.36 58.07 2qth h GLU 322 Cb 0.99 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.14 2qth h GLU 322 CO 0.07 0.77 -1.00 -0.07 -1.00 0.00 0.00 179.01 177.77 2qth h LEU 323 N 0.68 0.00 -7.31 1.33 3.38 -0.56 -3.48 115.31 109.35 2qth h LEU 323 Ca 0.13 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.00 2qth h LEU 323 Cb 0.47 0.00 -0.21 0.00 0.09 0.00 0.00 40.66 41.02 2qth h LEU 323 CO 0.02 0.30 -0.13 -0.47 0.09 0.00 0.00 178.44 178.25 2qth s TYR 324 N -3.12 -0.40 -0.00 1.13 5.04 -0.34 -5.00 117.35 114.65 2qth s TYR 324 Ca -0.00 0.78 0.01 0.00 -2.44 0.00 0.00 57.07 55.42 2qth s TYR 324 Cb 0.08 0.19 -0.00 0.00 0.35 0.00 0.00 41.96 42.59 2qth s TYR 324 CO 0.78 -0.40 -0.05 0.45 -1.34 0.00 0.00 175.55 175.00 2qth s SER 325 N -0.80 0.56 -0.17 4.32 0.15 -1.26 -4.25 113.70 112.25 2qth s SER 325 Ca -0.09 -0.09 -0.16 0.00 0.70 0.00 0.00 55.95 56.32 2qth s SER 325 Cb -0.03 -0.07 -0.04 0.00 -1.71 0.00 0.00 66.02 64.17 2qth s SER 325 CO 0.04 0.06 0.38 -2.16 1.20 0.00 0.00 173.24 172.76 2qth s PRO 326 N -0.09 4.24 -0.37 5.44 0.04 -1.26 -4.03 135.00 138.96 2qth s PRO 326 Ca 0.02 0.22 -0.27 0.00 0.04 0.00 0.00 61.00 61.01 2qth s PRO 326 Cb -0.02 -3.48 0.02 0.00 0.04 0.00 0.00 34.50 31.06 2qth s PRO 326 CO -0.00 0.09 1.00 0.42 0.04 0.00 0.00 177.00 178.55 2qth s ILE 327 N 0.89 4.51 0.03 0.56 -1.09 -1.26 -1.40 121.20 123.43 2qth s ILE 327 Ca 0.20 1.35 -0.25 0.00 -2.23 0.00 0.00 60.65 59.71 2qth s ILE 327 Cb -0.14 -4.40 -0.17 0.00 -1.58 0.00 0.00 42.46 36.16 2qth s ILE 327 CO 0.07 -0.59 1.41 0.15 -1.23 0.00 0.00 174.94 174.75 2qth h PHE 328 N 8.48 -0.18 -2.04 3.97 3.57 -1.19 -3.46 116.94 126.09 2qth h PHE 328 Ca -0.22 -0.00 0.24 0.00 3.53 0.00 0.00 57.97 61.51 2qth h PHE 328 Cb 1.07 0.06 -0.09 0.00 2.79 0.00 0.00 35.95 39.79 2qth h PHE 328 CO 0.85 0.11 0.66 0.34 -2.23 0.00 0.00 178.31 178.04 2qth s ASP 329 N -5.26 -0.09 -0.12 0.41 -1.08 -1.24 -5.02 116.67 104.27 2qth s ASP 329 Ca -0.15 -0.34 -0.01 0.00 -0.52 0.00 0.00 52.55 51.53 2qth s ASP 329 Cb 0.03 0.35 0.03 0.00 -1.46 0.00 0.00 42.92 41.87 2qth s ASP 329 CO 0.62 -0.66 -0.04 -0.69 0.52 0.00 0.00 175.17 174.93 2qth s VAL 330 N -2.68 0.82 0.06 1.11 1.01 -1.26 -1.25 120.40 118.21 2qth s VAL 330 Ca 0.16 -0.26 0.04 0.00 0.00 0.00 0.00 61.98 61.92 2qth s VAL 330 Cb 0.01 -0.95 -0.03 0.00 0.00 0.00 0.00 36.38 35.41 2qth s VAL 330 CO 0.00 0.24 -0.13 0.27 0.00 0.00 0.00 