#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hxj n MET 7 N 0.00 -3.76 -4.71 3.69 0.00 -1.26 -5.03 117.12 106.04 1hxj n MET 7 Ca 0.00 2.94 -0.33 0.00 0.00 0.00 0.00 57.70 60.31 1hxj n MET 7 Cb 0.00 -4.71 -0.07 0.00 0.00 0.00 0.00 33.22 28.45 1hxj n MET 7 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 1hxj s LEU 8 N -1.01 2.26 0.00 -0.89 2.01 -1.26 -5.05 118.68 114.74 1hxj s LEU 8 Ca -0.15 -1.65 0.00 0.00 0.01 0.00 0.00 54.13 52.34 1hxj s LEU 8 Cb 0.01 -0.75 0.00 0.00 0.01 0.00 0.00 46.19 45.46 1hxj s LEU 8 CO 0.70 -0.91 0.00 -0.24 1.01 0.00 0.00 176.35 176.91 1hxj n SER 9 N -1.33 0.00 0.32 2.29 2.88 -1.26 -4.67 113.62 111.85 1hxj n SER 9 Ca -0.19 0.00 0.21 0.00 -1.33 0.00 0.00 58.87 57.56 1hxj n SER 9 Cb 0.67 0.00 1.08 0.00 -0.75 0.00 0.00 64.21 65.21 1hxj n SER 9 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1hxj h PRO 10 N 0.36 0.00 0.00 -1.46 0.13 -1.98 0.63 132.00 129.68 1hxj h PRO 10 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1hxj h PRO 10 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1hxj h PRO 10 CO 0.00 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 176.64 1hxj n SER 11 N -3.12 0.00 0.01 1.44 3.41 -1.26 -2.85 113.62 111.24 1hxj n SER 11 Ca -0.02 0.39 0.11 0.00 -0.26 0.00 0.00 58.87 59.09 1hxj n SER 11 Cb 0.13 -0.46 -0.10 0.00 -0.26 0.00 0.00 64.21 63.52 1hxj n SER 11 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1hxj n GLU 12 N -1.46 0.38 -1.75 4.33 1.02 0.21 -4.93 120.64 118.44 1hxj n GLU 12 Ca 0.07 -0.08 -0.42 0.00 -0.02 0.00 0.00 57.16 56.71 1hxj n GLU 12 Cb 0.29 -1.55 -0.03 0.00 -0.02 0.00 0.00 31.44 30.13 1hxj n GLU 12 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1hxj s ILE 13 N -3.28 2.92 0.38 -3.67 1.01 -1.13 -4.92 121.20 112.50 1hxj s ILE 13 Ca -0.00 0.15 -0.27 0.00 0.00 0.00 0.00 60.65 60.53 1hxj s ILE 13 Cb 0.14 -3.10 -0.11 0.00 0.01 0.00 0.00 42.46 39.41 1hxj s ILE 13 CO 0.87 -0.01 1.28 -2.65 0.00 0.00 0.00 174.94 174.43 1hxj n PRO 14 N 6.69 2.06 -4.43 2.79 -0.02 -1.26 -5.03 135.00 135.80 1hxj n PRO 14 Ca 0.18 0.73 -0.29 0.00 -2.02 0.00 0.00 63.50 62.10 1hxj n PRO 14 Cb 0.40 -2.36 -0.12 0.00 -0.02 0.00 0.00 33.50 31.40 1hxj n PRO 14 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1hxj s GLN 15 N -2.03 1.64 0.40 -0.52 -1.52 -1.26 -5.03 119.66 111.35 1hxj s GLN 15 Ca 0.58 -1.23 0.08 0.00 -1.95 0.00 0.00 55.36 52.84 1hxj s GLN 15 Cb -0.54 -2.02 0.83 0.00 -0.22 0.00 0.00 33.01 31.07 1hxj s GLN 15 CO 0.61 0.48 1.98 -0.09 -0.25 0.00 0.00 175.29 178.01 1hxj h ARG 16 N 3.96 0.37 0.00 2.91 9.65 -1.96 -0.99 114.38 128.32 1hxj h ARG 16 Ca -0.50 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 58.33 1hxj h ARG 16 Cb 1.17 -0.07 0.00 0.00 -1.39 0.00 0.00 29.97 29.68 1hxj h ARG 16 CO 0.43 0.36 0.00 -0.40 2.80 0.00 0.00 179.97 183.16 1hxj n ASP 17 N -4.38 0.00 0.24 -3.80 3.85 -1.26 -1.67 116.55 109.53 1hxj n ASP 17 Ca 0.01 -0.91 0.13 0.00 -0.71 0.00 0.00 54.79 53.31 1hxj n ASP 17 Cb 0.17 0.00 0.34 0.00 -1.35 0.00 0.00 41.12 40.28 1hxj n ASP 17 CO 0.00 0.00 0.00 -0.50 -1.01 0.00 0.00 177.20 175.69 1hxj h TRP 18 N 0.00 0.00 -2.70 2.11 4.06 -1.59 -3.45 115.95 114.38 1hxj h TRP 18 Ca 0.00 0.00 -0.61 0.00 2.06 0.00 0.00 58.89 60.34 1hxj h TRP 18 Cb 0.00 0.00 -0.14 0.00 -1.00 0.00 0.00 29.16 28.02 1hxj h TRP 18 CO 0.00 0.03 -0.72 -0.06 -3.56 0.00 0.00 178.44 174.13 1hxj s PHE 19 N -3.37 2.55 0.73 0.49 0.40 -0.67 -5.00 117.98 113.12 1hxj s PHE 19 Ca 0.05 -0.26 -0.15 0.00 -0.60 0.00 0.00 56.93 55.97 1hxj s PHE 19 Cb 0.07 -1.20 0.04 0.00 0.51 0.00 0.00 43.02 42.44 1hxj s PHE 19 CO 0.63 0.57 1.23 -1.25 0.70 0.00 0.00 175.22 177.10 1hxj s PRO 20 N -3.13 2.09 0.42 0.24 0.04 -1.26 -4.89 135.00 128.51 1hxj s PRO 20 Ca 0.27 1.84 0.16 0.00 0.04 0.00 0.00 61.00 63.30 1hxj s PRO 20 Cb -0.07 -1.82 1.04 0.00 0.04 0.00 0.00 34.50 33.69 1hxj s PRO 20 CO 0.16 -1.89 1.89 0.66 0.04 0.00 0.00 177.00 177.86 1hxj h SER 21 N -0.26 0.42 0.60 6.66 4.64 -1.97 -1.12 113.55 122.52 1hxj h SER 21 Ca -0.48 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1hxj h SER 21 Cb 1.31 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1hxj h SER 21 CO 0.49 0.20 -0.04 -0.67 -0.87 0.00 0.00 176.83 175.95 1hxj n ASP 22 N -4.49 0.11 -4.63 4.97 2.03 -1.26 -4.90 116.55 108.37 1hxj n ASP 22 Ca 0.16 -0.12 -0.33 0.00 0.52 0.00 0.00 54.79 55.02 1hxj n ASP 22 Cb 0.58 -0.26 0.13 0.00 -0.72 0.00 0.00 41.12 40.84 1hxj n ASP 22 CO 0.00 0.00 0.00 0.33 -1.92 0.00 0.00 177.20 175.61 1hxj n PHE 23 N -1.27 0.66 -4.99 -0.67 7.35 -0.42 -5.00 117.46 113.11 1hxj n PHE 23 Ca 0.13 0.38 -0.32 0.00 -0.76 0.00 0.00 57.45 56.88 1hxj n PHE 23 Cb 0.27 -2.03 -0.17 0.00 0.35 0.00 0.00 39.48 37.90 1hxj n PHE 23 CO 0.00 0.00 0.00 0.99 -0.76 0.00 0.00 176.76 176.99 1hxj s THR 24 N -2.20 1.99 -0.10 -2.13 2.01 -0.72 -5.03 115.64 109.48 1hxj s THR 24 Ca 0.70 -0.97 0.03 0.00 0.31 0.00 0.00 61.69 61.76 1hxj s THR 24 Cb -0.28 -1.74 0.01 0.00 0.01 0.00 0.00 72.50 70.50 1hxj s THR 24 CO 0.55 0.54 -0.18 -0.36 -0.69 0.00 0.00 174.62 174.48 1hxj s PHE 25 N 0.53 2.10 0.00 4.92 0.08 -1.26 -0.76 117.98 123.59 1hxj s PHE 25 Ca -0.15 -0.89 0.00 0.00 0.12 0.00 0.00 56.93 56.01 1hxj s PHE 25 Cb -0.17 -1.46 0.00 0.00 -0.57 0.00 0.00 43.02 40.82 1hxj s PHE 25 CO 0.05 -0.41 0.00 0.41 -0.10 0.00 0.00 175.22 175.17 1hxj n GLY 26 N 3.82 2.72 3.37 4.36 0.00 -0.22 -0.15 105.19 119.09 1hxj n GLY 26 Ca -0.20 -1.20 -0.19 0.00 0.00 0.00 0.00 46.02 44.43 1hxj n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hxj s ALA 27 N -1.32 2.01 0.06 4.61 0.00 -1.22 -1.38 121.76 124.52 1hxj s ALA 27 Ca 0.00 -1.82 0.01 0.00 0.00 0.00 0.00 51.96 50.15 1hxj s ALA 27 Cb 0.00 0.38 -0.03 0.00 0.00 0.00 0.00 23.12 23.47 1hxj s ALA 27 CO 0.00 -0.19 -0.05 0.00 0.00 0.00 0.00 175.76 175.52 1hxj s ALA 28 N -3.27 0.61 0.33 0.00 0.00 -0.42 -1.45 121.76 117.54 1hxj s ALA 28 Ca 0.29 -1.03 -0.09 0.00 0.00 0.00 0.00 51.96 51.13 1hxj s ALA 28 Cb 0.05 0.15 0.01 0.00 0.00 0.00 0.00 23.12 23.34 1hxj s ALA 28 CO 0.10 -0.20 0.57 0.95 0.00 0.00 0.00 175.76 177.18 1hxj s THR 29 N -2.71 0.00 0.05 0.00 -4.23 0.11 -0.51 115.64 108.35 1hxj s THR 29 Ca -0.00 -1.37 0.02 0.00 -1.18 0.00 0.00 61.69 59.16 1hxj s THR 29 Cb -0.01 -2.55 -0.03 0.00 1.34 0.00 0.00 72.50 71.25 1hxj s THR 29 CO -0.04 0.00 -0.07 -0.94 -0.54 0.00 0.00 174.62 173.03 1hxj s SER 30 N -3.12 0.89 0.08 3.99 1.04 -1.26 -3.82 113.70 111.50 1hxj s SER 30 Ca 0.24 -0.67 -0.29 0.00 0.48 0.00 0.00 55.95 55.71 1hxj s SER 30 Cb -0.02 0.06 -0.13 0.00 0.10 0.00 0.00 66.02 66.03 1hxj s SER 30 CO 0.14 -0.28 1.46 0.00 0.98 0.00 0.00 173.24 175.54 1hxj h ALA 31 N 4.11 -0.96 -0.43 5.32 0.00 -1.91 -2.66 119.26 122.73 1hxj h ALA 31 Ca -0.36 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.46 1hxj h ALA 31 Cb 1.19 0.79 -0.02 0.00 0.00 0.00 0.00 17.79 19.75 1hxj h ALA 31 CO 0.47 -1.05 0.29 -0.92 0.00 0.00 0.00 179.25 178.04 1hxj h TYR 32 N -0.67 0.51 -0.17 0.00 3.20 -1.93 -0.59 116.97 117.32 1hxj h TYR 32 Ca -0.02 0.01 -0.11 0.00 3.14 0.00 0.00 58.73 61.76 1hxj h TYR 32 Cb 0.65 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.73 1hxj h TYR 32 CO -0.38 0.32 -0.37 1.96 -1.64 0.00 0.00 178.16 178.04 1hxj h GLN 33 N 0.55 0.37 0.00 1.82 4.20 -1.78 -3.39 115.11 116.87 1hxj h GLN 33 Ca 0.16 -0.17 -0.02 0.00 0.06 0.00 0.00 58.65 58.68 1hxj h GLN 33 Cb -0.01 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 27.75 1hxj h GLN 33 CO -0.04 0.69 -1.12 0.44 -0.67 0.00 0.00 178.83 178.13 1hxj n ILE 34 N -4.05 0.08 0.28 2.54 -5.35 -1.02 -2.40 119.36 109.45 1hxj n ILE 34 Ca -0.01 -0.07 -0.16 0.00 -0.27 0.00 0.00 62.75 62.23 1hxj n ILE 34 Cb 0.47 -0.37 -0.08 0.00 -1.74 0.00 0.00 39.64 37.91 1hxj n ILE 34 CO 0.00 0.00 0.00 -0.33 -1.76 0.00 0.00 176.55 174.46 1hxj h GLU 35 N 0.00 -0.71 0.00 6.28 5.08 -1.31 0.44 114.58 124.36 1hxj h GLU 35 Ca -0.03 0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1hxj h GLU 35 Cb 0.70 0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.12 1hxj h GLU 35 CO 0.00 -0.48 0.00 0.41 -1.00 0.00 0.00 179.01 177.95 1hxj n GLY 36 N -1.43 -0.57 4.33 -3.84 0.00 -1.16 -1.90 105.19 100.62 1hxj n GLY 36 Ca -0.11 -1.13 -0.36 0.00 0.00 0.00 0.00 46.02 44.42 1hxj n GLY 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hxj n ALA 37 N 4.12 -1.56 0.19 4.61 0.00 -0.88 -4.77 120.51 122.21 1hxj n ALA 37 Ca 0.00 -0.24 0.18 0.00 0.00 0.00 0.00 53.44 53.38 1hxj n ALA 37 Cb 0.00 -2.09 0.82 0.00 0.00 0.00 0.00 19.45 18.18 1hxj n ALA 37 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 177.50 177.61 1hxj h TRP 38 N -1.41 0.00 -0.07 0.00 5.08 -1.85 -2.73 115.95 114.97 1hxj h TRP 38 Ca -0.62 0.00 -0.17 0.00 1.08 0.00 0.00 58.89 59.18 1hxj h TRP 38 Cb 1.39 0.00 -0.34 0.00 -3.00 0.00 0.00 29.16 27.21 1hxj h TRP 38 CO 0.61 0.00 -0.98 0.27 -1.28 0.00 0.00 178.44 177.06 1hxj n ASN 39 N -3.73 1.25 -4.90 0.11 6.94 -1.26 -4.71 115.26 108.96 1hxj n ASN 39 Ca 0.03 -2.28 -0.31 0.00 -0.02 0.00 0.00 54.58 51.99 1hxj n ASN 39 Cb 0.39 -0.35 -0.05 0.00 -2.36 0.00 0.00 39.78 37.41 1hxj n ASN 39 CO 0.00 0.00 0.00 -0.70 -1.03 0.00 0.00 177.26 175.53 1hxj s GLU 40 N -0.97 3.63 -1.61 -3.83 2.12 -1.03 -4.45 118.70 112.56 1hxj s GLU 40 Ca 0.34 -0.06 -0.16 0.00 0.36 0.00 0.00 54.97 55.45 1hxj s GLU 40 Cb 0.38 -2.83 0.12 0.00 0.26 0.00 0.00 34.13 32.06 1hxj s GLU 40 CO -0.14 0.45 0.89 -0.25 -0.54 0.00 0.00 175.26 175.67 1hxj n ASP 41 N 0.03 -4.04 0.00 -1.70 8.00 -1.26 -1.81 116.55 115.77 1hxj n ASP 41 Ca -0.02 -0.89 0.00 0.00 0.71 0.00 0.00 54.79 54.59 1hxj n ASP 41 Cb 0.52 -3.36 0.00 0.00 -0.02 0.00 0.00 41.12 38.26 1hxj n ASP 41 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1hxj n GLY 42 N -1.56 0.69 3.73 0.44 0.00 -1.26 -4.72 105.19 102.50 1hxj n GLY 42 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 1hxj n GLY 42 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1hxj n LYS 43 N -2.52 2.45 -2.14 1.61 4.81 -0.75 -4.68 118.16 116.94 1hxj n LYS 43 Ca 0.00 0.87 -0.29 0.00 -0.87 0.00 0.00 58.31 58.02 1hxj n LYS 43 Cb 0.01 -2.57 0.03 0.00 0.02 0.00 0.00 35.03 32.52 1hxj n LYS 43 CO 0.00 0.00 0.00 0.20 1.17 0.00 0.00 177.40 178.77 1hxj s GLY 44 N 0.15 1.61 0.34 3.14 0.00 -0.70 -4.66 107.32 107.20 1hxj s GLY 44 Ca 0.61 -0.42 -0.27 0.00 0.00 0.00 0.00 44.72 44.64 1hxj s GLY 44 CO 0.55 -0.12 1.07 1.85 0.00 0.00 0.00 173.10 176.45 1hxj s GLU 45 N -5.12 4.40 0.39 2.90 2.12 -1.26 -4.65 118.70 117.47 1hxj s GLU 45 Ca 0.55 1.66 0.08 0.00 0.36 0.00 0.00 54.97 57.61 1hxj s GLU 45 Cb -0.11 -2.87 -0.04 0.00 0.26 0.00 0.00 34.13 31.37 1hxj s GLU 45 CO 0.49 0.04 0.20 -1.54 -0.54 0.00 0.00 175.26 173.91 1hxj s SER 46 N -1.22 4.62 0.36 -1.70 1.04 -1.26 0.15 113.70 115.69 1hxj s SER 46 Ca 0.51 -0.91 0.07 0.00 0.48 0.00 0.00 55.95 56.10 1hxj s SER 46 Cb -0.27 -0.58 0.78 0.00 0.10 0.00 0.00 66.02 66.05 1hxj s SER 46 CO 0.34 -0.48 1.91 -0.55 0.98 0.00 0.00 173.24 175.45 1hxj h ASN 47 N 1.40 0.66 0.24 7.02 -1.07 -0.94 -0.79 115.58 122.09 1hxj h ASN 47 Ca -0.43 0.02 -0.24 0.00 0.07 0.00 0.00 56.30 55.72 1hxj h ASN 47 Cb 1.25 -0.11 0.01 0.00 -2.07 0.00 0.00 38.32 37.40 1hxj h ASN 47 CO 0.65 0.38 -0.98 -0.50 0.07 0.00 0.00 177.43 177.05 1hxj h TRP 48 N 0.73 0.75 -0.14 4.14 4.06 -1.87 0.31 115.95 123.94 1hxj h TRP 48 Ca 0.39 -0.41 0.02 0.00 2.06 0.00 0.00 58.89 60.95 1hxj h TRP 48 Cb 0.51 -0.08 -0.02 0.00 -1.00 0.00 0.00 29.16 28.56 1hxj h TRP 48 CO -0.00 1.24 -0.02 -0.44 -3.56 0.00 0.00 178.44 175.66 1hxj h ASP 49 N 0.28 -0.09 -0.16 -3.49 3.32 -1.77 -0.52 116.42 113.99 1hxj h ASP 49 Ca -0.10 0.03 0.02 0.00 0.02 0.00 0.00 57.03 57.01 1hxj h ASP 49 Cb 1.63 0.07 -0.02 0.00 0.22 0.00 0.00 39.33 41.22 1hxj h ASP 49 CO 0.18 -0.02 0.03 -0.74 -1.72 0.00 0.00 179.24 176.97 1hxj h HIS 50 N 0.02 0.06 0.16 4.55 2.76 -1.12 -1.76 115.15 119.82 1hxj h HIS 50 Ca 0.06 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.24 1hxj h HIS 50 Cb 0.09 -0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.05 1hxj h HIS 50 CO -0.16 0.02 -0.08 0.35 -1.30 0.00 0.00 177.93 176.77 1hxj h PHE 51 N 0.10 -0.20 -0.29 5.26 3.57 -0.67 -0.75 116.94 123.95 1hxj h PHE 51 Ca 0.07 -0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.52 1hxj h PHE 51 Cb 0.06 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 38.85 1hxj h PHE 51 CO -0.13 -0.04 -0.03 0.00 -2.23 0.00 0.00 178.31 175.88 1hxj h HIS 53 N 0.44 0.64 0.00 0.00 3.86 -1.23 -3.22 115.15 115.64 1hxj h HIS 53 Ca 0.09 -0.33 -0.01 0.00 -1.16 0.00 0.00 60.37 58.96 1hxj h HIS 53 Cb 0.34 -0.08 -0.00 0.00 1.06 0.00 0.00 27.41 28.73 1hxj h HIS 53 CO 0.01 1.14 -0.68 -0.91 0.86 0.00 0.00 177.93 178.35 1hxj h ASN 54 N -0.05 0.00 -2.07 2.45 2.35 -1.06 -3.40 115.58 113.80 1hxj h ASN 54 Ca -0.07 0.00 -0.54 0.00 -0.55 0.00 0.00 56.30 55.14 1hxj h ASN 54 Cb 1.29 0.00 -0.40 0.00 0.05 0.00 0.00 38.32 39.26 1hxj h ASN 54 CO 0.12 0.05 -1.00 1.41 -1.65 0.00 0.00 177.43 176.36 1hxj n HIS 55 N -2.85 1.04 0.31 1.19 8.25 0.14 -4.91 115.22 118.39 1hxj n HIS 55 Ca 0.01 -3.80 0.20 0.00 -0.26 0.00 0.00 57.72 53.87 1hxj n HIS 55 Cb 0.57 -0.42 1.03 0.00 1.12 0.00 0.00 29.99 32.28 1hxj n HIS 55 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1hxj h PRO 56 N 3.53 0.00 0.00 -0.41 0.13 -1.74 -1.40 132.00 132.12 1hxj h PRO 56 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1hxj h PRO 56 Cb 0.83 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.96 1hxj h PRO 56 CO 0.58 0.01 0.00 -0.85 -0.23 0.00 0.00 178.00 177.51 1hxj n GLU 57 N -3.18 0.08 -0.13 0.86 0.00 -1.26 -2.23 120.64 114.78 1hxj n GLU 57 Ca -0.02 0.06 0.11 0.00 0.00 0.00 0.00 57.16 57.31 1hxj n GLU 57 Cb 0.14 -1.50 0.29 0.00 0.00 0.00 0.00 31.44 30.38 1hxj n GLU 57 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 1hxj n ARG 58 N -1.45 2.07 -4.62 3.44 5.12 -0.53 -4.77 116.66 115.92 1hxj n ARG 58 Ca 0.07 -1.62 -0.33 0.00 -1.93 0.00 0.00 57.85 54.05 1hxj n ARG 58 Cb 0.28 -1.44 -0.16 0.00 -1.16 0.00 0.00 32.46 29.98 1hxj n ARG 58 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1hxj s ILE 59 N -1.65 2.28 0.22 0.55 -1.09 -0.95 -4.76 121.20 115.81 1hxj s ILE 59 Ca 0.34 -0.90 -0.10 0.00 -2.23 0.00 0.00 60.65 57.76 1hxj s ILE 59 Cb 0.19 -1.93 0.32 0.00 -1.58 0.00 0.00 42.46 39.47 1hxj s ILE 59 CO 0.28 0.54 1.32 0.18 -1.23 0.00 0.00 174.94 176.02 1hxj n LEU 60 N 4.07 -0.39 -1.15 2.97 4.77 0.70 -0.11 117.00 127.86 1hxj n LEU 60 Ca -0.20 1.46 0.08 0.00 -0.03 0.00 0.00 56.01 57.33 1hxj n LEU 60 Cb 0.52 -0.40 0.28 0.00 -2.33 0.00 0.00 43.42 41.48 1hxj n LEU 60 CO 0.28 -1.37 0.74 -0.90 -1.33 0.00 0.00 177.39 174.81 1hxj n ASP 61 N -5.33 4.16 -1.16 -1.43 5.68 -1.26 -4.95 116.55 112.26 1hxj n ASP 61 Ca 0.12 -2.66 -0.15 0.00 -0.50 0.00 0.00 54.79 51.59 1hxj n ASP 61 Cb 0.39 -0.51 -0.06 0.00 -1.14 0.00 0.00 41.12 39.80 1hxj n ASP 61 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1hxj n GLY 62 N 0.24 1.44 2.96 6.12 0.00 0.84 -4.97 105.19 111.83 1hxj n GLY 62 Ca 0.21 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.02 1hxj n GLY 62 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1hxj n SER 63 N -1.28 0.37 -3.71 1.61 3.41 -1.26 -4.85 113.62 107.91 1hxj n SER 63 Ca -0.15 -1.52 -0.10 0.00 -0.26 0.00 0.00 58.87 56.83 1hxj n SER 63 Cb 0.64 -0.69 -0.04 0.00 -0.26 0.00 0.00 64.21 63.86 1hxj n SER 63 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1hxj s ASN 64 N -4.54 0.10 -0.58 4.04 6.03 -1.26 -4.91 114.94 113.82 1hxj s ASN 64 Ca 0.56 -1.04 0.02 0.00 -1.03 0.00 0.00 52.86 51.37 1hxj s ASN 64 Cb -0.02 0.65 0.42 0.00 -3.03 0.00 0.00 41.25 39.27 1hxj s ASN 64 CO 0.38 -1.26 1.62 -0.24 -2.03 0.00 0.00 177.10 175.58 1hxj n SER 65 N -0.71 6.33 0.01 3.54 2.88 -1.26 -4.66 113.62 119.75 1hxj n SER 65 Ca -0.02 -3.78 0.03 0.00 -1.33 0.00 0.00 58.87 53.77 1hxj n SER 65 Cb 0.61 -0.73 0.41 0.00 -0.75 0.00 0.00 64.21 63.75 1hxj n SER 65 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 1hxj h ASP 66 N 2.44 0.45 0.00 -3.46 5.19 -1.94 -3.31 116.42 115.78 1hxj h ASP 66 Ca 0.47 -0.03 -0.18 0.00 -0.62 0.00 0.00 57.03 56.68 1hxj h ASP 66 Cb 0.80 -0.11 -0.03 0.00 0.18 0.00 0.00 39.33 40.16 1hxj h ASP 66 CO 1.19 0.37 -1.66 -0.38 -3.12 0.00 0.00 179.24 175.64 1hxj n ILE 67 N -4.43 0.66 0.00 0.35 5.41 -1.26 -2.08 119.36 118.01 1hxj n ILE 67 Ca 0.02 -0.24 0.00 0.00 1.00 0.00 0.00 62.75 63.53 1hxj n ILE 67 Cb 0.10 -1.00 0.00 0.00 -0.71 0.00 0.00 39.64 38.03 1hxj n ILE 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1hxj n GLY 68 N 2.86 3.76 0.68 7.39 0.00 -1.25 -0.05 105.19 118.59 1hxj n GLY 68 Ca -0.21 0.22 0.07 0.00 0.00 0.00 0.00 46.02 46.09 1hxj n GLY 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hxj n ALA 69 N 12.26 2.29 -3.35 4.61 0.00 0.06 -4.92 120.51 131.46 1hxj n ALA 69 Ca 0.00 -0.99 -0.24 0.00 0.00 0.00 0.00 53.44 52.21 1hxj n ALA 69 Cb 0.00 -0.49 0.02 0.00 0.00 0.00 0.00 19.45 18.98 1hxj n ALA 69 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1hxj n ASN 70 N 0.71 -4.97 0.09 0.00 4.05 0.92 -4.84 115.26 111.23 1hxj n ASN 70 Ca 0.12 -0.43 0.11 0.00 0.45 0.00 0.00 54.58 54.83 1hxj n ASN 70 Cb 0.42 -4.02 0.44 0.00 1.23 0.00 0.00 39.78 37.85 1hxj n ASN 70 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 177.26 173.01 1hxj n SER 71 N -2.52 0.48 0.19 1.20 7.64 -0.66 -0.77 113.62 119.18 1hxj n SER 71 Ca -0.04 0.61 0.03 0.00 1.01 0.00 0.00 58.87 60.48 1hxj n SER 71 Cb 0.57 -0.71 0.41 0.00 -1.01 0.00 0.00 64.21 63.47 1hxj n SER 71 CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 1hxj h TYR 72 N 0.00 0.05 0.00 1.43 3.20 -1.61 -1.55 116.97 118.49 1hxj h TYR 72 Ca 0.00 -0.01 -0.23 0.00 3.14 0.00 0.00 58.73 61.63 1hxj h TYR 72 Cb 0.39 -0.01 -0.04 0.00 1.54 0.00 0.00 36.73 38.60 1hxj h TYR 72 CO 0.00 0.31 -2.00 0.72 -1.64 0.00 0.00 178.16 175.54 1hxj n HIS 73 N -4.21 0.00 -0.69 -3.82 8.25 -0.89 -4.59 115.22 109.26 1hxj n HIS 73 Ca -0.02 0.00 0.09 0.00 -0.26 0.00 0.00 57.72 57.53 1hxj n HIS 73 Cb 0.32 -0.69 0.33 0.00 1.12 0.00 0.00 29.99 31.08 1hxj n HIS 73 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 1hxj n MET 74 N -2.48 3.75 0.10 -0.41 2.81 0.05 -4.60 117.12 116.34 1hxj n MET 74 Ca -0.21 -2.86 0.19 0.00 -1.81 0.00 0.00 57.70 53.01 1hxj n MET 74 Cb 0.90 -1.89 0.75 0.00 -0.71 0.00 0.00 33.22 32.26 1hxj n MET 74 CO 0.00 0.00 0.00 0.10 1.51 0.00 0.00 175.97 177.58 1hxj h TYR 75 N 3.54 0.00 -0.43 2.03 -0.00 -1.52 -0.25 116.97 120.33 1hxj h TYR 75 Ca 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 58.73 58.66 1hxj h TYR 75 Cb 1.48 0.00 -0.02 0.00 -0.00 0.00 0.00 36.73 38.19 1hxj h TYR 75 CO 0.74 0.00 -0.00 0.87 -0.00 0.00 0.00 178.16 179.77 1hxj h LYS 76 N 0.00 0.70 -0.20 0.10 1.57 -1.87 -1.33 116.57 115.54 1hxj h LYS 76 Ca 0.17 -0.18 -0.18 0.00 -1.87 0.00 0.00 60.65 58.59 1hxj h LYS 76 Cb 0.81 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 33.03 1hxj h LYS 76 CO -0.00 0.72 -0.60 1.15 -0.57 0.00 0.00 179.45 180.15 1hxj h THR 77 N 0.66 1.31 -0.39 -0.16 2.02 -1.41 -1.99 112.91 112.95 1hxj h THR 77 Ca 0.13 -1.84 0.02 0.00 0.77 0.00 0.00 66.41 65.50 1hxj h THR 77 Cb 0.41 1.79 -0.03 0.00 -1.74 0.00 0.00 68.15 68.59 1hxj h THR 77 CO 0.02 0.58 0.21 0.44 0.37 0.00 0.00 175.52 177.13 1hxj h ASP 78 N 0.50 0.31 -0.76 4.18 3.32 -1.14 -1.38 116.42 121.45 1hxj h ASP 78 Ca -0.00 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.04 1hxj h ASP 78 Cb 1.18 -0.05 -0.04 0.00 0.22 0.00 0.00 39.33 40.65 1hxj h ASP 78 CO 0.12 0.23 0.40 0.58 -1.72 0.00 0.00 179.24 178.85 1hxj h VAL 79 N 0.42 1.23 -0.04 -1.35 2.07 -1.16 -2.09 116.25 115.33 1hxj h VAL 79 Ca 0.16 -0.61 0.04 0.00 0.82 0.00 0.00 66.70 67.11 1hxj h VAL 79 Cb 0.05 0.25 -0.05 0.00 -1.52 0.00 0.00 31.29 30.02 1hxj h VAL 79 CO -0.10 0.27 -0.23 -0.09 0.02 0.00 0.00 177.57 177.44 1hxj h ARG 80 N 1.06 -0.32 -0.39 1.57 2.43 -0.62 0.07 114.38 118.17 1hxj h ARG 80 Ca 0.27 0.02 0.03 0.00 -0.81 0.00 0.00 59.98 59.49 1hxj h ARG 80 Cb 0.06 0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.65 1hxj h ARG 80 CO -0.04 -0.21 0.20 -0.07 -1.51 0.00 0.00 179.97 178.33 1hxj h LEU 81 N -0.33 0.29 -0.86 3.80 3.38 -1.10 0.55 115.31 121.03 1hxj h LEU 81 Ca 0.07 0.02 0.05 0.00 0.09 0.00 0.00 57.88 58.12 1hxj h LEU 81 Cb 0.43 -0.03 -0.06 0.00 0.09 0.00 0.00 40.66 41.09 1hxj h LEU 81 CO -0.24 0.21 0.54 -0.07 0.09 0.00 0.00 178.44 178.97 1hxj h LEU 82 N 0.40 0.87 -0.19 1.67 3.38 -0.93 -0.19 115.31 120.32 1hxj h LEU 82 Ca 0.17 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.13 1hxj h LEU 82 Cb 0.07 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 1hxj h LEU 82 CO -0.12 0.57 0.08 0.50 0.09 0.00 0.00 178.44 179.56 1hxj h LYS 83 N 1.01 0.28 -0.69 1.13 1.63 -0.20 -2.23 116.57 117.50 1hxj h LYS 83 Ca 0.37 -0.05 -0.00 0.00 -0.85 0.00 0.00 60.65 60.11 1hxj h LYS 83 Cb 0.12 -0.05 -0.03 0.00 -0.60 0.00 0.00 32.23 31.67 1hxj h LYS 83 CO -0.15 0.35 0.42 0.93 -3.45 0.00 0.00 179.45 177.55 1hxj h GLU 84 N 0.16 0.93 0.00 1.90 5.08 -0.18 -1.48 114.58 120.98 1hxj h GLU 84 Ca 0.06 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1hxj h GLU 84 Cb 0.17 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.22 1hxj h GLU 84 CO -0.01 0.65 0.00 -1.33 -1.00 0.00 0.00 179.01 177.32 1hxj n MET 85 N -4.40 0.42 -1.58 2.33 2.81 -0.15 -4.87 117.12 111.67 1hxj n MET 85 Ca 0.07 0.03 -0.10 0.00 -1.81 0.00 0.00 57.70 55.90 1hxj n MET 85 Cb 0.06 -1.50 -0.03 0.00 -0.71 0.00 0.00 33.22 31.04 1hxj n MET 85 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1hxj n GLY 86 N 0.94 0.74 3.77 3.03 0.00 -0.56 -4.04 105.19 109.07 1hxj n GLY 86 Ca 0.13 -0.56 -0.40 0.00 0.00 0.00 0.00 46.02 45.19 1hxj n GLY 86 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1hxj s MET 87 N -3.37 3.97 0.25 1.61 -1.94 -0.87 -4.86 119.30 114.09 1hxj s MET 87 Ca 0.00 2.40 0.21 0.00 -1.71 0.00 0.00 55.69 56.58 1hxj s MET 87 Cb 0.00 -2.84 0.07 0.00 2.01 0.00 0.00 34.83 34.07 1hxj s MET 87 CO 0.00 -0.58 1.21 -0.44 -0.01 0.00 0.00 175.02 175.20 1hxj h ASP 88 N 2.76 0.00 -5.11 3.03 3.32 -0.88 -3.44 116.42 116.10 1hxj h ASP 88 Ca -0.50 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.53 1hxj h ASP 88 Cb 1.25 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 40.70 1hxj h ASP 88 CO 0.63 0.18 0.01 0.00 -1.72 0.00 0.00 179.24 178.33 1hxj s ALA 89 N -3.19 -0.80 -0.05 3.45 0.00 -1.16 -0.70 121.76 119.31 1hxj s ALA 89 Ca 0.02 -0.38 -0.02 0.00 0.00 0.00 0.00 51.96 51.58 1hxj s ALA 89 Cb 0.08 0.89 0.03 0.00 0.00 0.00 0.00 23.12 24.12 1hxj s ALA 89 CO 0.76 -0.83 0.04 -0.47 0.00 0.00 0.00 175.76 175.26 1hxj s TYR 90 N -3.91 0.21 -0.26 0.00 5.04 -0.42 -3.40 117.35 114.62 1hxj s TYR 90 Ca 0.12 0.14 -0.12 0.00 -2.44 0.00 0.00 57.07 54.77 1hxj s TYR 90 Cb -0.01 -0.54 -0.05 0.00 0.35 0.00 0.00 41.96 41.71 1hxj s TYR 90 CO 0.01 -0.21 0.22 0.50 -1.34 0.00 0.00 175.55 174.72 1hxj s ARG 91 N 2.02 4.01 0.19 4.97 3.52 -0.53 -1.46 118.95 131.68 1hxj s ARG 91 Ca 0.04 -0.21 -0.02 0.00 -0.13 0.00 0.00 55.73 55.41 1hxj s ARG 91 Cb -0.12 -3.62 -0.04 0.00 -1.56 0.00 0.00 34.95 29.61 1hxj s ARG 91 CO -0.03 -0.12 0.14 -0.59 -0.81 0.00 0.00 175.30 173.89 1hxj s PHE 92 N 1.57 1.08 0.32 5.12 -0.12 -0.87 -0.71 117.98 124.37 1hxj s PHE 92 Ca 0.09 -1.33 0.10 0.00 -0.05 0.00 0.00 56.93 55.74 1hxj s PHE 92 Cb -0.15 -0.52 -0.06 0.00 -0.63 0.00 0.00 43.02 41.66 1hxj s PHE 92 CO 0.09 -0.64 -0.13 -1.54 -0.05 0.00 0.00 175.22 172.95 1hxj s SER 93 N -3.14 3.63 -0.14 1.98 1.04 -1.25 -0.84 113.70 114.98 1hxj s SER 93 Ca 0.36 -1.15 -0.07 0.00 0.48 0.00 0.00 55.95 55.57 1hxj s SER 93 Cb 0.07 -0.32 -0.04 0.00 0.10 0.00 0.00 66.02 65.82 1hxj s SER 93 CO 0.10 -0.14 0.11 -0.63 0.98 0.00 0.00 173.24 173.67 1hxj s ILE 94 N -2.60 5.29 -0.48 -1.02 -1.09 -0.64 -4.14 121.20 116.51 1hxj s ILE 94 Ca 0.31 0.13 -0.25 0.00 -2.23 0.00 0.00 60.65 58.61 1hxj s ILE 94 Cb 0.00 -3.33 0.03 0.00 -1.58 0.00 0.00 42.46 37.58 1hxj s ILE 94 CO 0.16 0.56 0.94 -0.55 -1.23 0.00 0.00 174.94 174.81 1hxj s SER 95 N -0.52 6.47 0.16 3.58 0.15 -1.26 -4.64 113.70 117.63 1hxj s SER 95 Ca 0.12 0.03 -0.24 0.00 0.70 0.00 0.00 55.95 56.55 1hxj s SER 95 Cb -0.12 -2.45 0.04 0.00 -1.71 0.00 0.00 66.02 61.78 1hxj s SER 95 CO 0.02 -1.10 1.59 -0.25 1.20 0.00 0.00 173.24 174.70 1hxj h TRP 96 N 9.14 -1.02 0.00 3.44 2.91 -1.84 -1.07 115.95 127.52 1hxj h TRP 96 Ca -0.24 0.06 -0.03 0.00 1.13 0.00 0.00 58.89 59.80 1hxj h TRP 96 Cb 1.07 0.50 -0.00 0.00 -0.51 0.00 0.00 29.16 30.22 1hxj h TRP 96 CO 0.88 -0.40 -0.15 -1.00 -1.03 0.00 0.00 178.44 176.74 1hxj h PRO 97 N -0.28 0.00 -0.01 2.65 0.13 -1.79 0.12 132.00 132.82 1hxj h PRO 97 Ca 0.16 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 65.17 1hxj h PRO 97 Cb 0.56 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.67 1hxj h PRO 97 CO -0.55 0.15 -0.55 -0.09 -0.23 0.00 0.00 178.00 176.73 1hxj h ARG 98 N 0.00 0.04 0.07 0.86 2.43 -1.48 -1.76 114.38 114.53 1hxj h ARG 98 Ca -0.00 -0.02 -0.22 0.00 -0.81 0.00 0.00 59.98 58.93 1hxj h ARG 98 Cb 0.41 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.95 1hxj h ARG 98 CO 0.02 0.58 -1.13 0.82 -1.51 0.00 0.00 179.97 178.75 1hxj h ILE 99 N 0.03 1.15 -3.18 1.20 1.08 -0.85 -3.38 117.51 113.55 1hxj h ILE 99 Ca -0.00 -2.35 -0.62 0.00 -0.39 0.00 0.00 64.86 61.49 1hxj h ILE 99 Cb 0.98 2.73 -0.40 0.00 -3.07 0.00 0.00 36.82 37.06 1hxj h ILE 99 CO 0.07 0.60 -0.69 -0.76 -0.69 0.00 0.00 178.15 176.68 1hxj s LEU 100 N -7.74 3.40 0.40 1.44 1.43 0.35 -0.02 118.68 117.94 1hxj s LEU 100 Ca -0.21 -2.73 0.21 0.00 -1.03 0.00 0.00 54.13 50.37 1hxj s LEU 100 Cb 0.03 -1.30 1.20 0.00 0.03 0.00 0.00 46.19 46.16 1hxj s LEU 100 CO 0.72 -0.26 1.70 -0.65 0.23 0.00 0.00 176.35 178.08 1hxj h PRO 101 N 6.72 0.27 -0.44 1.29 0.11 -1.64 0.37 132.00 138.67 1hxj h PRO 101 Ca -0.04 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.05 1hxj h PRO 101 Cb 0.92 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.97 1hxj h PRO 101 CO 0.57 0.18 0.00 1.63 -0.21 0.00 0.00 178.00 180.17 1hxj n LYS 102 N -4.74 3.76 -0.57 1.05 5.02 -1.26 -4.35 118.16 117.07 1hxj n LYS 102 Ca 0.31 -2.91 0.00 0.00 -2.02 0.00 0.00 58.31 53.69 1hxj n LYS 102 Cb 1.08 -1.96 0.00 0.00 -0.02 0.00 0.00 35.03 34.13 1hxj n LYS 102 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1hxj n GLY 103 N 0.25 0.00 3.40 0.72 0.00 0.13 -4.62 105.19 105.06 1hxj n GLY 103 Ca 0.24 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.05 1hxj n GLY 103 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1hxj s THR 104 N -0.81 1.83 0.12 2.61 -4.23 -1.26 -4.85 115.64 