175.10 175.49 2qth s ILE 331 N 1.78 0.98 0.01 2.22 -4.36 -0.29 -4.99 121.20 116.55 2qth s ILE 331 Ca 0.04 -1.23 -0.16 0.00 -0.26 0.00 0.00 60.65 59.04 2qth s ILE 331 Cb -0.13 -0.96 -0.06 0.00 1.25 0.00 0.00 42.46 42.56 2qth s ILE 331 CO -0.07 -0.24 0.44 -2.16 0.24 0.00 0.00 174.94 173.14 2qth s PRO 332 N -1.65 3.98 0.16 0.37 0.04 -1.26 -0.34 135.00 136.30 2qth s PRO 332 Ca -0.04 0.47 -0.08 0.00 0.04 0.00 0.00 61.00 61.40 2qth s PRO 332 Cb -0.10 -3.23 -0.01 0.00 0.04 0.00 0.00 34.50 31.20 2qth s PRO 332 CO 0.02 0.67 0.25 0.96 0.04 0.00 0.00 177.00 178.94 2qth s ILE 333 N -1.04 0.06 -0.28 0.56 -4.36 0.26 -4.75 121.20 111.66 2qth s ILE 333 Ca 0.25 -1.49 0.01 0.00 -0.26 0.00 0.00 60.65 59.16 2qth s ILE 333 Cb -0.17 -1.92 0.08 0.00 1.25 0.00 0.00 42.46 41.70 2qth s ILE 333 CO 0.14 -0.29 0.01 -0.55 0.24 0.00 0.00 174.94 174.49 2qth s SER 334 N -2.99 4.14 0.43 4.36 0.15 -0.52 -2.47 113.70 116.79 2qth s SER 334 Ca 0.19 -1.54 0.19 0.00 0.70 0.00 0.00 55.95 55.49 2qth s SER 334 Cb 0.04 -1.23 0.97 0.00 -1.71 0.00 0.00 66.02 64.09 2qth s SER 334 CO 0.01 -0.31 1.91 0.00 1.20 0.00 0.00 173.24 176.05 2qth h ALA 335 N 7.89 1.32 -0.02 5.45 0.00 -1.94 0.65 119.26 132.62 2qth h ALA 335 Ca -0.13 -0.25 -0.10 0.00 0.00 0.00 0.00 54.91 54.43 2qth h ALA 335 Cb 1.04 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.80 2qth h ALA 335 CO 0.45 0.34 -0.39 1.25 0.00 0.00 0.00 179.25 180.90 2qth h LEU 336 N 0.00 0.38 -1.00 0.00 5.85 -1.94 -3.32 115.31 115.27 2qth h LEU 336 Ca -0.00 -0.74 0.00 0.00 0.84 0.00 0.00 57.88 57.98 2qth h LEU 336 Cb 0.56 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.48 2qth h LEU 336 CO 0.04 1.06 -0.25 0.29 -0.34 0.00 0.00 178.44 179.24 2qth n LYS 337 N -4.38 1.37 -3.14 1.25 4.76 -1.19 -4.95 118.16 111.87 2qth n LYS 337 Ca -0.10 -1.00 -0.14 0.00 -2.87 0.00 0.00 58.31 54.20 2qth n LYS 337 Cb 0.56 -1.48 0.06 0.00 -1.84 0.00 0.00 35.03 32.33 2qth n LYS 337 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2qth n ARG 338 N 0.06 -5.05 -3.53 1.97 1.74 0.14 -5.00 116.66 107.00 2qth n ARG 338 Ca 0.13 0.56 -0.37 0.00 -0.77 0.00 0.00 57.85 57.40 2qth n ARG 338 Cb 0.44 -4.77 -0.07 0.00 -1.02 0.00 0.00 32.46 27.03 2qth n ARG 338 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2qth s THR 339 N -3.22 5.30 -1.15 0.55 2.01 -0.72 -4.31 115.64 114.09 2qth s THR 339 Ca 0.26 0.54 0.00 0.00 0.31 0.00 0.00 