109.05 1hxj s THR 104 Ca 0.00 -2.21 -0.17 0.00 -1.18 0.00 0.00 61.69 58.13 1hxj s THR 104 Cb 0.00 -2.25 -0.03 0.00 1.34 0.00 0.00 72.50 71.56 1hxj s THR 104 CO 0.00 -0.45 1.65 0.50 -0.54 0.00 0.00 174.62 175.78 1hxj h LYS 105 N 2.40 0.51 0.00 3.99 3.64 -1.92 -2.37 116.57 122.82 1hxj h LYS 105 Ca -0.39 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 58.89 1hxj h LYS 105 Cb 1.23 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.97 1hxj h LYS 105 CO 0.64 0.53 0.00 1.49 -2.27 0.00 0.00 179.45 179.84 1hxj h GLU 106 N 0.39 0.00 0.00 1.90 4.81 -1.97 -1.50 114.58 118.21 1hxj h GLU 106 Ca 0.11 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.33 1hxj h GLU 106 Cb 0.22 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.60 1hxj h GLU 106 CO -0.01 0.00 -0.02 0.78 -0.73 0.00 0.00 179.01 179.03 1hxj h GLY 107 N 1.62 0.00 0.00 1.92 0.00 -1.77 -3.49 103.07 101.36 1hxj h GLY 107 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1hxj h GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 1hxj n GLY 108 N 0.40 -0.48 3.79 4.60 0.00 -0.56 -4.74 105.19 108.20 1hxj n GLY 108 Ca 0.02 -1.58 -0.38 0.00 0.00 0.00 0.00 46.02 44.08 1hxj n GLY 108 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1hxj s ILE 109 N -3.05 5.12 -0.47 -0.61 1.01 -1.26 -4.27 121.20 117.68 1hxj s ILE 109 Ca 0.00 0.80 -0.25 0.00 0.00 0.00 0.00 60.65 61.21 1hxj s ILE 109 Cb 0.00 -3.72 0.03 0.00 0.01 0.00 0.00 42.46 38.78 1hxj s ILE 109 CO 0.00 0.49 0.89 0.21 0.00 0.00 0.00 174.94 176.53 1hxj s ASN 110 N -0.43 6.46 0.45 3.58 2.47 0.97 -4.94 114.94 123.51 1hxj s ASN 110 Ca 0.23 0.01 0.16 0.00 0.42 0.00 0.00 52.86 53.68 1hxj s ASN 110 Cb -0.16 -2.43 1.09 0.00 -1.45 0.00 0.00 41.25 38.30 1hxj s ASN 110 CO 0.11 -1.03 1.98 1.55 -3.72 0.00 0.00 177.10 175.99 1hxj h PRO 111 N 9.07 0.33 0.00 0.43 0.13 -1.92 -0.86 132.00 139.19 1hxj h PRO 111 Ca -0.24 -0.02 -0.09 0.00 -0.87 0.00 0.00 66.00 64.78 1hxj h PRO 111 Cb 1.08 -0.07 -0.01 0.00 0.13 0.00 0.00 31.00 32.12 1hxj h PRO 111 CO 1.01 0.22 -0.43 -0.44 -0.23 0.00 0.00 178.00 178.13 1hxj h ASP 112 N 0.34 0.00 -0.02 1.44 3.32 -1.92 -1.71 116.42 117.88 1hxj h ASP 112 Ca 0.27 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.30 1hxj h ASP 112 Cb 0.62 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.17 1hxj h ASP 112 CO -0.07 0.43 -0.07 1.23 -1.72 0.00 0.00 179.24 179.05 1hxj h GLY 113 N 1.34 0.08 0.59 2.75 0.00 -1.35 -1.99 103.07 104.50 1hxj h GLY 113 Ca -0.00 -0.11 0.06 0.00 0.00 0.00 0.00 47.33 47.27 1hxj h GLY 113 CO 0.06 0.10 0.25 -2.22 0.00 0.00 0.00 176.54 174.73 1hxj h ILE 114 N -0.54 0.88 -0.07 2.60 1.08 -1.42 -2.47 117.51 117.58 1hxj h ILE 114 Ca -0.00 -0.16 0.02 0.00 -0.39 0.00 0.00 64.86 64.33 1hxj h ILE 114 Cb 0.72 0.38 -0.02 0.00 -3.07 0.00 0.00 36.82 34.82 1hxj h ILE 114 CO 0.01 0.09 -0.07 0.50 -0.69 0.00 0.00 178.15 177.99 1hxj h LYS 115 N 0.47 -0.08 -0.15 2.37 3.64 -1.33 -1.69 116.57 119.80 1hxj h LYS 115 Ca 0.26 0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.69 1hxj h LYS 115 Cb 0.23 0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 32.01 1hxj h LYS 115 CO -0.22 -0.05 -0.23 -0.92 -2.27 0.00 0.00 179.45 175.76 1hxj h TYR 116 N -0.08 -0.61 -0.27 1.91 3.20 -0.91 -0.40 116.97 119.81 1hxj h TYR 116 Ca 0.05 0.03 -0.09 0.00 3.14 0.00 0.00 58.73 61.86 1hxj h TYR 116 Cb 0.16 0.29 -0.01 0.00 1.54 0.00 0.00 36.73 38.71 1hxj h TYR 116 CO -0.17 -0.31 -0.22 1.88 -1.64 0.00 0.00 178.16 177.70 1hxj h TYR 117 N -0.28 0.57 -0.43 -3.82 0.05 -1.41 -1.95 116.97 109.70 1hxj h TYR 117 Ca 0.11 -0.11 -0.10 0.00 0.05 0.00 0.00 58.73 58.67 1hxj h TYR 117 Cb 0.44 -0.14 -0.02 0.00 1.01 0.00 0.00 36.73 38.02 1hxj h TYR 117 CO -0.34 0.69 -0.14 0.00 -1.05 0.00 0.00 178.16 177.33 1hxj h ARG 118 N 0.46 0.78 -0.58 4.88 3.08 -0.83 0.81 114.38 122.97 1hxj h ARG 118 Ca 0.07 -0.28 -0.05 0.00 0.07 0.00 0.00 59.98 59.79 1hxj h ARG 118 Cb 0.63 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.60 1hxj h ARG 118 CO 0.04 0.88 0.16 -0.91 -1.07 0.00 0.00 179.97 179.08 1hxj h ASN 119 N 0.70 0.87 0.07 7.04 2.35 -0.81 0.40 115.58 126.20 1hxj h ASN 119 Ca 0.11 -0.22 -0.00 0.00 -0.55 0.00 0.00 56.30 55.64 1hxj h ASN 119 Cb 0.63 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.77 1hxj h ASN 119 CO 0.04 0.86 -0.03 0.25 -1.65 0.00 0.00 177.43 176.90 1hxj h LEU 120 N 0.83 -0.08 -0.34 1.61 5.85 -1.05 -1.51 115.31 120.62 1hxj h LEU 120 Ca 0.19 -0.21 0.02 0.00 0.84 0.00 0.00 57.88 58.72 1hxj h LEU 120 Cb 0.32 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.35 1hxj h LEU 120 CO -0.00 0.17 0.18 0.40 -0.34 0.00 0.00 178.44 178.85 1hxj h ILE 121 N -0.33 1.00 -0.57 4.05 2.04 -0.73 -0.70 117.51 122.27 1hxj h ILE 121 Ca -0.01 -0.13 -0.05 0.00 1.00 0.00 0.00 64.86 65.67 1hxj h ILE 121 Cb 0.28 0.60 -0.02 0.00 -0.74 0.00 0.00 36.82 36.94 1hxj h ILE 121 CO 0.02 0.07 0.14 0.78 0.00 0.00 0.00 178.15 179.16 1hxj h ASN 122 N 0.37 0.85 -0.34 1.72 2.35 -0.91 -1.43 115.58 118.19 1hxj h ASN 122 Ca 0.14 -0.23 -0.05 0.00 -0.55 0.00 0.00 56.30 55.61 1hxj h ASN 122 Cb 0.04 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.16 1hxj h ASN 122 CO -0.09 0.86 0.05 0.25 -1.65 0.00 0.00 177.43 176.85 1hxj h LEU 123 N 0.81 0.63 0.16 1.61 5.85 -1.04 0.10 115.31 123.43 1hxj h LEU 123 Ca 0.18 -0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 1hxj h LEU 123 Cb 0.34 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.20 1hxj h LEU 123 CO 0.00 0.67 -0.08 -0.07 -0.34 0.00 0.00 178.44 178.62 1hxj h LEU 124 N 0.64 -0.19 -1.49 2.25 3.38 -0.74 -2.53 115.31 116.64 1hxj h LEU 124 Ca 0.14 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1hxj h LEU 124 Cb 0.33 0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 1hxj h LEU 124 CO 0.01 0.05 0.25 -0.07 0.09 0.00 0.00 178.44 178.77 1hxj h LEU 125 N -0.42 0.52 -0.90 1.67 3.38 -1.06 0.19 115.31 118.68 1hxj h LEU 125 Ca -0.02 -0.03 0.06 0.00 0.09 0.00 0.00 57.88 57.98 1hxj h LEU 125 Cb 0.33 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 40.89 1hxj h LEU 125 CO 0.04 0.42 0.57 -0.33 0.09 0.00 0.00 178.44 179.23 1hxj h GLU 126 N 0.60 1.01 -0.67 1.13 5.08 -0.73 -0.83 114.58 120.18 1hxj h GLU 126 Ca 0.16 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 1hxj h GLU 126 Cb 0.00 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.03 1hxj h GLU 126 CO -0.03 0.67 0.00 0.09 -1.00 0.00 0.00 179.01 178.74 1hxj n ASN 127 N -4.58 3.38 -1.35 1.42 4.13 -0.60 -4.91 115.26 112.75 1hxj n ASN 127 Ca 0.13 -2.39 -0.13 0.00 1.68 0.00 0.00 54.58 53.87 1hxj n ASN 127 Cb 0.18 -0.52 -0.02 0.00 -1.54 0.00 0.00 39.78 37.88 1hxj n ASN 127 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1hxj n GLY 128 N 0.60 0.22 3.53 7.41 0.00 -0.32 -4.94 105.19 111.70 1hxj n GLY 128 Ca 0.16 -0.36 -0.35 0.00 0.00 0.00 0.00 46.02 45.47 1hxj n GLY 128 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1hxj s ILE 129 N -2.60 4.35 -0.11 -0.61 1.01 -0.05 -4.86 121.20 118.33 1hxj s ILE 129 Ca 0.00 -0.18 -0.27 0.00 0.00 0.00 0.00 60.65 60.20 1hxj s ILE 129 Cb 0.00 -2.97 -0.02 0.00 0.01 0.00 0.00 42.46 39.48 1hxj s ILE 129 CO 0.00 0.43 0.88 -0.70 0.00 0.00 0.00 174.94 175.55 1hxj s GLU 130 N 0.75 4.39 0.06 2.79 2.56 0.12 -3.41 118.70 125.96 1hxj s GLU 130 Ca 0.02 1.16 -0.26 0.00 0.00 0.00 0.00 54.97 55.89 1hxj s GLU 130 Cb -0.14 -3.53 -0.05 0.00 2.00 0.00 0.00 34.13 32.41 1hxj s GLU 130 CO 0.02 -0.22 0.80 -1.25 -0.56 0.00 0.00 175.26 174.05 1hxj s PRO 131 N 1.73 4.53 -0.31 4.30 0.04 -1.26 -1.30 135.00 142.74 1hxj s PRO 131 Ca 0.43 1.14 0.02 0.00 0.04 0.00 0.00 61.00 62.63 1hxj s PRO 131 Cb -0.18 -3.37 0.08 0.00 0.04 0.00 0.00 34.50 31.07 1hxj s PRO 131 CO 0.17 0.26 -0.01 0.71 0.04 0.00 0.00 177.00 178.17 1hxj s TYR 132 N -0.02 3.48 -0.25 0.56 1.51 -0.53 -4.14 117.35 117.96 1hxj s TYR 132 Ca 0.40 -2.53 -0.13 0.00 -1.01 0.00 0.00 57.07 53.80 1hxj s TYR 132 Cb -0.21 -2.43 -0.04 0.00 -0.11 0.00 0.00 41.96 39.16 1hxj s TYR 132 CO 0.24 -0.90 0.27 0.08 -1.11 0.00 0.00 175.55 174.13 1hxj s VAL 133 N 1.05 5.27 -0.23 0.71 1.01 -0.66 -2.05 120.40 125.50 1hxj s VAL 133 Ca 0.00 0.38 -0.19 0.00 0.00 0.00 0.00 61.98 62.17 1hxj s VAL 133 Cb -0.20 -3.60 -0.03 0.00 0.00 0.00 0.00 36.38 32.55 1hxj s VAL 133 CO -0.06 0.25 0.57 -0.89 0.00 0.00 0.00 175.10 174.97 1hxj s THR 134 N 1.58 5.05 -0.03 3.92 2.01 -0.02 -0.73 115.64 127.43 1hxj s THR 134 Ca 0.11 1.03 -0.24 0.00 0.31 0.00 0.00 61.69 62.90 1hxj s THR 134 Cb -0.15 -3.88 -0.21 0.00 0.01 0.00 0.00 72.50 68.27 1hxj s THR 134 CO 0.08 0.10 1.15 0.40 -0.69 0.00 0.00 174.62 175.67 1hxj h ILE 135 N 5.27 1.47 -3.33 1.82 2.04 -0.34 -1.71 117.51 122.73 1hxj h ILE 135 Ca -0.30 -1.62 -0.65 0.00 1.00 0.00 0.00 64.86 63.28 1hxj h ILE 135 Cb 1.14 2.43 -0.36 0.00 -0.74 0.00 0.00 36.82 39.29 1hxj h ILE 135 CO 0.75 0.45 -0.83 0.12 0.00 0.00 0.00 178.15 178.63 1hxj s PHE 136 N -3.64 2.77 -0.49 1.37 5.36 -0.79 -4.16 117.98 118.40 1hxj s PHE 136 Ca -0.16 -1.76 0.07 0.00 -0.96 0.00 0.00 56.93 54.12 1hxj s PHE 136 Cb 0.02 -1.84 0.38 0.00 -0.34 0.00 0.00 43.02 41.24 1hxj s PHE 136 CO 0.73 -0.80 0.98 1.58 -1.46 0.00 0.00 175.22 176.25 1hxj n HIS 137 N 4.60 3.17 -0.29 10.12 -0.00 -1.26 -2.18 115.22 129.38 1hxj n HIS 137 Ca -0.18 -3.59 0.00 0.00 0.46 0.00 0.00 57.72 54.41 1hxj n HIS 137 Cb 0.47 -0.34 0.00 0.00 -0.12 0.00 0.00 29.99 30.01 1hxj n HIS 137 CO 0.00 0.00 0.00 0.91 0.46 0.00 0.00 176.34 177.71 1hxj n TRP 138 N -0.25 0.00 -3.07 1.57 8.01 -1.26 -4.86 117.44 117.58 1hxj n TRP 138 Ca 0.31 0.00 -0.45 0.00 -1.31 0.00 0.00 57.50 56.06 1hxj n TRP 138 Cb 0.54 -0.26 -0.01 0.00 -2.01 0.00 0.00 31.31 29.57 1hxj n TRP 138 CO 0.00 0.00 0.00 0.16 -1.01 0.00 0.00 177.69 176.84 1hxj s ASP 139 N -3.30 6.97 0.23 -0.99 3.84 -1.26 -4.80 116.67 117.36 1hxj s ASP 139 Ca 0.00 -2.84 -0.29 0.00 -0.00 0.00 0.00 52.55 49.43 1hxj s ASP 139 Cb 0.00 -2.34 -0.09 0.00 -1.38 0.00 0.00 42.92 39.12 1hxj s ASP 139 CO 0.00 -0.71 0.90 -0.69 -0.00 0.00 0.00 175.17 174.67 1hxj s VAL 140 N 1.09 4.15 0.16 2.11 1.01 -1.26 -4.22 120.40 123.44 1hxj s VAL 140 Ca 0.34 1.98 -0.31 0.00 0.00 0.00 0.00 61.98 63.99 1hxj s VAL 140 Cb -0.06 -4.26 -0.11 0.00 0.00 0.00 0.00 36.38 31.95 1hxj s VAL 140 CO -0.05 0.48 1.76 -2.84 0.00 0.00 0.00 175.10 174.45 1hxj s PRO 141 N -1.24 4.14 0.55 2.72 0.02 -1.26 -0.32 135.00 139.61 1hxj s PRO 141 Ca 0.40 2.57 0.25 0.00 0.02 0.00 0.00 61.00 64.24 1hxj s PRO 141 Cb -0.25 -3.37 1.45 0.00 0.02 0.00 0.00 34.50 32.36 1hxj s PRO 141 CO 0.30 -0.78 2.03 0.37 -0.33 0.00 0.00 177.00 178.59 1hxj h GLN 142 N 7.77 0.00 -0.77 5.54 5.75 -0.51 -0.53 115.11 132.36 1hxj h GLN 142 Ca -0.44 0.00 -0.02 0.00 -0.15 0.00 0.00 58.65 58.03 1hxj h GLN 142 Cb 1.21 0.00 -0.04 0.00 1.07 0.00 0.00 27.48 29.72 1hxj h GLN 142 CO 0.95 0.00 0.38 0.00 -2.65 0.00 0.00 178.83 177.51 1hxj h ALA 143 N 1.75 1.22 -0.01 3.38 0.00 -1.87 -2.29 119.26 121.44 1hxj h ALA 143 Ca 0.18 -0.14 -0.19 0.00 0.00 0.00 0.00 54.91 54.76 1hxj h ALA 143 Cb 0.78 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1hxj h ALA 143 CO -0.00 0.60 -0.82 -0.07 0.00 0.00 0.00 179.25 178.96 1hxj h LEU 144 N 1.09 0.23 -0.84 0.00 3.38 -1.36 -2.13 115.31 115.69 1hxj h LEU 144 Ca 0.27 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1hxj h LEU 144 Cb 0.09 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 40.73 1hxj h LEU 144 CO -0.04 0.95 0.53 -0.33 0.09 0.00 0.00 178.44 179.65 1hxj h GLU 145 N 0.11 1.11 0.00 1.13 4.39 -1.17 -1.87 114.58 118.29 1hxj h GLU 145 Ca -0.03 -0.08 -0.17 0.00 0.34 0.00 0.00 59.36 59.41 1hxj h GLU 145 Cb 1.43 -0.24 -0.02 0.00 -0.10 0.00 0.00 28.75 29.81 1hxj h GLU 145 CO 0.12 0.76 -0.82 0.93 -1.16 0.00 0.00 179.01 178.84 1hxj h GLU 146 N 1.14 0.00 0.06 2.33 5.08 -1.40 0.60 114.58 122.40 1hxj h GLU 146 Ca 0.30 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.66 1hxj h GLU 146 Cb -0.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.16 1hxj h GLU 146 CO -0.06 0.82 -0.03 -0.22 -1.00 0.00 0.00 179.01 178.52 1hxj h LYS 147 N 0.00 -0.08 0.00 2.33 3.64 -0.98 -3.41 116.57 118.07 1hxj h LYS 147 Ca -0.01 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1hxj h LYS 147 Cb 1.58 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.42 1hxj h LYS 147 CO 0.11 0.28 -0.18 2.48 -2.27 0.00 0.00 179.45 179.87 1hxj n TYR 148 N -4.95 0.00 -0.74 1.91 0.18 -0.74 -5.02 117.16 107.80 1hxj n TYR 148 Ca -0.08 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.70 1hxj n TYR 148 Cb 0.21 0.09 0.00 0.00 -0.38 0.00 0.00 39.34 39.26 1hxj n TYR 148 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1hxj n GLY 149 N 0.00 0.61 7.00 -7.48 0.00 0.20 -3.64 105.19 101.89 1hxj n GLY 149 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1hxj n GLY 149 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hxj n GLY 150 N -2.74 3.11 0.00 -0.02 0.00 -1.08 -2.14 105.19 102.31 1hxj n GLY 150 Ca 0.00 -0.17 0.08 0.00 0.00 0.00 0.00 46.02 45.92 1hxj n GLY 150 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1hxj n PHE 151 N 13.34 0.00 1.49 1.61 3.72 -1.26 -2.05 117.46 134.31 1hxj n PHE 151 Ca 0.00 0.00 0.14 0.00 -0.05 0.00 0.00 57.45 57.54 1hxj n PHE 151 Cb 0.00 0.00 0.55 0.00 -0.94 0.00 0.00 39.48 39.09 1hxj n PHE 151 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1hxj n LEU 152 N -0.87 1.13 -4.29 4.37 4.77 -0.91 -3.59 117.00 117.61 1hxj n LEU 152 Ca 0.11 -0.34 -0.57 0.00 -0.03 0.00 0.00 56.01 55.18 1hxj n LEU 152 Cb 0.05 -0.05 -0.12 0.00 -2.33 0.00 0.00 43.42 40.97 1hxj n LEU 152 CO 0.09 0.19 1.79 -0.67 -1.33 0.00 0.00 177.39 177.46 1hxj n ASP 153 N -0.25 0.76 0.23 -1.43 2.03 -0.87 -4.78 116.55 112.24 1hxj n ASP 153 Ca 0.18 0.61 0.15 0.00 0.52 0.00 0.00 54.79 56.25 1hxj n ASP 153 Cb 0.32 -0.92 0.58 0.00 -0.72 0.00 0.00 41.12 40.38 1hxj n ASP 153 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 1hxj h LYS 154 N 9.52 0.00 0.00 -0.67 1.79 -1.91 -2.61 116.57 122.68 1hxj h LYS 154 Ca -0.10 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.37 1hxj h LYS 154 Cb 1.40 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.05 1hxj h LYS 154 CO 1.12 0.00 -0.18 0.66 -1.08 0.00 0.00 179.45 179.97 1hxj h SER 155 N 0.00 0.00 -3.45 0.86 4.64 -1.96 -3.47 113.55 110.16 1hxj h SER 155 Ca 0.00 -0.01 -0.36 0.00 -0.47 0.00 0.00 61.79 60.96 1hxj h SER 155 Cb 0.53 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.61 1hxj h SER 155 CO 0.00 0.00 -0.47 1.41 -0.87 0.00 0.00 176.83 176.91 1hxj n HIS 156 N -2.93 -1.23 0.01 4.77 8.25 -0.99 -4.79 115.22 118.31 1hxj n HIS 156 Ca 0.03 0.05 0.00 0.00 -0.26 0.00 0.00 57.72 57.54 1hxj n HIS 156 Cb 0.52 -3.58 0.00 0.00 1.12 0.00 0.00 29.99 28.06 1hxj n HIS 156 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1hxj n LYS 157 N -3.03 0.00 0.10 -0.41 5.02 -1.26 -4.71 118.16 113.86 1hxj n LYS 157 Ca -0.20 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 55.97 1hxj n LYS 157 Cb 0.65 -0.27 -0.05 0.00 -0.02 0.00 0.00 35.03 35.34 1hxj n LYS 157 CO 0.00 0.00 0.00 0.77 -0.52 0.00 0.00 177.40 177.65 1hxj h SER 158 N 0.00 -0.66 -0.66 4.39 0.02 -1.95 -0.35 113.55 114.34 1hxj h SER 158 Ca 0.00 0.08 -0.04 0.00 -0.84 0.00 0.00 61.79 60.99 1hxj h SER 158 Cb 0.46 0.25 -0.03 0.00 0.14 0.00 0.00 62.40 63.23 1hxj h SER 158 CO 0.00 -0.31 0.26 -0.29 -1.14 0.00 0.00 176.83 175.35 1hxj h ILE 159 N -0.41 1.24 -0.45 3.27 6.09 -1.91 0.54 117.51 125.88 1hxj h ILE 159 Ca 0.04 -0.76 -0.03 0.00 -1.37 0.00 0.00 64.86 62.74 1hxj h ILE 159 Cb 0.45 0.43 -0.02 0.00 0.47 0.00 0.00 36.82 38.15 1hxj h ILE 159 CO -0.15 0.30 0.18 0.58 -3.07 0.00 0.00 178.15 175.99 1hxj h VAL 160 N 0.99 1.20 -0.12 2.19 2.07 -1.77 0.29 116.25 121.10 1hxj h VAL 160 Ca 0.23 -0.64 -0.01 0.00 0.82 0.00 0.00 66.70 67.10 1hxj h VAL 160 Cb 0.21 0.79 -0.00 0.00 -1.52 0.00 0.00 31.29 30.76 1hxj h VAL 160 CO -0.02 0.24 0.02 -0.08 0.02 0.00 0.00 177.57 177.75 1hxj h GLU 161 N 0.58 0.20 -0.73 1.57 4.81 -0.69 -0.67 114.58 119.66 1hxj h GLU 161 Ca 0.15 -0.06 -0.06 0.00 -0.13 0.00 0.00 59.36 59.26 1hxj h GLU 161 Cb 0.20 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.52 1hxj h GLU 161 CO -0.01 0.40 0.21 -0.44 -0.73 0.00 0.00 179.01 178.44 1hxj h ASP 162 N -0.03 1.08 -0.37 1.04 3.32 -0.79 -0.81 116.42 119.86 1hxj h ASP 162 Ca 0.04 -0.22 -0.10 0.00 0.02 0.00 0.00 57.03 56.76 1hxj h ASP 162 Cb 0.30 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.56 1hxj h ASP 162 CO 0.00 1.02 -0.18 0.22 -1.72 0.00 0.00 179.24 178.58 1hxj h TYR 163 N 1.09 0.89 -0.40 4.55 3.20 -0.92 -1.49 116.97 123.89 1hxj h TYR 163 Ca 0.23 -0.22 -0.01 0.00 3.14 0.00 0.00 58.73 61.87 1hxj h TYR 163 Cb 0.34 -0.21 -0.02 0.00 1.54 0.00 0.00 36.73 38.38 1hxj h TYR 163 CO 0.03 0.96 0.19 1.15 -1.64 0.00 0.00 178.16 178.84 1hxj h THR 164 N 0.57 1.14 -0.27 1.81 2.02 -0.85 0.10 112.91 117.43 1hxj h THR 164 Ca 0.08 -0.40 -0.16 0.00 0.77 0.00 0.00 66.41 66.71 1hxj h THR 164 Cb 0.72 0.64 -0.00 0.00 -1.74 0.00 0.00 68.15 67.77 1hxj h THR 164 CO 0.05 0.16 -0.46 0.22 0.37 0.00 0.00 175.52 175.86 1hxj h TYR 165 N 0.55 1.00 -0.63 3.16 3.20 -0.89 -1.01 116.97 122.34 1hxj h TYR 165 Ca 0.14 -0.35 -0.00 0.00 3.14 0.00 0.00 58.73 61.66 1hxj h TYR 165 Cb 0.07 -0.19 -0.03 0.00 1.54 0.00 0.00 36.73 38.11 1hxj h TYR 165 CO 0.00 1.15 0.38 0.35 -1.64 0.00 0.00 178.16 178.40 1hxj h PHE 166 N 0.56 0.84 -0.87 -3.82 3.57 -0.52 -0.68 116.94 116.01 1hxj h PHE 166 Ca 0.02 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.50 1hxj h PHE 166 Cb 1.07 -0.27 -0.04 0.00 2.79 0.00 0.00 35.95 39.49 1hxj h PHE 166 CO 0.08 0.58 0.50 0.00 -2.23 0.00 0.00 178.31 177.24 1hxj h ALA 167 N 1.19 1.11 -0.69 2.41 0.00 -0.70 -1.87 119.26 120.70 1hxj h ALA 167 Ca 0.23 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 1hxj h ALA 167 Cb -0.01 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.40 1hxj h ALA 167 CO -0.04 0.59 0.30 -0.22 0.00 0.00 0.00 179.25 179.88 1hxj h LYS 168 N 1.20 1.02 -0.89 0.00 3.64 -0.41 0.38 116.57 121.50 1hxj h LYS 168 Ca 0.31 -0.17 -0.01 0.00 -1.27 0.00 0.00 60.65 59.51 1hxj h LYS 168 Cb -0.01 -0.17 -0.04 0.00 -0.41 0.00 0.00 32.23 31.59 1hxj h LYS 168 CO -0.05 0.83 0.53 0.28 -2.27 0.00 0.00 179.45 178.76 1hxj h VAL 169 N 0.98 1.25 -0.04 2.00 2.07 -0.74 0.27 116.25 122.04 1hxj h VAL 169 Ca 0.23 -0.56 -0.01 0.00 0.82 0.00 0.00 66.70 67.18 1hxj h VAL 169 Cb 0.17 0.01 -0.00 0.00 -1.52 0.00 0.00 31.29 29.94 1hxj h VAL 169 CO -0.02 0.27 0.00 0.00 0.02 0.00 0.00 177.57 177.84 1hxj h PHE 171 N -0.19 0.44 -0.23 0.00 0.04 -0.62 0.20 116.94 116.58 1hxj h PHE 171 Ca 0.01 0.01 -0.00 0.00 2.80 0.00 0.00 57.97 60.79 1hxj h PHE 171 Cb 0.30 -0.15 -0.01 0.00 2.20 0.00 0.00 35.95 38.29 1hxj h PHE 171 CO 0.02 0.27 0.14 -0.44 -0.60 0.00 0.00 178.31 177.71 1hxj h ASP 172 N 0.48 0.28 0.68 2.17 3.32 -0.41 0.14 116.42 123.08 1hxj h ASP 172 Ca 0.14 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.15 1hxj h ASP 172 Cb -0.03 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.45 1hxj h ASP 172 CO -0.05 0.24 -0.62 0.59 -1.72 0.00 0.00 179.24 177.68 1hxj n ASN 173 N -4.90 0.60 0.00 6.45 3.02 -0.40 -4.44 115.26 115.60 1hxj n ASN 173 Ca -0.03 -0.04 0.00 0.00 -0.03 0.00 0.00 54.58 54.48 1hxj n ASN 173 Cb 0.05 0.26 0.00 0.00 -0.61 0.00 0.00 39.78 39.48 1hxj n ASN 173 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1hxj n PHE 174 N -1.86 0.00 0.03 3.10 3.72 0.69 -4.82 117.46 118.32 1hxj n PHE 174 Ca 0.04 0.00 0.20 0.00 -0.05 0.00 0.00 57.45 57.64 1hxj n PHE 174 Cb 0.40 0.00 0.72 0.00 -0.94 0.00 0.00 39.48 39.66 1hxj n PHE 174 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 1hxj h GLY 175 N 0.00 0.00 2.00 1.37 0.00 -0.68 0.85 103.07 106.61 1hxj h GLY 175 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.27 1hxj h GLY 175 CO 0.00 0.00 -0.27 1.29 0.00 0.00 0.00 176.54 177.56 1hxj h ASP 176 N 0.00 0.00 0.00 0.19 2.03 -1.85 -3.28 116.42 113.51 1hxj h ASP 176 Ca 0.23 0.00 -0.18 0.00 -0.73 0.00 0.00 57.03 56.35 1hxj h ASP 176 Cb 1.00 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 39.47 1hxj h ASP 176 CO -0.00 0.27 -1.79 0.29 -1.03 0.00 0.00 179.24 176.98 1hxj n LYS 177 N -3.99 1.67 -3.28 4.15 4.76 -0.43 -4.98 118.16 116.06 1hxj n LYS 177 Ca -0.02 -0.03 -0.39 0.00 -2.87 0.00 0.00 58.31 55.01 1hxj n LYS 177 Cb 0.34 -1.31 -0.06 0.00 -1.84 0.00 0.00 35.03 32.15 1hxj n LYS 177 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1hxj s VAL 178 N -2.43 5.15 -0.49 -0.18 1.01 0.16 -4.88 120.40 118.75 1hxj s VAL 178 Ca -0.06 0.95 0.04 0.00 0.00 0.00 0.00 61.98 62.92 1hxj s VAL 178 Cb 0.05 -3.83 0.07 0.00 0.00 0.00 0.00 36.38 32.66 1hxj s VAL 178 CO 0.51 0.25 0.80 0.29 0.00 0.00 0.00 175.10 176.95 1hxj n LYS 179 N 4.25 0.80 -3.66 2.72 5.02 -1.26 -4.67 118.16 121.37 1hxj n LYS 179 Ca -0.06 -1.10 -0.27 0.00 -2.02 0.00 0.00 58.31 54.86 1hxj n LYS 179 Cb 0.51 -1.09 -0.17 0.00 -0.02 0.00 0.00 35.03 34.26 1hxj n LYS 179 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1hxj s ASN 180 N -0.59 2.68 0.01 4.39 0.01 -1.25 0.05 114.94 120.24 1hxj s ASN 180 Ca 0.07 -0.76 0.06 0.00 -0.71 0.00 0.00 52.86 51.52 1hxj s ASN 180 Cb 0.04 -0.41 -0.03 0.00 0.41 0.00 0.00 41.25 41.26 1hxj s ASN 180 CO 0.06 -0.34 -0.18 0.26 -1.51 0.00 0.00 177.10 175.39 1hxj s TRP 181 N 2.00 2.56 -0.18 2.20 0.52 0.23 -1.65 118.94 124.62 1hxj s TRP 181 Ca 0.01 -0.26 -0.00 0.00 0.02 0.00 0.00 56.10 55.87 1hxj s TRP 181 Cb -0.16 -1.51 0.04 0.00 -1.15 0.00 0.00 33.47 30.69 1hxj s TRP 181 CO -0.10 0.20 -0.06 -0.51 0.02 0.00 0.00 176.95 176.49 1hxj s LEU 182 N -1.15 1.82 0.03 2.99 1.43 0.09 -0.65 118.68 123.24 1hxj s LEU 182 Ca 0.13 -0.75 -0.24 0.00 -1.03 0.00 0.00 54.13 52.24 1hxj s LEU 182 Cb -0.10 -1.00 -0.18 0.00 0.03 0.00 0.00 46.19 44.94 1hxj s LEU 182 CO 0.03 -0.18 1.50 0.71 0.23 0.00 0.00 176.35 178.64 1hxj h THR 183 N 6.40 1.20 -3.98 5.49 1.35 -1.13 0.39 112.91 122.63 1hxj h THR 183 Ca -0.25 -0.59 -0.37 0.00 -0.55 0.00 0.00 66.41 64.66 1hxj h THR 183 Cb 1.11 1.59 -0.23 0.00 -1.73 0.00 0.00 68.15 68.89 1hxj h THR 183 CO 0.42 0.15 -0.77 -0.36 -0.25 0.00 0.00 175.52 174.72 1hxj s PHE 184 N -5.20 0.97 -0.18 4.73 0.40 -1.26 -1.88 117.98 115.57 1hxj s PHE 184 Ca -0.14 -0.40 -0.04 0.00 -0.60 0.00 0.00 56.93 55.74 1hxj s PHE 184 Cb 0.04 -0.57 -0.02 0.00 0.51 0.00 0.00 43.02 42.97 1hxj s PHE 184 CO 0.67 -0.00 -0.03 1.21 0.70 0.00 0.00 175.22 177.77 1hxj s ASN 185 N -1.35 4.75 -0.92 1.36 2.47 -0.93 -1.72 114.94 118.61 1hxj s ASN 185 Ca -0.03 -0.18 -0.10 0.00 0.42 0.00 0.00 52.86 52.97 1hxj s ASN 185 Cb -0.09 -1.79 0.01 0.00 -1.45 0.00 0.00 41.25 37.94 1hxj s ASN 185 CO 0.01 0.12 0.61 -0.62 -3.72 0.00 0.00 177.10 173.50 1hxj n GLU 186 N 3.88 -1.15 -0.18 0.43 1.02 -0.33 -4.77 120.64 119.53 1hxj n GLU 186 Ca -0.17 0.53 0.03 0.00 -0.02 0.00 0.00 57.16 57.53 1hxj n GLU 186 Cb 0.52 -2.22 0.30 0.00 -0.02 0.00 0.00 31.44 30.02 1hxj n GLU 186 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1hxj h PRO 187 N -0.92 0.85 -0.46 3.49 0.13 -1.87 -1.31 132.00 131.91 1hxj h PRO 187 Ca -0.66 -0.05 -0.07 0.00 -0.87 0.00 0.00 66.00 64.36 1hxj h PRO 187 Cb 1.38 -0.19 -0.02 0.00 0.13 0.00 0.00 31.00 32.30 1hxj h PRO 187 CO 0.40 0.56 0.02 0.37 -0.23 0.00 0.00 178.00 179.13 1hxj h GLN 188 N 0.88 0.79 -0.22 0.86 -0.00 -1.89 -1.25 115.11 114.27 1hxj h GLN 188 Ca 0.28 -0.24 -0.01 0.00 -0.00 0.00 0.00 58.65 58.68 1hxj h GLN 188 Cb 0.03 -0.08 -0.01 0.00 0.00 0.00 0.00 27.48 27.42 1hxj h GLN 188 CO -0.08 0.84 0.09 1.15 0.00 0.00 0.00 178.83 180.83 1hxj h THR 189 N 0.64 1.17 0.17 2.39 2.02 -1.84 -1.14 112.91 116.32 1hxj h THR 189 Ca 0.13 -0.50 0.00 0.00 0.77 0.00 0.00 66.41 66.82 1hxj h THR 189 Cb 0.46 1.08 -0.01 0.00 -1.74 0.00 0.00 68.15 67.94 1hxj h THR 189 CO 0.02 0.16 -0.17 0.15 0.37 0.00 0.00 175.52 176.06 1hxj h PHE 190 N 0.21 -0.43 -0.05 3.16 3.57 -1.13 -0.58 116.94 121.69 1hxj h PHE 190 Ca 0.08 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.57 1hxj h PHE 190 Cb 0.17 0.17 -0.00 0.00 2.79 0.00 0.00 35.95 39.08 1hxj h PHE 190 CO -0.01 -0.25 0.01 1.79 -2.23 0.00 0.00 178.31 177.62 1hxj h THR 191 N -0.36 1.20 0.10 4.41 1.35 -1.21 -1.22 112.91 117.18 1hxj h THR 191 Ca 0.00 -0.61 -0.01 0.00 -0.55 0.00 0.00 66.41 65.24 1hxj h THR 191 Cb 0.34 1.52 0.00 0.00 -1.73 0.00 0.00 68.15 68.28 1hxj h THR 191 CO -0.04 0.17 -0.05 0.28 -0.25 0.00 0.00 175.52 175.63 1hxj h SER 192 N -0.15 -0.12 -0.36 5.36 0.02 -1.21 -1.38 113.55 115.71 1hxj h SER 192 Ca 0.02 -0.12 -0.12 0.00 -0.84 0.00 0.00 61.79 60.72 1hxj h SER 192 Cb 0.26 0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.81 1hxj h SER 192 CO 0.00 0.05 -0.21 -0.26 -1.14 0.00 0.00 176.83 175.28 1hxj h PHE 193 N -0.28 0.97 0.06 3.45 -1.00 -1.18 0.73 116.94 119.69 1hxj h PHE 193 Ca -0.01 -0.22 -0.23 0.00 2.81 0.00 0.00 57.97 60.31 1hxj h PHE 193 Cb 0.23 -0.23 -0.01 0.00 3.61 0.00 0.00 35.95 39.55 1hxj h PHE 193 CO -0.02 0.98 -1.06 0.77 -1.61 0.00 0.00 178.31 177.36 1hxj h SER 194 N 0.74 0.29 0.00 2.17 0.02 -1.24 0.22 113.55 115.76 1hxj h SER 194 Ca 0.10 -0.28 0.00 0.00 -0.84 0.00 0.00 61.79 60.77 1hxj h SER 194 Cb 0.74 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.19 1hxj h SER 194 CO 0.06 1.17 0.00 -1.22 -1.14 0.00 0.00 176.83 175.70 1hxj n TYR 195 N -3.54 0.00 0.00 3.45 4.01 -0.52 -2.07 117.16 118.48 1hxj n TYR 195 Ca -0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.69 1hxj n TYR 195 Cb 0.93 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.96 1hxj n TYR 195 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1hxj n GLY 196 N 0.06 -0.44 0.17 2.72 0.00 0.24 -3.95 105.19 104.00 1hxj n GLY 196 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 1hxj n GLY 196 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1hxj h THR 197 N 0.00 0.01 -0.49 2.61 1.35 -1.35 -3.41 112.91 111.64 1hxj h THR 197 Ca 0.00 -1.01 -0.20 0.00 -0.55 0.00 0.00 66.41 64.65 1hxj h THR 197 Cb 0.00 1.78 -0.08 0.00 -1.73 0.00 0.00 68.15 68.13 1hxj h THR 197 CO 0.00 0.01 -0.18 0.61 -0.25 0.00 0.00 175.52 175.70 1hxj n GLY 198 N 1.14 1.09 0.12 5.82 0.00 0.09 -4.69 105.19 108.75 1hxj n GLY 198 Ca 0.02 -0.59 0.13 0.00 0.00 0.00 0.00 46.02 45.58 1hxj n GLY 198 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1hxj h VAL 199 N 0.00 0.00 -3.00 1.61 -1.51 -0.98 -3.38 116.25 108.99 1hxj h VAL 199 Ca -0.20 -0.42 -0.62 0.00 -1.23 0.00 0.00 66.70 64.23 1hxj h VAL 199 Cb 0.65 1.34 -0.12 0.00 -2.13 0.00 0.00 31.29 31.03 1hxj h VAL 199 CO 0.29 0.00 -0.69 -0.36 -1.23 0.00 0.00 177.57 175.58 1hxj s PHE 200 N -3.18 