61.69 62.80 2qth s THR 339 Cb -0.11 -3.63 0.00 0.00 0.01 0.00 0.00 72.50 68.76 2qth s THR 339 CO 0.49 0.37 0.00 0.59 -0.69 0.00 0.00 174.62 175.38 2qth n ASN 340 N 3.73 -4.16 0.26 3.53 5.03 -1.26 -1.44 115.26 120.95 2qth n ASN 340 Ca -0.12 0.17 0.12 0.00 0.87 0.00 0.00 54.58 55.62 2qth n ASN 340 Cb 0.52 -2.99 0.73 0.00 -1.02 0.00 0.00 39.78 37.02 2qth n ASN 340 CO 0.00 0.00 0.00 -0.07 -1.83 0.00 0.00 177.26 175.36 2qth h LEU 341 N 0.00 0.00 0.20 3.41 3.38 -1.90 -1.89 115.31 118.51 2qth h LEU 341 Ca -0.26 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.45 2qth h LEU 341 Cb 0.96 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.73 2qth h LEU 341 CO 0.35 0.10 -1.18 -0.08 0.09 0.00 0.00 178.44 177.72 2qth h GLU 342 N 0.00 0.42 -0.25 1.13 4.57 -1.93 0.27 114.58 118.78 2qth h GLU 342 Ca -0.00 -0.71 0.06 0.00 -1.18 0.00 0.00 59.36 57.53 2qth h GLU 342 Cb 0.25 0.26 -0.07 0.00 -0.16 0.00 0.00 28.75 29.04 2qth h GLU 342 CO 0.01 1.34 -0.22 1.25 -1.18 0.00 0.00 179.01 180.21 2qth h LEU 343 N -0.12 -0.72 -0.06 1.64 5.85 -1.91 0.41 115.31 120.41 2qth h LEU 343 Ca -0.21 0.14 0.04 0.00 0.84 0.00 0.00 57.88 58.69 2qth h LEU 343 Cb 1.91 0.35 -0.06 0.00 0.37 0.00 0.00 40.66 43.23 2qth h LEU 343 CO 0.21 -0.26 -0.36 0.25 -0.34 0.00 0.00 178.44 177.94 2qth h LEU 344 N -0.22 -1.09 -0.49 2.25 5.85 -1.25 0.09 115.31 120.44 2qth h LEU 344 Ca 0.14 0.14 0.08 0.00 0.84 0.00 0.00 57.88 59.09 2qth h LEU 344 Cb 0.44 0.44 -0.10 0.00 0.37 0.00 0.00 40.66 41.81 2qth h LEU 344 CO -0.38 -0.40 -0.39 -0.09 -0.34 0.00 0.00 178.44 176.84 2qth h ARG 345 N -0.47 -0.24 -0.64 1.25 2.43 -0.56 0.19 114.38 116.34 2qth h ARG 345 Ca 0.07 0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.21 2qth h ARG 345 Cb 0.59 0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.16 2qth h ARG 345 CO -0.32 -0.16 0.19 -0.44 -1.51 0.00 0.00 179.97 177.72 2qth h ASP 346 N -0.25 0.91 0.00 -3.80 3.32 0.13 -0.69 116.42 116.04 2qth h ASP 346 Ca 0.18 -0.16 -0.13 0.00 0.02 0.00 0.00 57.03 56.93 2qth h ASP 346 Cb 0.56 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.86 2qth h ASP 346 CO -0.62 0.86 -0.42 0.11 -1.72 0.00 0.00 179.24 177.46 2qth h LYS 347 N 0.94 0.52 -0.48 3.56 1.79 -0.46 0.85 116.57 123.28 2qth h LYS 347 Ca 0.21 -0.27 -0.04 0.00 -2.18 0.00 0.00 60.65 58.37 2qth h LYS 347 Cb 0.29 0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 30.92 2qth