2.78 0.49 5.19 0.40 -0.76 -4.67 117.98 118.24 1hxj s PHE 200 Ca 0.08 -0.16 -0.23 0.00 -0.60 0.00 0.00 56.93 56.03 1hxj s PHE 200 Cb 0.11 -1.37 -0.07 0.00 0.51 0.00 0.00 43.02 42.20 1hxj s PHE 200 CO 0.54 0.50 1.20 0.00 0.70 0.00 0.00 175.22 178.17 1hxj n ALA 201 N 0.04 1.03 1.27 5.36 0.00 -1.26 -0.10 120.51 126.86 1hxj n ALA 201 Ca -0.10 0.17 0.12 0.00 0.00 0.00 0.00 53.44 53.62 1hxj n ALA 201 Cb 0.55 -2.24 0.64 0.00 0.00 0.00 0.00 19.45 18.40 1hxj n ALA 201 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1hxj n PRO 202 N -0.45 0.50 -1.94 0.00 -0.04 -1.26 -4.67 135.00 127.14 1hxj n PRO 202 Ca 0.09 0.04 0.00 0.00 -0.04 0.00 0.00 63.50 63.59 1hxj n PRO 202 Cb 0.42 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.38 1hxj n PRO 202 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1hxj n GLY 203 N 0.64 0.82 3.92 0.55 0.00 0.86 -4.73 105.19 107.25 1hxj n GLY 203 Ca 0.14 -0.51 -0.29 0.00 0.00 0.00 0.00 46.02 45.36 1hxj n GLY 203 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1hxj s ARG 204 N -3.84 3.53 0.27 1.61 0.52 -0.88 -0.97 118.95 119.20 1hxj s ARG 204 Ca 0.00 -0.29 -0.20 0.00 -0.52 0.00 0.00 55.73 54.71 1hxj s ARG 204 Cb 0.00 -2.88 0.05 0.00 0.52 0.00 0.00 34.95 32.64 1hxj s ARG 204 CO 0.00 0.46 0.85 0.00 0.02 0.00 0.00 175.30 176.62 1hxj s SER 206 N -3.05 6.34 0.28 0.00 0.01 -1.26 0.45 113.70 116.47 1hxj s SER 206 Ca 0.14 2.22 -0.29 0.00 1.31 0.00 0.00 55.95 59.33 1hxj s SER 206 Cb -0.04 -2.60 -0.14 0.00 0.21 0.00 0.00 66.02 63.46 1hxj s SER 206 CO 0.07 -0.80 1.22 -2.65 0.41 0.00 0.00 173.24 171.49 1hxj n PRO 207 N -0.39 1.74 -0.27 12.44 -0.02 -1.10 -1.44 135.00 145.96 1hxj n PRO 207 Ca 0.07 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 1hxj n PRO 207 Cb 0.49 -2.14 0.00 0.00 -0.02 0.00 0.00 33.50 31.83 1hxj n PRO 207 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1hxj n GLY 208 N 1.42 0.65 3.66 -1.23 0.00 -1.26 -5.06 105.19 103.36 1hxj n GLY 208 Ca 0.09 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.83 1hxj n GLY 208 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1hxj s LEU 209 N 0.00 3.31 -0.73 0.99 1.43 -0.52 -5.08 118.68 118.08 1hxj s LEU 209 Ca 0.00 -0.34 -0.22 0.00 -1.03 0.00 0.00 54.13 52.54 1hxj s LEU 209 Cb 0.00 -2.01 0.08 0.00 0.03 0.00 0.00 46.19 44.30 1hxj s LEU 209 CO 0.00 0.12 1.01 -0.62 0.23 0.00 0.00 176.35 177.09 1hxj s ASP 210 N -2.70 6.29 0.20 2.29 2.15 -1.26 -4.64 116.67 119.00 1hxj s ASP 210 Ca 0.26 -1.25 -0.22 0.00 0.43 0.00 0.00 52.55 51.77 1hxj s ASP 210 Cb -0.10 -2.42 0.05 0.00 -0.30 0.00 0.00 42.92 40.16 1hxj s ASP 210 CO 0.18 -1.36 0.64 0.00 -0.17 0.00 0.00 175.17 174.46 1hxj h ALA 212 N 2.00 1.29 -2.85 0.00 0.00 -1.80 -3.30 119.26 114.60 1hxj h ALA 212 Ca -0.29 0.19 -0.61 0.00 0.00 0.00 0.00 54.91 54.20 1hxj h ALA 212 Cb 1.29 0.25 -0.40 0.00 0.00 0.00 0.00 17.79 18.92 1hxj h ALA 212 CO 0.33 -0.41 -0.73 0.71 0.00 0.00 0.00 179.25 179.15 1hxj s TYR 213 N -5.93 2.49 0.00 0.00 2.02 -0.14 -4.98 117.35 110.81 1hxj s TYR 213 Ca -0.12 -2.85 -0.02 0.00 -0.37 0.00 0.00 57.07 53.71 1hxj s TYR 213 Cb 0.25 -2.00 -0.08 0.00 -0.40 0.00 0.00 41.96 39.73 1hxj s TYR 213 CO 0.77 -0.68 2.09 -0.35 -1.57 0.00 0.00 175.55 175.81 1hxj n PRO 214 N 2.56 1.08 -0.33 -1.71 -0.04 -1.25 -2.24 135.00 133.08 1hxj n PRO 214 Ca 0.20 -0.28 0.07 0.00 -0.04 0.00 0.00 63.50 63.46 1hxj n PRO 214 Cb 0.39 -1.38 0.18 0.00 -0.04 0.00 0.00 33.50 32.64 1hxj n PRO 214 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1hxj n THR 215 N 1.95 2.08 -1.82 0.52 -2.24 -1.14 -2.70 114.28 110.94 1hxj n THR 215 Ca 0.12 -2.56 0.00 0.00 -2.27 0.00 0.00 64.05 59.34 1hxj n THR 215 Cb 0.52 -0.25 0.00 0.00 -2.10 0.00 0.00 70.33 68.50 1hxj n THR 215 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1hxj n GLY 216 N -1.22 4.19 2.71 3.38 0.00 0.17 -4.91 105.19 109.51 1hxj n GLY 216 Ca 0.19 -1.88 -0.20 0.00 0.00 0.00 0.00 46.02 44.13 1hxj n GLY 216 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1hxj s ASN 217 N 0.23 2.01 0.00 1.61 3.84 -1.25 -3.85 114.94 117.52 1hxj s ASN 217 Ca 0.00 -0.76 0.10 0.00 0.21 0.00 0.00 52.86 52.41 1hxj s ASN 217 Cb 0.00 0.30 0.50 0.00 -0.55 0.00 0.00 41.25 41.50 1hxj s ASN 217 CO 0.00 -0.39 1.19 -1.20 -2.79 0.00 0.00 177.10 173.92 1hxj n SER 218 N 5.30 0.00 -0.39 -4.21 7.64 -1.25 -0.49 113.62 120.22 1hxj n SER 218 Ca -0.04 0.13 0.07 0.00 1.01 0.00 0.00 58.87 60.05 1hxj n SER 218 Cb 0.46 -0.28 0.01 0.00 -1.01 0.00 0.00 64.21 63.40 1hxj n SER 218 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1hxj n LEU 219 N -1.28 1.67 0.00 -3.43 4.77 -1.26 -0.87 117.00 116.60 1hxj n LEU 219 Ca 0.05 -0.83 0.00 0.00 -0.03 0.00 0.00 56.01 55.20 1hxj n LEU 219 Cb 0.08 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 1hxj n LEU 219 CO 0.07 0.32 -0.20 0.52 -1.33 0.00 0.00 177.39 176.78 1hxj n VAL 220 N 0.09 0.00 -0.36 4.08 0.31 -0.76 -4.81 118.33 116.88 1hxj n VAL 220 Ca 0.07 0.00 0.04 0.00 -0.01 0.00 0.00 64.34 64.43 1hxj n VAL 220 Cb 0.31 -0.65 0.20 0.00 -0.91 0.00 0.00 33.84 32.79 1hxj n VAL 220 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1hxj h GLU 221 N 0.00 1.09 -0.79 5.55 5.08 -1.09 0.25 114.58 124.68 1hxj h GLU 221 Ca 0.00 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.27 1hxj h GLU 221 Cb 0.39 -0.25 -0.04 0.00 0.50 0.00 0.00 28.75 29.36 1hxj h GLU 221 CO 0.00 0.72 0.40 -1.35 -1.00 0.00 0.00 179.01 177.78 1hxj h PRO 222 N 1.13 1.12 -0.18 2.33 0.11 -1.78 -0.64 132.00 134.09 1hxj h PRO 222 Ca 0.44 -0.15 -0.19 0.00 0.11 0.00 0.00 66.00 66.22 1hxj h PRO 222 Cb 0.24 -0.21 -0.00 0.00 0.11 0.00 0.00 31.00 31.14 1hxj h PRO 222 CO -0.19 0.85 -0.63 1.88 -0.21 0.00 0.00 178.00 179.69 1hxj h TYR 223 N 1.11 0.85 -0.23 0.65 0.05 -1.60 0.03 116.97 117.84 1hxj h TYR 223 Ca 0.27 -0.33 -0.01 0.00 0.05 0.00 0.00 58.73 58.71 1hxj h TYR 223 Cb 0.08 -0.15 -0.01 0.00 1.01 0.00 0.00 36.73 37.66 1hxj h TYR 223 CO 0.01 1.12 0.09 1.15 -1.05 0.00 0.00 178.16 179.48 1hxj h THR 224 N 0.49 1.17 -0.25 -2.88 2.02 -0.71 0.14 112.91 112.88 1hxj h THR 224 Ca -0.01 -0.51 -0.01 0.00 0.77 0.00 0.00 66.41 66.65 1hxj h THR 224 Cb 1.22 1.07 -0.01 0.00 -1.74 0.00 0.00 68.15 68.69 1hxj h THR 224 CO 0.12 0.17 0.13 0.00 0.37 0.00 0.00 175.52 176.31 1hxj h ALA 225 N 0.93 0.32 -0.47 6.16 0.00 -1.08 -1.20 119.26 123.93 1hxj h ALA 225 Ca 0.08 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1hxj h ALA 225 Cb 0.18 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1hxj h ALA 225 CO -0.01 -0.13 0.17 0.78 0.00 0.00 0.00 179.25 180.07 1hxj h GLY 226 N 0.28 0.72 0.91 0.00 0.00 -0.82 -0.02 103.07 104.13 1hxj h GLY 226 Ca 0.09 -0.36 -0.07 0.00 0.00 0.00 0.00 47.33 46.99 1hxj h GLY 226 CO -0.01 0.34 -0.06 0.84 0.00 0.00 0.00 176.54 177.65 1hxj h HIS 227 N 0.67 0.68 -0.70 5.60 2.76 -0.36 -1.95 115.15 121.85 1hxj h HIS 227 Ca 0.16 -0.14 -0.06 0.00 -2.20 0.00 0.00 60.37 58.13 1hxj h HIS 227 Cb 0.16 -0.17 -0.03 0.00 1.55 0.00 0.00 27.41 28.92 1hxj h HIS 227 CO 0.01 0.78 0.20 -0.91 -1.30 0.00 0.00 177.93 176.71 1hxj h ASN 228 N 0.39 1.02 -0.77 3.26 2.35 -0.77 -1.84 115.58 119.22 1hxj h ASN 228 Ca 0.08 -0.19 0.02 0.00 -0.55 0.00 0.00 56.30 55.66 1hxj h ASN 228 Cb 0.54 -0.27 -0.04 0.00 0.05 0.00 0.00 38.32 38.61 1hxj h ASN 228 CO 0.03 0.96 0.50 0.40 -1.65 0.00 0.00 177.43 177.66 1hxj h ILE 229 N 1.04 1.15 -0.53 2.81 2.04 -0.81 0.11 117.51 123.32 1hxj h ILE 229 Ca 0.22 -0.34 -0.10 0.00 1.00 0.00 0.00 64.86 65.64 1hxj h ILE 229 Cb 0.31 0.07 -0.02 0.00 -0.74 0.00 0.00 36.82 36.45 1hxj h ILE 229 CO -0.00 0.18 -0.06 -0.07 0.00 0.00 0.00 178.15 178.20 1hxj h LEU 230 N 0.99 0.97 -0.70 1.44 3.38 -0.98 0.10 115.31 120.51 1hxj h LEU 230 Ca 0.30 -0.33 -0.08 0.00 0.09 0.00 0.00 57.88 57.86 1hxj h LEU 230 Cb -0.05 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.41 1hxj h LEU 230 CO -0.09 1.07 0.12 -0.07 0.09 0.00 0.00 178.44 179.56 1hxj h LEU 231 N 0.85 1.07 -0.44 1.67 3.38 -0.92 -0.06 115.31 120.85 1hxj h LEU 231 Ca 0.14 -0.25 -0.04 0.00 0.09 0.00 0.00 57.88 57.82 1hxj h LEU 231 Cb 0.61 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 1hxj h LEU 231 CO 0.04 1.05 0.11 0.00 0.09 0.00 0.00 178.44 179.73 1hxj h ALA 232 N 1.07 0.58 -0.14 1.53 0.00 -0.49 -1.78 119.26 120.03 1hxj h ALA 232 Ca 0.21 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1hxj h ALA 232 Cb 0.43 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1hxj h ALA 232 CO 0.01 0.26 0.08 1.25 0.00 0.00 0.00 179.25 180.85 1hxj h HIS 233 N 0.58 0.19 -0.64 0.00 -0.00 -0.49 -1.19 115.15 113.60 1hxj h HIS 233 Ca 0.14 -0.00 0.07 0.00 -0.00 0.00 0.00 60.37 60.58 1hxj h HIS 233 Cb 0.31 -0.06 -0.06 0.00 -0.00 0.00 0.00 27.41 27.60 1hxj h HIS 233 CO 0.02 0.19 0.32 0.00 -0.00 0.00 0.00 177.93 178.46 1hxj h ALA 234 N 0.98 0.85 -0.26 5.26 0.00 -0.89 -0.17 119.26 125.04 1hxj h ALA 234 Ca 0.05 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1hxj h ALA 234 Cb 0.06 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1hxj h ALA 234 CO -0.01 -0.04 -0.02 0.93 0.00 0.00 0.00 179.25 180.11 1hxj h GLU 235 N 0.58 0.47 -0.69 0.00 4.39 -1.14 -1.66 114.58 116.52 1hxj h GLU 235 Ca 0.30 -0.16 -0.02 0.00 0.34 0.00 0.00 59.36 59.82 1hxj h GLU 235 Cb 0.25 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 28.84 1hxj h GLU 235 CO -0.22 0.66 0.36 0.00 -1.16 0.00 0.00 179.01 178.65 1hxj h ALA 236 N 0.79 0.89 -0.64 3.43 0.00 -0.87 -0.67 119.26 122.19 1hxj h ALA 236 Ca 0.07 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 1hxj h ALA 236 Cb 0.46 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 1hxj h ALA 236 CO 0.02 0.43 0.17 0.28 0.00 0.00 0.00 179.25 180.15 1hxj h VAL 237 N 0.96 1.25 -0.07 0.00 2.07 -0.99 0.60 116.25 120.08 1hxj h VAL 237 Ca 0.24 -0.91 0.00 0.00 0.82 0.00 0.00 66.70 66.86 1hxj h VAL 237 Cb 0.07 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 1hxj h VAL 237 CO -0.04 0.34 0.03 -0.78 0.02 0.00 0.00 177.57 177.14 1hxj h ASP 238 N 0.94 0.03 -0.36 0.57 3.58 -0.84 -0.82 116.42 119.53 1hxj h ASP 238 Ca 0.20 0.01 0.04 0.00 0.42 0.00 0.00 57.03 57.70 1hxj h ASP 238 Cb 0.34 -0.00 -0.04 0.00 1.72 0.00 0.00 39.33 41.35 1hxj h ASP 238 CO -0.00 0.03 0.12 0.25 -2.88 0.00 0.00 179.24 176.76 1hxj h LEU 239 N 0.06 0.11 0.04 2.28 5.85 -0.86 -1.79 115.31 121.01 1hxj h LEU 239 Ca 0.03 0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.80 1hxj h LEU 239 Cb 0.01 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.06 1hxj h LEU 239 CO -0.03 0.10 -0.10 0.22 -0.34 0.00 0.00 178.44 178.30 1hxj h TYR 240 N 0.26 -0.25 -0.69 1.25 3.20 -0.48 -2.38 116.97 117.87 1hxj h TYR 240 Ca 0.16 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.04 1hxj h TYR 240 Cb 0.15 0.11 -0.03 0.00 1.54 0.00 0.00 36.73 38.49 1hxj h TYR 240 CO -0.15 -0.15 0.42 -0.91 -1.64 0.00 0.00 178.16 175.73 1hxj h ASN 241 N -0.19 0.82 -0.12 -2.11 2.35 -0.98 0.36 115.58 115.71 1hxj h ASN 241 Ca 0.02 -0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 1hxj h ASN 241 Cb 0.21 -0.21 0.00 0.00 0.05 0.00 0.00 38.32 38.38 1hxj h ASN 241 CO -0.07 0.63 0.00 0.29 -1.65 0.00 0.00 177.43 176.63 1hxj n LYS 242 N -4.40 1.49 0.00 0.81 5.02 -0.69 -4.27 118.16 116.11 1hxj n LYS 242 Ca 0.07 -0.74 0.00 0.00 -2.02 0.00 0.00 58.31 55.62 1hxj n LYS 242 Cb 0.06 -1.34 0.00 0.00 -0.02 0.00 0.00 35.03 33.73 1hxj n LYS 242 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1hxj n HIS 243 N -0.02 0.00 0.00 2.13 8.25 -0.92 -5.00 115.22 119.66 1hxj n HIS 243 Ca 0.15 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.61 1hxj n HIS 243 Cb 0.24 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.35 1hxj n HIS 243 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1hxj n TYR 244 N 0.00 0.00 -1.67 4.41 4.01 0.73 -5.05 117.16 119.58 1hxj n TYR 244 Ca 0.00 0.00 -0.47 0.00 -0.16 0.00 0.00 57.90 57.27 1hxj n TYR 244 Cb 0.00 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 38.99 1hxj n TYR 244 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 1hxj n LYS 245 N -0.67 2.18 -4.44 -0.72 3.00 0.93 -4.99 118.16 113.45 1hxj n LYS 245 Ca 0.00 0.79 -0.26 0.00 -0.00 0.00 0.00 58.31 58.84 1hxj n LYS 245 Cb 0.07 -2.60 -0.11 0.00 0.00 0.00 0.00 35.03 32.39 1hxj n LYS 245 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 1hxj s ARG 246 N 2.45 1.58 0.48 1.64 0.52 -1.26 -4.99 118.95 119.36 1hxj s ARG 246 Ca 0.85 -1.60 0.27 0.00 -0.52 0.00 0.00 55.73 54.73 1hxj s ARG 246 Cb -0.68 -1.83 1.33 0.00 0.52 0.00 0.00 34.95 34.30 1hxj s ARG 246 CO 0.44 0.38 1.82 -0.44 0.02 0.00 0.00 175.30 177.53 1hxj h ASP 247 N 2.90 0.19 -0.69 0.23 5.19 -2.03 0.84 116.42 123.05 1hxj h ASP 247 Ca -0.44 0.03 0.00 0.00 -0.62 0.00 0.00 57.03 56.00 1hxj h ASP 247 Cb 1.22 -0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.73 1hxj h ASP 247 CO 0.52 0.05 0.00 -0.90 -3.12 0.00 0.00 179.24 175.79 1hxj n ASP 248 N -4.39 3.76 -4.68 6.45 3.85 -1.26 -4.95 116.55 115.34 1hxj n ASP 248 Ca 0.23 -2.00 -0.26 0.00 -0.71 0.00 0.00 54.79 52.05 1hxj n ASP 248 Cb 0.98 -0.46 -0.07 0.00 -1.35 0.00 0.00 41.12 40.22 1hxj n ASP 248 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.20 176.61 1hxj s THR 249 N -1.09 3.76 0.02 2.12 -4.23 0.29 -4.90 115.64 111.61 1hxj s THR 249 Ca 0.47 -1.47 -0.07 0.00 -1.18 0.00 0.00 61.69 59.44 1hxj s THR 249 Cb 0.24 -2.92 -0.00 0.00 1.34 0.00 0.00 72.50 71.16 1hxj s THR 249 CO 0.32 -0.16 0.12 -0.13 -0.54 0.00 0.00 174.62 174.23 1hxj s ARG 250 N -3.10 0.55 0.02 3.99 0.52 0.11 -4.61 118.95 116.43 1hxj s ARG 250 Ca 0.28 -0.59 0.00 0.00 -0.52 0.00 0.00 55.73 54.91 1hxj s ARG 250 Cb -0.09 0.22 -0.02 0.00 0.52 0.00 0.00 34.95 35.58 1hxj s ARG 250 CO 0.19 -0.14 -0.03 -1.50 0.02 0.00 0.00 175.30 173.84 1hxj s ILE 251 N -2.05 0.16 0.00 1.52 2.07 -1.26 -0.61 121.20 121.03 1hxj s ILE 251 Ca -0.09 -0.95 0.00 0.00 -1.41 0.00 0.00 60.65 58.20 1hxj s ILE 251 Cb -0.04 -0.33 0.00 0.00 0.13 0.00 0.00 42.46 42.22 1hxj s ILE 251 CO -0.02 -0.50 0.00 0.61 -1.91 0.00 0.00 174.94 173.12 1hxj n GLY 252 N 1.55 2.12 3.77 1.50 0.00 0.18 -0.30 105.19 114.01 1hxj n GLY 252 Ca -0.24 -0.13 -0.08 0.00 0.00 0.00 0.00 46.02 45.58 1hxj n GLY 252 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1hxj s LEU 253 N 0.00 -0.32 -0.08 0.99 2.34 -1.26 -0.59 118.68 119.76 1hxj s LEU 253 Ca 0.00 -0.48 0.04 0.00 0.06 0.00 0.00 54.13 53.75 1hxj s LEU 253 Cb 0.00 2.70 -0.01 0.00 -0.56 0.00 0.00 46.19 48.32 1hxj s LEU 253 CO 0.00 -1.27 -0.20 0.00 -1.06 0.00 0.00 176.35 173.82 1hxj s ALA 254 N -3.88 2.36 -0.08 1.48 0.00 -0.70 -0.58 121.76 120.35 1hxj s ALA 254 Ca 0.09 -0.99 -0.01 0.00 0.00 0.00 0.00 51.96 51.06 1hxj s ALA 254 Cb -0.05 -0.87 -0.03 0.00 0.00 0.00 0.00 23.12 22.17 1hxj s ALA 254 CO 0.03 0.38 -0.04 -0.06 0.00 0.00 0.00 175.76 176.07 1hxj s PHE 255 N -0.05 3.03 0.25 0.00 0.40 0.64 -1.18 117.98 121.06 1hxj s PHE 255 Ca -0.05 0.05 -0.30 0.00 -0.60 0.00 0.00 56.93 56.03 1hxj s PHE 255 Cb -0.14 -1.76 -0.09 0.00 0.51 0.00 0.00 43.02 41.53 1hxj s PHE 255 CO 0.05 0.35 0.95 0.16 0.70 0.00 0.00 175.22 177.42 1hxj s ASP 256 N -0.72 7.60 -0.15 1.36 -4.77 -1.26 -0.71 116.67 118.03 1hxj s ASP 256 Ca 0.11 1.97 -0.07 0.00 -3.30 0.00 0.00 52.55 51.26 1hxj s ASP 256 Cb -0.11 -2.61 0.06 0.00 -1.09 0.00 0.00 42.92 39.17 1hxj s ASP 256 CO 0.02 0.12 0.34 -0.69 0.70 0.00 0.00 175.17 175.66 1hxj s VAL 257 N -1.20 -0.17 -0.13 2.11 1.01 -0.73 -4.64 120.40 116.64 1hxj s VAL 257 Ca 0.42 0.15 -0.03 0.00 0.00 0.00 0.00 61.98 62.51 1hxj s VAL 257 Cb -0.26 -0.52 -0.03 0.00 0.00 0.00 0.00 36.38 35.56 1hxj s VAL 257 CO 0.32 0.06 -0.01 -0.04 0.00 0.00 0.00 175.10 175.44 1hxj s MET 258 N 1.68 3.45 0.74 2.72 -1.94 -1.26 -4.25 119.30 120.43 1hxj s MET 258 Ca -0.07 -0.45 -0.14 0.00 -1.71 0.00 0.00 55.69 53.32 1hxj s MET 258 Cb -0.10 -2.91 0.04 0.00 2.01 0.00 0.00 34.83 33.87 1hxj s MET 258 CO -0.11 0.43 1.18 0.20 -0.01 0.00 0.00 175.02 176.71 1hxj s GLY 259 N -0.12 2.24 -0.08 -0.03 0.00 -0.61 -4.82 107.32 103.90 1hxj s GLY 259 Ca 0.04 0.79 0.02 0.00 0.00 0.00 0.00 44.72 45.57 1hxj s GLY 259 CO 0.02 1.19 -0.13 0.50 0.00 0.00 0.00 173.10 174.68 1hxj s ARG 260 N -4.03 1.83 -0.02 2.90 1.81 -1.26 -0.77 118.95 119.41 1hxj s ARG 260 Ca 0.72 -0.44 0.05 0.00 -1.72 0.00 0.00 55.73 54.34 1hxj s ARG 260 Cb -0.27 -1.54 -0.01 0.00 -0.45 0.00 0.00 34.95 32.68 1hxj s ARG 260 CO 0.46 -0.01 -0.18 0.08 -0.68 0.00 0.00 175.30 174.98 1hxj s VAL 261 N 0.80 1.39 0.27 3.52 1.01 -0.16 -4.96 120.40 122.27 1hxj s VAL 261 Ca -0.12 -0.75 -0.31 0.00 0.00 0.00 0.00 61.98 60.81 1hxj s VAL 261 Cb -0.15 -1.16 -0.12 0.00 0.00 0.00 0.00 36.38 34.95 1hxj s VAL 261 CO 0.02 0.40 1.63 -2.84 0.00 0.00 0.00 175.10 174.31 1hxj s PRO 262 N -0.35 4.12 0.07 2.72 0.02 -1.26 0.60 135.00 140.91 1hxj s PRO 262 Ca 0.05 2.59 -0.30 0.00 0.02 0.00 0.00 61.00 63.37 1hxj s PRO 262 Cb -0.07 -3.04 -0.15 0.00 0.02 0.00 0.00 34.50 31.26 1hxj s PRO 262 CO -0.00 -0.67 1.46 -0.92 -0.33 0.00 0.00 177.00 176.54 1hxj h TYR 263 N 5.38 -1.15 -2.50 6.54 3.20 -1.01 -3.43 116.97 124.00 1hxj h TYR 263 Ca -0.46 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.41 1hxj h TYR 263 Cb 1.21 0.44 0.00 0.00 1.54 0.00 0.00 36.73 39.93 1hxj h TYR 263 CO 0.60 -0.58 0.00 0.41 -1.64 0.00 0.00 178.16 176.95 1hxj n GLY 264 N -1.48 5.39 0.03 1.82 0.00 -1.26 -4.33 105.19 105.35 1hxj n GLY 264 Ca -0.11 -1.98 0.12 0.00 0.00 0.00 0.00 46.02 44.04 1hxj n GLY 264 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1hxj n THR 265 N 0.00 0.14 -1.76 2.61 -2.24 -1.26 -4.85 114.28 106.92 1hxj n THR 265 Ca 0.00 -0.15 -0.40 0.00 -2.27 0.00 0.00 64.05 61.23 1hxj n THR 265 Cb 0.00 0.20 0.02 0.00 -2.10 0.00 0.00 70.33 68.46 1hxj n THR 265 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1hxj n SER 266 N -1.81 3.24 0.28 3.42 2.88 -1.26 -4.86 113.62 115.51 1hxj n SER 266 Ca 0.03 1.10 0.16 0.00 -1.33 0.00 0.00 58.87 58.83 1hxj n SER 266 Cb 0.40 -1.60 0.84 0.00 -0.75 0.00 0.00 64.21 63.10 1hxj n SER 266 CO 0.00 0.00 0.00 2.19 -1.23 0.00 0.00 175.04 176.00 1hxj h PHE 267 N 2.18 0.00 -0.37 0.66 -5.15 -2.01 -1.77 116.94 110.49 1hxj h PHE 267 Ca -0.51 0.00 -0.03 0.00 -0.20 0.00 0.00 57.97 57.23 1hxj h PHE 267 Cb 1.27 0.00 -0.02 0.00 0.22 0.00 0.00 35.95 37.42 1hxj h PHE 267 CO 0.49 0.07 0.10 -0.07 -2.00 0.00 0.00 178.31 176.90 1hxj h LEU 268 N 0.00 0.49 -0.47 2.10 3.38 -1.98 -1.97 115.31 116.86 1hxj h LEU 268 Ca -0.00 -0.06 -0.13 0.00 0.09 0.00 0.00 57.88 57.78 1hxj h LEU 268 Cb 0.26 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 1hxj h LEU 268 CO 0.01 0.49 -0.60 0.44 0.09 0.00 0.00 178.44 178.86 1hxj h ASP 269 N 0.53 0.00 -0.43 -0.43 3.32 -1.63 -1.55 116.42 116.22 1hxj h ASP 269 Ca 0.13 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.12 1hxj h ASP 269 Cb 0.19 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.72 1hxj h ASP 269 CO -0.01 0.60 0.06 0.11 -1.72 0.00 0.00 179.24 178.29 1hxj h LYS 270 N 0.00 0.72 -0.39 3.56 1.57 -1.36 0.74 116.57 121.41 1hxj h LYS 270 Ca -0.01 -0.20 -0.08 0.00 -1.87 0.00 0.00 60.65 58.49 1hxj h LYS 270 Cb 1.25 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 33.47 1hxj h LYS 270 CO 0.08 0.76 -0.10 1.96 -0.57 0.00 0.00 179.45 181.58 1hxj h GLN 271 N 0.57 0.68 -0.54 3.15 4.20 -1.29 -0.78 115.11 121.12 1hxj h GLN 271 Ca 0.13 -0.21 -0.09 0.00 0.06 0.00 0.00 58.65 58.54 1hxj h GLN 271 Cb 0.40 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.09 1hxj h GLN 271 CO 0.01 0.77 -0.01 0.00 -0.67 0.00 0.00 178.83 178.92 1hxj h ALA 272 N 1.27 0.96 -0.64 3.87 0.00 -0.94 -1.14 119.26 122.64 1hxj h ALA 272 Ca 0.11 -0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.68 1hxj h ALA 272 Cb 0.54 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 1hxj h ALA 272 CO 0.03 0.63 0.21 1.49 0.00 0.00 0.00 179.25 181.61 1hxj h GLU 273 N 0.85 0.98 0.33 0.00 4.81 -0.36 -1.63 114.58 119.56 1hxj h GLU 273 Ca 0.16 -0.20 -0.01 0.00 -0.13 0.00 0.00 59.36 59.17 1hxj h GLU 273 Cb 0.52 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.75 1hxj h GLU 273 CO 0.03 0.85 -0.21 0.93 -0.73 0.00 0.00 179.01 179.88 1hxj h GLU 274 N 0.91 -0.50 -0.37 1.92 4.39 -0.64 -1.33 114.58 118.95 1hxj h GLU 274 Ca 0.21 0.03 0.02 0.00 0.34 0.00 0.00 59.36 59.96 1hxj h GLU 274 Cb 0.27 0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 29.02 1hxj h GLU 274 CO -0.01 -0.34 0.25 0.00 -1.16 0.00 0.00 179.01 177.75 1hxj h ARG 275 N -0.52 0.43 -0.28 2.33 3.08 -1.14 -2.05 114.38 116.22 1hxj h ARG 275 Ca -0.03 -0.03 -0.11 0.00 0.07 0.00 0.00 59.98 59.88 1hxj h ARG 275 Cb 0.43 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.38 1hxj h ARG 275 CO 0.03 0.29 -0.26 0.77 -1.07 0.00 0.00 179.97 179.73 1hxj h SER 276 N 0.45 0.72 -0.71 7.04 0.02 -0.87 -0.16 113.55 120.05 1hxj h SER 276 Ca 0.15 -0.47 -0.03 0.00 -0.84 0.00 0.00 61.79 60.60 1hxj h SER 276 Cb 0.04 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.34 1hxj h SER 276 CO -0.03 1.04 0.34 -0.50 -1.14 0.00 0.00 176.83 176.53 1hxj h TRP 277 N 0.42 1.03 -0.03 3.45 4.06 -0.91 -1.86 115.95 122.12 1hxj h TRP 277 Ca 0.05 -0.05 -0.00 0.00 2.06 0.00 0.00 58.89 60.95 1hxj h TRP 277 Cb 0.83 -0.32 -0.00 0.00 -1.00 0.00 0.00 29.16 28.66 1hxj h TRP 277 CO 0.07 0.76 0.01 -0.44 -3.56 0.00 0.00 178.44 175.28 1hxj h ASP 278 N 1.03 0.04 0.30 -3.49 3.32 -1.08 0.31 116.42 116.85 1hxj h ASP 278 Ca 0.25 -0.16 -0.09 0.00 0.02 0.00 0.00 57.03 57.04 1hxj h ASP 278 Cb 0.12 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 1hxj h ASP 278 CO -0.03 0.19 -0.39 -0.29 -1.72 0.00 0.00 179.24 177.00 1hxj h ILE 279 N -0.12 1.30 0.00 0.35 6.09 -0.91 0.29 117.51 124.51 1hxj h ILE 279 Ca 0.01 -1.43 -0.01 0.00 -1.37 0.00 0.00 64.86 62.06 1hxj h ILE 279 Cb 0.16 1.69 -0.00 0.00 0.47 0.00 0.00 36.82 39.15 1hxj h ILE 279 CO -0.00 0.42 -0.22 -1.13 -3.07 0.00 0.00 178.15 174.15 1hxj h ASN 280 N 0.11 0.00 0.00 2.19 -0.00 -1.28 -3.40 115.58 113.20 1hxj h ASN 280 Ca 0.01 -0.06 -0.17 0.00 -0.00 0.00 0.00 56.30 56.08 1hxj h ASN 280 Cb 0.75 0.00 -0.02 0.00 -0.00 0.00 0.00 38.32 39.04 1hxj h ASN 280 CO 0.06 0.64 -1.15 -0.11 -0.00 0.00 0.00 177.43 176.87 1hxj n LEU 281 N -4.70 1.86 0.07 0.34 7.94 0.10 -4.50 117.00 118.12 1hxj n LEU 281 Ca -0.04 0.48 0.17 0.00 -1.11 0.00 0.00 56.01 55.51 1hxj n LEU 281 Cb 0.14 -0.90 0.69 0.00 0.53 0.00 0.00 43.42 43.88 1hxj n LEU 281 CO 0.06 0.02 1.16 1.23 -1.11 0.00 0.00 177.39 178.74 1hxj h GLY 282 N -1.00 0.00 -0.37 -3.96 0.00 -0.75 -1.38 103.07 95.62 1hxj h GLY 282 Ca -0.25 0.00 0.16 0.00 0.00 0.00 0.00 47.33 47.24 1hxj h GLY 282 CO -0.15 0.00 -0.07 -0.25 0.00 0.00 0.00 176.54 176.07 1hxj h TRP 283 N 0.00 -0.18 0.00 5.60 2.91 -0.66 -1.31 115.95 122.30 1hxj h TRP 283 Ca 0.19 0.06 -0.04 0.00 1.13 0.00 0.00 58.89 60.23 1hxj h TRP 283 Cb 0.77 0.19 -0.01 0.00 -0.51 0.00 0.00 29.16 29.61 1hxj h TRP 283 CO 0.00 -0.26 -1.69 1.19 -1.03 0.00 0.00 178.44 176.64 1hxj n PHE 284 N -5.39 0.00 0.04 2.65 3.72 -1.09 -4.47 117.46 112.91 1hxj n PHE 284 Ca 0.12 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.40 1hxj n PHE 284 Cb 0.42 -0.38 -0.09 0.00 -0.94 0.00 0.00 39.48 38.50 1hxj n PHE 284 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 1hxj h LEU 285 N 0.00 -0.13 -1.26 4.37 5.85 -1.08 -3.25 115.31 119.81 1hxj h LEU 285 Ca -0.05 -0.42 0.04 0.00 0.84 0.00 0.00 57.88 58.29 1hxj h LEU 285 Cb 0.83 0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.85 1hxj h LEU 285 CO 0.00 0.41 0.52 -0.33 -0.34 0.00 0.00 178.44 178.71 1hxj h GLU 286 N -0.75 0.92 -0.81 1.25 5.08 -1.47 -1.13 114.58 117.67 1hxj h GLU 286 Ca -0.02 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1hxj h GLU 286 Cb 0.55 -0.21 -0.04 0.00 0.50 0.00 0.00 28.75 29.55 1hxj h GLU 286 CO 0.03 0.61 0.50 -1.35 -1.00 0.00 0.00 179.01 177.80 1hxj h PRO 287 N 0.95 1.09 0.00 2.33 0.11 -1.49 0.24 132.00 135.23 1hxj h PRO 287 Ca 0.32 -0.09 0.00 0.00 0.11 0.00 0.00 66.00 66.34 1hxj h PRO 287 Cb 0.09 -0.23 0.00 0.00 0.11 0.00 0.00 31.00 30.96 1hxj h PRO 287 CO -0.10 0.76 0.00 -0.39 -0.21 0.00 0.00 178.00 178.06 1hxj h VAL 288 N 1.11 0.00 0.06 3.15 -1.51 -1.44 0.42 116.25 118.05 1hxj h VAL 288 Ca 0.29 -0.84 -0.23 0.00 -1.23 0.00 0.00 66.70 64.69 1hxj h VAL 288 Cb -0.07 1.84 -0.01 0.00 -2.13 0.00 0.00 31.29 30.92 1hxj h VAL 288 CO -0.06 0.00 -1.20 0.58 -1.23 0.00 0.00 177.57 175.66 1hxj h VAL 289 N 0.00 1.08 0.00 7.19 2.07 -0.61 0.14 116.25 126.11 1hxj h VAL 289 Ca 0.00 -2.32 0.00 0.00 0.82 0.00 0.00 66.70 65.20 1hxj h VAL 289 Cb 0.85 2.64 0.00 0.00 -1.52 0.00 0.00 31.29 33.26 1hxj h VAL 289 CO 0.00 0.58 0.00 -2.11 0.02 0.00 0.00 177.57 176.06 1hxj n ARG 290 N -4.15 1.81 -0.44 1.57 1.85 0.78 -3.71 116.66 114.37 1hxj n ARG 290 Ca -0.26 -0.26 0.00 0.00 -1.00 0.00 0.00 57.85 56.33 1hxj n ARG 290 Cb 0.78 -0.73 0.00 0.00 -1.05 0.00 0.00 32.46 31.46 1hxj n ARG 290 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1hxj n GLY 291 N 0.33 0.77 3.44 2.89 0.00 0.15 -4.71 105.19 108.05 1hxj n GLY 291 Ca 0.00 -0.15 -0.11 0.00 0.00 0.00 0.00 46.02 45.77 1hxj n GLY 291 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1hxj s ASP 292 N -2.13 -0.38 0.79 1.61 2.15 -1.24 -4.60 116.67 112.86 1hxj s ASP 292 Ca 0.00 -0.24 -0.11 0.00 0.43 0.00 0.00 52.55 52.62 1hxj s ASP 292 Cb 0.00 0.56 0.06 0.00 -0.30 0.00 0.00 42.92 43.25 1hxj s ASP 292 CO 0.00 -0.97 1.08 -0.31 -0.17 0.00 0.00 175.17 174.80 1hxj s TYR 293 N -3.81 2.74 0.50 -5.34 2.02 -1.26 -1.99 117.35 110.22 1hxj s TYR 293 Ca 0.04 1.33 -0.23 0.00 -0.37 0.00 0.00 57.07 57.85 1hxj s TYR 293 Cb -0.00 -3.05 -0.06 0.00 -0.40 0.00 0.00 41.96 38.44 1hxj s TYR 293 CO -0.09 -1.77 1.34 -2.14 -1.57 0.00 0.00 175.55 171.32 1hxj s PRO 294 N -5.02 3.39 0.20 -1.71 0.02 -1.26 -4.88 135.00 125.74 1hxj s PRO 294 Ca 0.61 2.21 -0.11 0.00 0.02 0.00 0.00 61.00 63.72 1hxj s PRO 294 Cb -0.16 -2.39 0.23 0.00 0.02 0.00 0.00 34.50 32.20 1hxj s PRO 294 CO 0.55 -0.98 1.73 0.35 -0.33 0.00 0.00 177.00 178.32 1hxj h PHE 295 N 1.80 0.26 -0.59 6.54 3.57 -1.99 -2.28 116.94 124.25 1hxj h PHE 295 Ca -0.51 0.03 0.11 0.00 3.53 0.00 0.00 57.97 61.14 1hxj h PHE 295 Cb 1.28 -0.03 -0.09 0.00 2.79 0.00 0.00 35.95 39.90 1hxj h PHE 295 CO 0.48 0.03 0.10 0.66 -2.23 0.00 0.00 178.31 177.36 1hxj h SER 296 N 0.31 -0.05 -0.74 0.41 4.64 -1.99 -0.50 113.55 115.63 1hxj h SER 296 Ca 0.28 0.12 -0.05 0.00 -0.47 0.00 0.00 61.79 61.67 1hxj h SER 296 Cb 0.36 0.17 -0.03 0.00 -0.31 0.00 0.00 62.40 62.59 1hxj h SER 296 CO -0.32 -0.01 0.27 0.24 -0.87 0.00 0.00 176.83 176.14 1hxj h MET 297 N 0.23 1.12 -0.37 4.77 2.86 -1.79 -1.91 