h LYS 347 CO -0.01 0.84 0.13 0.82 -1.08 0.00 0.00 179.45 180.16 2qth h ILE 348 N 0.43 1.23 -0.40 1.86 1.08 -0.64 0.18 117.51 121.25 2qth h ILE 348 Ca 0.04 -0.80 -0.01 0.00 -0.39 0.00 0.00 64.86 63.69 2qth h ILE 348 Cb 0.91 0.84 -0.02 0.00 -3.07 0.00 0.00 36.82 35.48 2qth h ILE 348 CO 0.08 0.29 0.21 0.22 -0.69 0.00 0.00 178.15 178.26 2qth h TYR 349 N 0.66 0.55 -0.74 1.37 3.20 -0.90 0.30 116.97 121.40 2qth h TYR 349 Ca 0.15 -0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.97 2qth h TYR 349 Cb 0.30 -0.17 -0.03 0.00 1.54 0.00 0.00 36.73 38.37 2qth h TYR 349 CO 0.02 0.44 0.30 1.96 -1.64 0.00 0.00 178.16 179.23 2qth h GLN 350 N 0.51 1.10 -0.60 1.82 4.20 -0.55 -0.74 115.11 120.84 2qth h GLN 350 Ca 0.14 -0.19 -0.09 0.00 0.06 0.00 0.00 58.65 58.57 2qth h GLN 350 Cb 0.07 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 27.65 2qth h GLN 350 CO -0.02 0.89 0.02 1.25 -0.67 0.00 0.00 178.83 180.30 2qth h LEU 351 N 1.07 1.03 -1.14 1.46 5.85 -0.62 0.12 115.31 123.08 2qth h LEU 351 Ca 0.25 -0.30 -0.06 0.00 0.84 0.00 0.00 57.88 58.61 2qth h LEU 351 Cb 0.20 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 40.93 2qth h LEU 351 CO -0.02 1.07 -0.05 0.00 -0.34 0.00 0.00 178.44 179.10 2qth h ALA 352 N 0.99 1.29 -0.15 1.25 0.00 -0.53 -0.23 119.26 121.88 2qth h ALA 352 Ca 0.17 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 2qth h ALA 352 Cb 0.53 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 2qth h ALA 352 CO 0.03 0.47 -0.15 1.15 0.00 0.00 0.00 179.25 180.75 2qth h THR 353 N 0.50 1.34 -0.72 0.00 2.02 -0.84 -2.22 112.91 113.00 2qth h THR 353 Ca 0.10 -1.31 0.08 0.00 0.77 0.00 0.00 66.41 66.05 2qth h THR 353 Cb 0.41 1.86 -0.07 0.00 -1.74 0.00 0.00 68.15 68.61 2qth h THR 353 CO 0.02 0.39 0.38 -0.61 0.37 0.00 0.00 175.52 176.07 2qth h GLN 354 N 0.01 0.64 -0.24 6.66 4.15 -0.27 -3.10 115.11 122.97 2qth h GLN 354 Ca 0.02 -0.04 -0.01 0.00 0.77 0.00 0.00 58.65 59.39 2qth h GLN 354 Cb 0.69 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 28.22 2qth h GLN 354 CO 0.04 0.42 0.10 -0.07 -1.93 0.00 0.00 178.83 177.40 2qth h LEU 355 N 0.66 0.32 0.00 -2.39 3.38 -0.96 -3.51 115.31 112.81 2qth h LEU 355 Ca 0.34 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.16 2qth h LEU 355 Cb 0.31 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.98 2qth h LEU 355 CO -0.24 0.38 0.00 -1.54 0.09 0.00 0.00 178.44 177.13