114.93 119.83 1hxj h MET 297 Ca 0.31 -0.22 -0.10 0.00 -2.06 0.00 0.00 59.70 57.63 1hxj h MET 297 Cb 0.46 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 31.93 1hxj h MET 297 CO -0.41 0.93 -0.19 0.00 1.06 0.00 0.00 176.91 178.30 1hxj h ARG 298 N 1.07 0.70 0.00 1.72 3.08 -0.95 0.18 114.38 120.17 1hxj h ARG 298 Ca 0.24 -0.26 -0.02 0.00 0.07 0.00 0.00 59.98 60.02 1hxj h ARG 298 Cb 0.25 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.25 1hxj h ARG 298 CO -0.02 0.84 -0.10 0.66 -1.07 0.00 0.00 179.97 180.28 1hxj h SER 299 N 0.62 0.00 0.00 7.04 4.64 -0.85 -1.89 113.55 123.11 1hxj h SER 299 Ca 0.09 0.00 -0.37 0.00 -0.47 0.00 0.00 61.79 61.04 1hxj h SER 299 Cb 0.66 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.69 1hxj h SER 299 CO 0.05 0.10 -2.35 0.18 -0.87 0.00 0.00 176.83 173.94 1hxj n LEU 300 N -3.20 2.61 0.14 5.97 4.77 -0.74 -4.54 117.00 122.00 1hxj n LEU 300 Ca 0.01 0.01 0.08 0.00 -0.03 0.00 0.00 56.01 56.07 1hxj n LEU 300 Cb 0.40 -0.79 0.05 0.00 -2.33 0.00 0.00 43.42 40.75 1hxj n LEU 300 CO 0.31 0.78 0.36 0.00 -1.33 0.00 0.00 177.39 177.51 1hxj h ALA 301 N -0.27 0.74 -0.54 -1.18 0.00 -0.79 -3.49 119.26 113.73 1hxj h ALA 301 Ca -0.56 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.11 1hxj h ALA 301 Cb 1.73 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.54 1hxj h ALA 301 CO -0.17 0.30 0.00 0.54 0.00 0.00 0.00 179.25 179.92 1hxj n ARG 302 N -3.00 0.00 0.00 0.00 1.74 -0.71 -1.51 116.66 113.19 1hxj n ARG 302 Ca 0.00 0.00 0.02 0.00 -0.77 0.00 0.00 57.85 57.10 1hxj n ARG 302 Cb 0.64 0.00 0.09 0.00 -1.02 0.00 0.00 32.46 32.16 1hxj n ARG 302 CO 0.00 0.00 0.00 -0.85 -1.52 0.00 0.00 177.63 175.26 1hxj n GLU 303 N 14.00 0.00 0.00 5.56 0.00 -1.26 -1.29 120.64 137.65 1hxj n GLU 303 Ca 0.00 0.42 0.10 0.00 0.00 0.00 0.00 57.16 57.68 1hxj n GLU 303 Cb 0.00 -1.50 0.47 0.00 0.00 0.00 0.00 31.44 30.41 1hxj n GLU 303 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 1hxj n ARG 304 N -1.49 0.06 -3.79 3.44 1.74 -0.57 -4.38 116.66 111.67 1hxj n ARG 304 Ca 0.01 0.13 -0.37 0.00 -0.77 0.00 0.00 57.85 56.85 1hxj n ARG 304 Cb 0.05 -1.50 -0.12 0.00 -1.02 0.00 0.00 32.46 29.86 1hxj n ARG 304 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1hxj s LEU 305 N -2.91 4.38 0.62 0.55 2.96 -0.41 -4.74 118.68 119.12 1hxj s LEU 305 Ca 0.12 -1.33 -0.18 0.00 -0.22 0.00 0.00 54.13 52.53 1hxj s LEU 305 Cb 0.14 -1.82 -0.05 0.00 0.50 0.00 0.00 46.19 44.96 1hxj s LEU 305 CO 0.37 -0.35 0.87 -2.65 -1.32 0.00 0.00 176.35 173.28 1hxj n PRO 306 N 4.73 0.74 -3.36 0.98 -0.02 -1.26 -4.91 135.00 131.90 1hxj n PRO 306 Ca -0.11 0.30 -0.29 0.00 -2.02 0.00 0.00 63.50 61.37 1hxj n PRO 306 Cb 0.44 -2.09 -0.03 0.00 -0.02 0.00 0.00 33.50 31.79 1hxj n PRO 306 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 1hxj s PHE 307 N -1.60 3.47 -0.00 6.00 2.99 -1.26 -5.02 117.98 122.56 1hxj s PHE 307 Ca 0.75 0.67 -0.02 0.00 0.00 0.00 0.00 56.93 58.32 1hxj s PHE 307 Cb -0.41 -2.12 -0.04 0.00 0.00 0.00 0.00 43.02 40.46 1hxj s PHE 307 CO 0.48 0.19 0.16 -0.06 -0.00 0.00 0.00 175.22 175.99 1hxj s PHE 308 N -2.04 3.48 0.52 0.36 0.08 -1.26 -5.09 117.98 114.04 1hxj s PHE 308 Ca 0.44 0.31 -0.17 0.00 0.12 0.00 0.00 56.93 57.63 1hxj s PHE 308 Cb -0.11 -1.80 -0.07 0.00 -0.57 0.00 0.00 43.02 40.47 1hxj s PHE 308 CO 0.29 0.62 1.01 0.15 -0.10 0.00 0.00 175.22 177.18 1hxj s LYS 309 N -1.93 3.79 0.26 0.44 1.02 -1.26 -4.83 119.74 117.24 1hxj s LYS 309 Ca 0.27 1.09 -0.01 0.00 0.02 0.00 0.00 55.97 57.33 1hxj s LYS 309 Cb -0.12 -2.11 0.48 0.00 -0.52 0.00 0.00 37.83 35.56 1hxj s LYS 309 CO 0.18 -0.41 1.82 -0.44 -0.92 0.00 0.00 175.35 175.58 1hxj h ASP 310 N 0.97 0.78 -0.63 2.83 3.32 -1.99 0.72 116.42 122.42 1hxj h ASP 310 Ca -0.47 0.05 0.07 0.00 0.02 0.00 0.00 57.03 56.70 1hxj h ASP 310 Cb 1.20 -0.10 -0.04 0.00 0.22 0.00 0.00 39.33 40.61 1hxj h ASP 310 CO 0.60 0.42 0.42 -0.33 -1.72 0.00 0.00 179.24 178.63 1hxj h GLU 311 N 0.87 0.56 0.11 3.56 3.07 -2.00 -1.05 114.58 119.71 1hxj h GLU 311 Ca 0.45 -0.03 -0.29 0.00 -0.50 0.00 0.00 59.36 58.98 1hxj h GLU 311 Cb 0.45 -0.13 0.02 0.00 -0.84 0.00 0.00 28.75 28.26 1hxj h GLU 311 CO -0.27 0.37 -1.23 1.96 -1.40 0.00 0.00 179.01 178.45 1hxj h GLN 312 N 0.58 0.56 -0.87 2.33 4.20 -1.28 -2.66 115.11 117.97 1hxj h GLN 312 Ca 0.28 -0.76 -0.01 0.00 0.06 0.00 0.00 58.65 58.22 1hxj h GLN 312 Cb 0.35 0.25 -0.04 0.00 0.30 0.00 0.00 27.48 28.34 1hxj h GLN 312 CO -0.09 1.34 0.51 0.87 -0.67 0.00 0.00 178.83 180.79 1hxj h LYS 313 N 0.25 1.19 -0.46 1.46 1.57 -0.52 0.78 116.57 120.83 1hxj h LYS 313 Ca -0.17 -0.12 -0.05 0.00 -1.87 0.00 0.00 60.65 58.44 1hxj h LYS 313 Cb 1.90 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 33.95 1hxj h LYS 313 CO 0.23 0.84 0.11 1.49 -0.57 0.00 0.00 179.45 181.55 1hxj h GLU 314 N 1.20 0.74 -0.24 3.15 4.81 -1.22 -0.88 114.58 122.15 1hxj h GLU 314 Ca 0.31 -0.18 -0.13 0.00 -0.13 0.00 0.00 59.36 59.24 1hxj h GLU 314 Cb -0.03 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.25 1hxj h GLU 314 CO -0.06 0.73 -0.38 0.87 -0.73 0.00 0.00 179.01 179.45 1hxj h LYS 315 N 0.62 0.54 -0.18 1.92 1.57 -1.08 -3.27 116.57 116.69 1hxj h LYS 315 Ca 0.14 -0.26 -0.09 0.00 -1.87 0.00 0.00 60.65 58.57 1hxj h LYS 315 Cb 0.33 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.63 1hxj h LYS 315 CO 0.00 0.83 -0.25 -0.07 -0.57 0.00 0.00 179.45 179.40 1hxj h LEU 316 N 0.45 0.53 -9.26 2.94 3.38 -0.62 -3.40 115.31 109.33 1hxj h LEU 316 Ca 0.04 -0.51 -0.56 0.00 0.09 0.00 0.00 57.88 56.94 1hxj h LEU 316 Cb 0.86 -0.15 0.02 0.00 0.09 0.00 0.00 40.66 41.48 1hxj h LEU 316 CO 0.07 0.94 1.26 0.00 0.09 0.00 0.00 178.44 180.80 1hxj n ALA 317 N -2.47 1.47 -1.55 1.53 0.00 -0.36 -2.04 120.51 117.10 1hxj n ALA 317 Ca -0.06 0.15 -0.06 0.00 0.00 0.00 0.00 53.44 53.47 1hxj n ALA 317 Cb 0.44 -2.69 -0.02 0.00 0.00 0.00 0.00 19.45 17.19 1hxj n ALA 317 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hxj n GLY 318 N 4.77 0.56 2.33 0.00 0.00 0.49 -4.95 105.19 108.39 1hxj n GLY 318 Ca 0.23 -0.72 -0.35 0.00 0.00 0.00 0.00 46.02 45.18 1hxj n GLY 318 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1hxj n SER 319 N 0.95 7.92 -3.60 1.61 3.41 -0.87 -4.81 113.62 118.24 1hxj n SER 319 Ca -0.06 -2.76 -0.08 0.00 -0.26 0.00 0.00 58.87 55.70 1hxj n SER 319 Cb 0.34 -1.46 -0.05 0.00 -0.26 0.00 0.00 64.21 62.78 1hxj n SER 319 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 1hxj s TYR 320 N 0.80 -0.28 -0.13 7.33 -0.85 -1.26 -4.76 117.35 118.20 1hxj s TYR 320 Ca 0.64 0.48 0.08 0.00 -0.52 0.00 0.00 57.07 57.76 1hxj s TYR 320 Cb 0.22 0.46 -0.12 0.00 0.38 0.00 0.00 41.96 42.90 1hxj s TYR 320 CO -0.07 -0.25 0.24 0.09 -1.52 0.00 0.00 175.55 174.03 1hxj n ASN 321 N 0.70 2.22 -3.57 -0.18 3.02 0.60 -5.00 115.26 113.05 1hxj n ASN 321 Ca -0.07 -0.22 -0.11 0.00 -0.03 0.00 0.00 54.58 54.15 1hxj n ASN 321 Cb 0.58 1.26 -0.03 0.00 -0.61 0.00 0.00 39.78 40.99 1hxj n ASN 321 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1hxj s MET 322 N -2.33 1.34 -0.01 3.52 0.23 -1.23 -4.55 119.30 116.28 1hxj s MET 322 Ca -0.01 -0.65 0.02 0.00 -1.03 0.00 0.00 55.69 54.02 1hxj s MET 322 Cb 0.06 0.56 -0.00 0.00 -1.53 0.00 0.00 34.83 33.92 1hxj s MET 322 CO 0.34 -0.58 -0.06 -0.51 -2.03 0.00 0.00 175.02 172.18 1hxj s LEU 323 N -2.80 1.96 -0.02 0.18 1.43 -0.69 -4.06 118.68 114.67 1hxj s LEU 323 Ca 0.04 -0.11 -0.02 0.00 -1.03 0.00 0.00 54.13 53.02 1hxj s LEU 323 Cb -0.01 -0.31 -0.04 0.00 0.03 0.00 0.00 46.19 45.86 1hxj s LEU 323 CO -0.08 0.06 0.11 -0.83 0.23 0.00 0.00 176.35 175.84 1hxj s GLY 324 N -0.06 2.06 -0.10 -3.19 0.00 0.25 -1.37 107.32 104.91 1hxj s GLY 324 Ca 0.01 -0.81 0.00 0.00 0.00 0.00 0.00 44.72 43.92 1hxj s GLY 324 CO -0.00 -0.67 -0.08 1.08 0.00 0.00 0.00 173.10 173.42 1hxj s LEU 325 N -1.66 1.28 -0.49 0.66 1.43 0.03 -0.26 118.68 119.67 1hxj s LEU 325 Ca 0.23 -0.29 -0.16 0.00 -1.03 0.00 0.00 54.13 52.87 1hxj s LEU 325 Cb -0.12 -0.82 0.08 0.00 0.03 0.00 0.00 46.19 45.35 1hxj s LEU 325 CO 0.13 -0.09 0.45 0.20 0.23 0.00 0.00 176.35 177.28 1hxj s ASN 326 N 1.47 6.17 -0.14 2.29 0.01 0.12 -1.86 114.94 123.00 1hxj s ASN 326 Ca 0.00 -1.30 0.00 0.00 -0.71 0.00 0.00 52.86 50.86 1hxj s ASN 326 Cb -0.13 -2.21 -0.01 0.00 0.41 0.00 0.00 41.25 39.31 1hxj s ASN 326 CO -0.05 -0.72 -0.15 -0.47 -1.51 0.00 0.00 177.10 174.20 1hxj s TYR 327 N 1.84 2.78 0.00 2.20 5.04 -0.41 -1.77 117.35 127.02 1hxj s TYR 327 Ca 0.06 -0.83 0.00 0.00 -2.44 0.00 0.00 57.07 53.87 1hxj s TYR 327 Cb -0.24 -1.85 0.00 0.00 0.35 0.00 0.00 41.96 40.22 1hxj s TYR 327 CO 0.07 -0.33 0.00 0.66 -1.34 0.00 0.00 175.55 174.61 1hxj n TYR 328 N 3.75 0.00 -3.55 4.97 4.02 -1.26 -4.20 117.16 120.89 1hxj n TYR 328 Ca -0.19 0.00 -0.06 0.00 -0.01 0.00 0.00 57.90 57.65 1hxj n TYR 328 Cb 0.52 0.02 0.00 0.00 -0.02 0.00 0.00 39.34 39.87 1hxj n TYR 328 CO 0.00 0.00 0.00 -2.37 -1.01 0.00 0.00 176.86 173.48 1hxj n THR 329 N -2.24 0.00 -4.29 -0.72 5.66 -1.26 -4.62 114.28 106.81 1hxj n THR 329 Ca 0.00 -0.64 -0.17 0.00 -3.05 0.00 0.00 64.05 60.19 1hxj n THR 329 Cb 0.33 0.52 -0.09 0.00 -1.55 0.00 0.00 70.33 69.54 1hxj n THR 329 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 175.07 171.58 1hxj s SER 330 N -2.06 1.20 0.06 1.09 0.01 -1.26 -1.58 113.70 111.16 1hxj s SER 330 Ca 0.10 -1.55 -0.08 0.00 1.31 0.00 0.00 55.95 55.74 1hxj s SER 330 Cb -0.02 0.41 -0.00 0.00 0.21 0.00 0.00 66.02 66.62 1hxj s SER 330 CO 0.08 -0.91 0.15 -0.13 0.41 0.00 0.00 173.24 172.84 1hxj s ARG 331 N -3.84 0.71 -0.14 12.44 1.81 0.05 -4.85 118.95 125.14 1hxj s ARG 331 Ca 0.38 -0.81 -0.19 0.00 -1.72 0.00 0.00 55.73 53.38 1hxj s ARG 331 Cb 0.05 0.29 -0.04 0.00 -0.45 0.00 0.00 34.95 34.80 1hxj s ARG 331 CO 0.18 -0.20 0.52 -0.06 -0.68 0.00 0.00 175.30 175.05 1hxj s PHE 332 N -3.12 3.47 -0.22 -0.53 0.40 0.85 -0.99 117.98 117.85 1hxj s PHE 332 Ca -0.01 0.89 -0.11 0.00 -0.60 0.00 0.00 56.93 57.10 1hxj s PHE 332 Cb 0.02 -2.62 -0.05 0.00 0.51 0.00 0.00 43.02 40.88 1hxj s PHE 332 CO -0.07 0.07 0.20 -1.12 0.70 0.00 0.00 175.22 174.99 1hxj s SER 333 N 0.82 6.21 -0.11 1.36 0.01 0.20 0.30 113.70 122.49 1hxj s SER 333 Ca 0.27 0.23 0.02 0.00 1.31 0.00 0.00 55.95 57.78 1hxj s SER 333 Cb -0.15 -2.13 -0.01 0.00 0.21 0.00 0.00 66.02 63.94 1hxj s SER 333 CO 0.11 0.08 -0.19 -0.75 0.41 0.00 0.00 173.24 172.89 1hxj s LYS 334 N 0.86 3.16 0.64 12.44 2.20 -0.08 -0.46 119.74 138.50 1hxj s LYS 334 Ca 0.10 -0.79 -0.18 0.00 -0.36 0.00 0.00 55.97 54.73 1hxj s LYS 334 Cb -0.13 -2.44 -0.01 0.00 -1.51 0.00 0.00 37.83 33.74 1hxj s LYS 334 CO 0.03 0.22 1.30 -1.71 -0.36 0.00 0.00 175.35 174.83 1hxj n ASN 335 N 3.46 2.13 -3.70 1.43 2.85 -1.26 -0.53 115.26 119.64 1hxj n ASN 335 Ca -0.19 0.84 -0.18 0.00 -0.11 0.00 0.00 54.58 54.95 1hxj n ASN 335 Cb 0.53 -1.56 -0.17 0.00 1.24 0.00 0.00 39.78 39.82 1hxj n ASN 335 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 1hxj s ILE 336 N -1.37 -0.10 0.44 -1.44 1.01 -1.10 -4.76 121.20 113.87 1hxj s ILE 336 Ca 0.82 0.36 -0.18 0.00 0.00 0.00 0.00 60.65 61.64 1hxj s ILE 336 Cb -0.38 -0.14 -0.10 0.00 0.01 0.00 0.00 42.46 41.85 1hxj s ILE 336 CO 0.41 0.15 0.92 -1.81 0.00 0.00 0.00 174.94 174.61 1hxj s ASP 337 N 1.83 6.80 0.14 3.58 1.01 -1.26 -4.70 116.67 124.07 1hxj s ASP 337 Ca 0.00 1.57 -0.30 0.00 0.71 0.00 0.00 52.55 54.53 1hxj s ASP 337 Cb -0.12 -2.49 -0.07 0.00 1.01 0.00 0.00 42.92 41.24 1hxj s ASP 337 CO -0.03 -0.41 1.17 -0.63 0.21 0.00 0.00 175.17 175.47 1hxj s ILE 338 N -2.30 3.82 0.08 0.77 1.01 -1.26 -4.89 121.20 118.44 1hxj s ILE 338 Ca 0.59 1.46 -0.26 0.00 0.00 0.00 0.00 60.65 62.44 1hxj s ILE 338 Cb -0.09 -3.94 0.08 0.00 0.01 0.00 0.00 42.46 38.52 1hxj s ILE 338 CO 0.20 0.20 0.84 -0.94 0.00 0.00 0.00 174.94 175.24 1hxj s SER 339 N 0.36 -0.35 0.15 3.58 1.04 -1.26 -5.01 113.70 112.21 1hxj s SER 339 Ca 0.54 -0.14 0.19 0.00 0.48 0.00 0.00 55.95 57.02 1hxj s SER 339 Cb -0.30 0.47 0.83 0.00 0.10 0.00 0.00 66.02 67.11 1hxj s SER 339 CO 0.34 -0.80 1.60 -0.81 0.98 0.00 0.00 173.24 174.55 1hxj n PRO 340 N -0.34 0.11 0.00 4.02 -0.04 -1.26 -2.22 135.00 135.28 1hxj n PRO 340 Ca -0.09 0.36 0.13 0.00 -0.04 0.00 0.00 63.50 63.86 1hxj n PRO 340 Cb 0.62 -1.72 0.37 0.00 -0.04 0.00 0.00 33.50 32.73 1hxj n PRO 340 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1hxj n ASN 341 N -1.94 1.57 -4.10 3.54 3.02 -1.26 -4.88 115.26 111.21 1hxj n ASN 341 Ca 0.02 -1.36 -0.25 0.00 -0.03 0.00 0.00 54.58 52.97 1hxj n ASN 341 Cb 0.20 0.09 -0.16 0.00 -0.61 0.00 0.00 39.78 39.30 1hxj n ASN 341 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1hxj s TYR 342 N -2.22 1.53 -0.04 3.10 5.04 -0.94 -5.13 117.35 118.69 1hxj s TYR 342 Ca 0.30 -0.43 0.01 0.00 -2.44 0.00 0.00 57.07 54.51 1hxj s TYR 342 Cb 0.20 -1.04 0.02 0.00 0.35 0.00 0.00 41.96 41.49 1hxj s TYR 342 CO 0.42 -0.15 -0.03 -1.12 -1.34 0.00 0.00 175.55 173.33 1hxj s SER 343 N 0.08 0.81 0.49 4.32 0.01 -1.26 -4.60 113.70 113.55 1hxj s SER 343 Ca -0.04 -0.09 -0.23 0.00 1.31 0.00 0.00 55.95 56.90 1hxj s SER 343 Cb -0.11 -0.37 -0.07 0.00 0.21 0.00 0.00 66.02 65.68 1hxj s SER 343 CO 0.02 -0.08 1.29 -2.84 0.41 0.00 0.00 173.24 172.04 1hxj s PRO 344 N 1.02 3.53 -0.05 12.44 0.02 -1.26 -4.94 135.00 145.75 1hxj s PRO 344 Ca -0.10 2.09 -0.04 0.00 0.02 0.00 0.00 61.00 62.97 1hxj s PRO 344 Cb -0.14 -2.43 -0.03 0.00 0.02 0.00 0.00 34.50 31.92 1hxj s PRO 344 CO -0.01 -0.83 -0.10 0.28 -0.33 0.00 0.00 177.00 176.01 1hxj n VAL 345 N -0.58 0.68 -3.63 3.83 0.31 -1.26 -5.03 118.33 112.65 1hxj n VAL 345 Ca 0.08 0.01 -0.28 0.00 -0.01 0.00 0.00 64.34 64.13 1hxj n VAL 345 Cb 0.45 -1.66 -0.03 0.00 -0.91 0.00 0.00 33.84 31.69 1hxj n VAL 345 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1hxj s LEU 346 N -6.66 4.20 0.42 7.52 1.43 -1.26 -4.31 118.68 120.02 1hxj s LEU 346 Ca -0.10 0.49 0.13 0.00 -1.03 0.00 0.00 54.13 53.61 1hxj s LEU 346 Cb 0.03 -3.26 0.98 0.00 0.03 0.00 0.00 46.19 43.98 1hxj s LEU 346 CO 0.14 -0.06 1.97 -0.55 0.23 0.00 0.00 176.35 178.07 1hxj h ASN 347 N 2.06 0.42 0.66 2.29 7.08 -1.36 0.19 115.58 126.92 1hxj h ASN 347 Ca -0.48 0.01 0.00 0.00 -3.08 0.00 0.00 56.30 52.75 1hxj h ASN 347 Cb 1.19 -0.08 0.00 0.00 -2.08 0.00 0.00 38.32 37.35 1hxj h ASN 347 CO 0.68 0.25 0.00 0.71 -2.08 0.00 0.00 177.43 177.00 1hxj h THR 348 N 0.47 0.00 0.00 6.14 1.35 -1.94 -1.82 112.91 117.12 1hxj h THR 348 Ca 0.30 -0.25 0.00 0.00 -0.55 0.00 0.00 66.41 65.91 1hxj h THR 348 Cb 0.54 1.02 0.00 0.00 -1.73 0.00 0.00 68.15 67.98 1hxj h THR 348 CO -0.09 0.00 0.00 0.47 -0.25 0.00 0.00 175.52 175.65 1hxj n ASP 349 N -2.47 0.77 0.23 5.36 8.00 0.66 -2.74 116.55 126.35 1hxj n ASP 349 Ca 0.01 0.63 0.16 0.00 0.71 0.00 0.00 54.79 56.30 1hxj n ASP 349 Cb 0.21 -0.82 0.79 0.00 -0.02 0.00 0.00 41.12 41.28 1hxj n ASP 349 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 1hxj h ASP 350 N 0.00 0.00 0.84 -2.24 3.32 -1.42 -0.54 116.42 116.38 1hxj h ASP 350 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1hxj h ASP 350 Cb 0.54 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.09 1hxj h ASP 350 CO 0.00 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.52 1hxj n ALA 351 N -1.90 2.26 -3.85 3.45 0.00 -1.11 -4.85 120.51 114.52 1hxj n ALA 351 Ca -0.01 -0.10 -0.35 0.00 0.00 0.00 0.00 53.44 52.98 1hxj n ALA 351 Cb 0.10 -1.44 0.02 0.00 0.00 0.00 0.00 19.45 18.13 1hxj n ALA 351 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1hxj n TYR 352 N -1.46 -1.71 -3.59 0.00 4.02 -0.21 -4.69 117.16 109.53 1hxj n TYR 352 Ca 0.08 0.40 -0.16 0.00 -0.01 0.00 0.00 57.90 58.21 1hxj n TYR 352 Cb 0.30 -3.29 -0.07 0.00 -0.02 0.00 0.00 39.34 36.26 1hxj n TYR 352 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1hxj s ALA 353 N -3.59 -1.78 -0.09 -0.72 0.00 -1.26 -2.72 121.76 111.60 1hxj s ALA 353 Ca 0.39 1.74 -0.07 0.00 0.00 0.00 0.00 51.96 54.02 1hxj s ALA 353 Cb -0.16 -0.71 -0.04 0.00 0.00 0.00 0.00 23.12 22.20 1hxj s ALA 353 CO 0.90 -0.35 0.18 -1.54 0.00 0.00 0.00 175.76 174.95 1hxj s SER 354 N -0.25 6.43 -0.33 0.00 1.04 0.31 -4.87 113.70 116.03 1hxj s SER 354 Ca -0.04 0.51 -0.12 0.00 0.48 0.00 0.00 55.95 56.78 1hxj s SER 354 Cb -0.03 -2.08 -0.02 0.00 0.10 0.00 0.00 66.02 63.99 1hxj s SER 354 CO 0.05 0.38 0.21 -1.10 0.98 0.00 0.00 173.24 173.76 1hxj s GLN 355 N -1.17 3.48 0.03 4.02 -1.52 -1.26 -0.90 119.66 122.35 1hxj s GLN 355 Ca 0.18 -0.64 0.04 0.00 -1.95 0.00 0.00 55.36 52.99 1hxj s GLN 355 Cb -0.13 -3.73 -0.04 0.00 -0.22 0.00 0.00 33.01 28.90 1hxj s GLN 355 CO 0.07 -0.42 -0.07 -1.21 -0.25 0.00 0.00 175.29 173.41 1hxj s GLU 356 N 1.69 2.46 -0.12 2.91 0.41 0.15 -4.89 118.70 121.31 1hxj s GLU 356 Ca 0.06 -0.80 -0.17 0.00 -0.41 0.00 0.00 54.97 53.65 1hxj s GLU 356 Cb -0.17 -2.46 -0.26 0.00 -1.78 0.00 0.00 34.13 29.45 1hxj s GLU 356 CO 0.09 0.58 0.54 0.28 -0.49 0.00 0.00 175.26 176.25 1hxj h VAL 357 N 3.56 1.07 -3.22 2.63 2.07 -1.91 0.24 116.25 120.68 1hxj h VAL 357 Ca -0.48 -2.37 -0.59 0.00 0.82 0.00 0.00 66.70 64.07 1hxj h VAL 357 Cb 1.17 2.71 -0.09 0.00 -1.52 0.00 0.00 31.29 33.56 1hxj h VAL 357 CO 0.54 0.66 -0.28 0.20 0.02 0.00 0.00 177.57 178.71 1hxj s ASN 358 N -6.96 6.54 0.97 0.57 0.02 -1.26 0.20 114.94 115.02 1hxj s ASN 358 Ca -0.21 0.64 -0.07 0.00 -1.02 0.00 0.00 52.86 52.20 1hxj s ASN 358 Cb 0.04 -2.21 0.10 0.00 0.02 0.00 0.00 41.25 39.20 1hxj s ASN 358 CO 0.74 0.13 0.59 0.61 0.02 0.00 0.00 177.10 179.19 1hxj n GLY 359 N 3.04 -1.18 0.30 0.66 0.00 -0.49 -4.85 105.19 102.66 1hxj n GLY 359 Ca -0.12 -1.71 0.15 0.00 0.00 0.00 0.00 46.02 44.35 1hxj n GLY 359 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1hxj h PRO 360 N 0.00 0.00 -0.01 1.61 0.13 -1.90 -0.73 132.00 131.11 1hxj h PRO 360 Ca -0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.94 1hxj h PRO 360 Cb 0.53 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.66 1hxj h PRO 360 CO 0.14 0.00 -0.05 -0.40 -0.23 0.00 0.00 178.00 177.46 1hxj n ASP 361 N -3.86 0.68 0.00 1.44 3.85 -1.26 -4.92 116.55 112.48 1hxj n ASP 361 Ca -0.03 -1.01 0.00 0.00 -0.71 0.00 0.00 54.79 53.04 1hxj n ASP 361 Cb 0.08 -0.02 0.00 0.00 -1.35 0.00 0.00 41.12 39.83 1hxj n ASP 361 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1hxj n GLY 362 N 1.16 1.36 3.79 6.12 0.00 -0.28 -5.05 105.19 112.30 1hxj n GLY 362 Ca 0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.82 1hxj n GLY 362 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1hxj s LYS 363 N -0.52 4.36 0.60 1.61 2.20 -1.26 -4.69 119.74 122.03 1hxj s LYS 363 Ca 0.00 0.92 -0.19 0.00 -0.36 0.00 0.00 55.97 56.34 1hxj s LYS 363 Cb 0.00 -3.25 -0.03 0.00 -1.51 0.00 0.00 37.83 33.04 1hxj s LYS 363 CO 0.00 0.60 1.27 -2.14 -0.36 0.00 0.00 175.35 174.72 1hxj s PRO 364 N -1.09 2.85 0.55 4.03 0.02 -1.26 -1.40 135.00 138.70 1hxj s PRO 364 Ca 0.32 2.01 0.29 0.00 0.02 0.00 0.00 61.00 63.64 1hxj s PRO 364 Cb -0.21 -1.97 1.46 0.00 0.02 0.00 0.00 34.50 33.80 1hxj s PRO 364 CO 0.22 -1.35 1.92 0.97 -0.33 0.00 0.00 177.00 178.43 1hxj h ILE 365 N 0.88 0.56 -2.59 2.83 2.10 -0.59 -3.44 117.51 117.26 1hxj h ILE 365 Ca -0.51 0.00 0.13 0.00 1.08 0.00 0.00 64.86 65.57 1hxj h ILE 365 Cb 1.31 0.61 -0.07 0.00 -1.09 0.00 0.00 36.82 37.59 1hxj h ILE 365 CO 0.55 0.00 0.39 -0.83 -1.08 0.00 0.00 178.15 177.18 1hxj s GLY 366 N -3.96 -0.19 0.33 8.18 0.00 -1.26 -4.87 107.32 105.55 1hxj s GLY 366 Ca -0.05 -0.01 -0.29 0.00 0.00 0.00 0.00 44.72 44.37 1hxj s GLY 366 CO 0.71 -0.02 1.48 -4.14 0.00 0.00 0.00 173.10 171.13 1hxj s PRO 367 N -3.52 4.17 0.38 2.90 0.02 -1.24 -4.46 135.00 133.25 1hxj s PRO 367 Ca 0.11 2.48 -0.27 0.00 0.02 0.00 0.00 61.00 63.34 1hxj s PRO 367 Cb -0.03 -3.02 -0.09 0.00 0.02 0.00 0.00 34.50 31.38 1hxj s PRO 367 CO 0.04 -0.49 1.30 -1.25 -0.33 0.00 0.00 177.00 176.27 1hxj s PRO 368 N -1.34 4.13 0.00 5.54 0.04 -1.26 -0.92 135.00 141.18 1hxj s PRO 368 Ca 0.56 2.17 0.23 0.00 0.04 0.00 0.00 61.00 64.00 1hxj s PRO 368 Cb -0.45 -2.88 0.36 0.00 0.04 0.00 0.00 34.50 31.56 1hxj s PRO 368 CO 0.54 -0.36 1.35 -1.33 0.04 0.00 0.00 177.00 177.24 1hxj n MET 369 N 0.40 2.44 0.00 4.56 2.81 -0.28 -4.86 117.12 122.18 1hxj n MET 369 Ca 0.02 -2.18 0.00 0.00 -1.81 0.00 0.00 57.70 53.73 1hxj n MET 369 Cb 0.43 -1.49 0.00 0.00 -0.71 0.00 0.00 33.22 31.44 1hxj n MET 369 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1hxj n GLY 370 N 1.44 3.08 3.87 3.03 0.00 -1.26 -4.71 105.19 110.64 1hxj n GLY 370 Ca 0.18 -0.78 -0.30 0.00 0.00 0.00 0.00 46.02 45.12 1hxj n GLY 370 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hxj s ASN 371 N 0.00 2.39 0.16 1.61 2.20 -1.24 -4.78 114.94 115.28 1hxj s ASN 371 Ca 0.00 0.23 0.19 0.00 -0.94 0.00 0.00 52.86 52.35 1hxj s ASN 371 Cb 0.00 -0.22 0.83 0.00 -2.00 0.00 0.00 41.25 39.85 1hxj s ASN 371 CO 0.00 -3.18 1.59 -0.81 -2.94 0.00 0.00 177.10 171.76 1hxj n PRO 372 N -4.06 0.12 0.00 3.55 -0.04 -1.26 -4.19 135.00 129.12 1hxj n PRO 372 Ca 0.16 0.38 0.00 0.00 -0.04 0.00 0.00 63.50 64.00 1hxj n PRO 372 Cb 0.59 -1.73 0.00 0.00 -0.04 0.00 0.00 33.50 32.32 1hxj n PRO 372 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1hxj n TRP 373 N -1.95 0.00 -3.13 0.54 4.27 -1.26 -5.04 117.44 110.87 1hxj n TRP 373 Ca 0.02 0.00 -0.41 0.00 -3.89 0.00 0.00 57.50 53.22 1hxj n TRP 373 Cb 0.19 0.00 -0.07 0.00 -1.36 0.00 0.00 31.31 30.07 1hxj n TRP 373 CO 0.00 0.00 0.00 0.42 -2.29 0.00 0.00 177.69 175.82 1hxj s ILE 374 N -0.81 4.94 -0.12 -1.67 1.01 -1.26 -4.92 121.20 118.37 1hxj s ILE 374 Ca 0.00 0.79 0.03 0.00 0.00 0.00 0.00 60.65 61.47 1hxj s ILE 374 Cb 0.00 -4.00 0.01 0.00 0.01 0.00 0.00 42.46 38.48 1hxj s ILE 374 CO 0.00 -0.16 -0.22 -0.31 0.00 0.00 0.00 174.94 174.26 1hxj s TYR 375 N 2.60 2.54 -0.19 3.97 1.51 -1.26 -1.13 117.35 125.39 1hxj s TYR 375 Ca 0.25 -1.20 -0.29 0.00 -1.01 0.00 0.00 57.07 54.81 1hxj s TYR 375 Cb -0.15 -1.73 -0.04 0.00 -0.11 0.00 0.00 41.96 39.93 1hxj s TYR 375 CO 0.12 -0.54 1.81 1.41 -1.11 0.00 0.00 175.55 177.24 1hxj s MET 376 N 0.69 3.67 -0.45 -0.62 1.75 -0.10 -4.21 119.30 120.03 1hxj s MET 376 Ca -0.11 1.87 0.06 0.00 -1.25 0.00 0.00 55.69 56.26 1hxj s MET 376 Cb -0.16 -4.14 0.20 0.00 2.84 0.00 0.00 34.83 33.57 1hxj s MET 376 CO 0.01 -1.46 0.59 0.98 -0.65 0.00 0.00 175.02 174.50 1hxj n TYR 377 N 9.13 -2.15 0.28 4.11 9.36 -1.26 -3.64 117.16 132.98 1hxj n TYR 377 Ca 0.22 -2.48 0.14 0.00 3.32 0.00 0.00 57.90 59.09 1hxj n TYR 377 Cb 0.45 0.76 0.84 0.00 -0.63 0.00 0.00 39.34 40.75 1hxj n TYR 377 CO 0.00 0.00 0.00 -1.00 0.22 0.00 0.00 176.86 176.08 1hxj h PRO 378 N 4.85 0.00 0.00 2.98 0.13 -1.93 -1.55 132.00 136.48 1hxj h PRO 378 Ca 0.10 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.21 1hxj h PRO 378 Cb 0.99 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.12 1hxj h PRO 378 CO 0.27 0.05 -0.06 1.49 -0.23 0.00 0.00 178.00 179.51 1hxj h GLU 379 N 0.00 0.00 -0.18 0.86 4.81 -1.96 0.14 114.58 118.25 1hxj h GLU 379 Ca -0.00 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 59.15 1hxj h GLU 379 Cb 0.12 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.49 1hxj h GLU 379 CO 0.01 0.06 -0.23 0.78 -0.73 0.00 0.00 179.01 178.90 1hxj h GLY 380 N 0.26 0.34 1.10 1.92 0.00 -1.69 -1.04 103.07 103.96 1hxj h GLY 380 Ca -0.00 -0.26 -0.12 0.00 0.00 0.00 0.00 47.33 46.96 1hxj h GLY 380 CO 0.01 0.24 -0.11 -2.00 0.00 0.00 0.00 176.54 174.67 1hxj h LEU 381 N 0.29 1.04 -0.53 3.11 5.85 -1.08 -1.37 115.31 122.61 1hxj h LEU 381 Ca 0.05 -0.35 -0.04 0.00 0.84 0.00 0.00 57.88 58.38 1hxj h LEU 381 Cb 0.57 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.29 1hxj h LEU 381 CO 0.04 1.15 0.19 0.50 -0.34 0.00 0.00 178.44 179.98 1hxj h LYS 382 N 0.92 0.81 -0.91 1.25 3.64 -1.21 -0.72 116.57 120.34 1hxj h LYS 382 Ca 0.14 -0.16 0.01 0.00 -1.27 0.00 0.00 60.65 59.37 1hxj h LYS 382 Cb 0.68 -0.12 -0.05 0.00 -0.41 0.00 0.00 32.23 32.33 1hxj h LYS 382 CO 0.05 0.73 0.60 -0.44 -2.27 0.00 0.00 179.45 178.12 1hxj h ASP 383 N 0.73 1.04 -0.29 4.20 3.32 -0.96 -1.29 116.42 123.17 1hxj h ASP 383 Ca 0.17 -0.02 -0.04 0.00 0.02 0.00 0.00 57.03 57.16 1hxj h ASP 383 Cb 0.24 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 1hxj h ASP 383 CO -0.01 0.75 0.03 0.25 -1.72 0.00 0.00 179.24 178.53 1hxj h LEU 384 N 1.22 0.47 -1.29 1.55 5.85 -0.67 -2.10 115.31 120.34 1hxj h LEU 384 Ca 0.34 -0.28 -0.07 0.00 0.84 0.00 0.00 57.88 58.70 1hxj h LEU 384 Cb -0.12 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 40.77 1hxj h LEU 384 CO -0.08 0.64 -0.32 -0.07 -0.34 0.00 0.00 178.44 178.27 1hxj h LEU 385 N 0.29 0.06 -0.46 2.25 3.38 -0.75 -1.34 115.31 118.75 1hxj h LEU 385 Ca 0.08 -0.02 -0.16 0.00 0.09 0.00 0.00 57.88 57.87 1hxj h LEU 385 Cb 0.38 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 1hxj h LEU 385 CO 0.01 0.38 -0.48 0.24 0.09 0.00 0.00 178.44 178.68 1hxj h MET 386 N 0.06 0.74 -0.17 1.13 2.86 -1.11 -0.72 114.93 117.72 1hxj h MET 386 Ca 0.01 -0.43 -0.01 0.00 -2.06 0.00 0.00 59.70 57.21 1hxj h MET 386 Cb 0.59 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.28 1hxj h MET 386 CO 0.04 1.05 0.07 0.82 1.06 0.00 0.00 176.91 179.96 1hxj h ILE 387 N 0.58 1.15 -0.91 -1.22 2.04 -0.89 0.32 117.51 118.58 1hxj h ILE 387 Ca 0.03 -0.44 0.02 0.00 1.00 0.00 0.00 64.86 65.47 1hxj h ILE 387 Cb 1.04 1.13 -0.05 0.00 -0.74 0.00 0.00 36.82 38.20 1hxj h ILE 387 CO 0.10 0.14 0.60 0.24 0.00 0.00 0.00 178.15 179.23 1hxj h MET 388 N 0.13 1.14 -0.03 2.37 2.86 -1.13 0.22 114.93 120.49 1hxj h MET 388 Ca 0.06 -0.07 -0.02 0.00 -2.06 0.00 0.00 59.70 57.60 1hxj h MET 388 Cb 0.16 -0.26 0.00 0.00 0.06 0.00 0.00 31.60 31.56 1hxj h MET 388 CO -0.01 0.76 -0.08 -0.22 1.06 0.00 0.00 176.91 178.43 1hxj h LYS 389 N 1.18 0.10 0.00 1.72 3.64 -0.74 -0.04 116.57 122.43 1hxj h LYS 389 Ca 0.35 -0.07 -0.17 0.00 -1.27 0.00 0.00 60.65 59.49 1hxj h LYS 389 Cb -0.05 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 31.76 1hxj h LYS 389 CO -0.09 0.68 -1.04 -0.91 -2.27 0.00 0.00 179.45 175.82 1hxj h ASN 390 N -0.47 0.00 0.00 4.20 -0.26 -0.26 -3.14 115.58 115.65 1hxj h ASN 390 Ca -0.00 0.00 -0.23 0.00 -0.56 0.00 0.00 56.30 55.51 1hxj h ASN 390 Cb 0.69 0.00 -0.04 0.00 -1.06 0.00 0.00 38.32 37.90 1hxj h ASN 390 CO 0.02 0.68 -1.88 1.17 -1.06 0.00 0.00 177.43 176.36 1hxj n LYS 391 N -3.12 1.08 -0.96 0.81 4.81 0.76 -4.76 118.16 116.77 1hxj n LYS 391 Ca -0.04 0.05 -0.10 0.00 -0.87 0.00 0.00 58.31 57.35 1hxj n LYS 391 Cb 0.85 -1.32 0.19 0.00 0.02 0.00 0.00 35.03 34.77 1hxj n LYS 391 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1hxj n TYR 392 N -2.75 1.60 -0.93 5.64 4.01 -1.12 -4.95 117.16 118.66 1hxj n TYR 392 Ca -0.25 -1.74 0.00 0.00 -0.16 0.00 0.00 57.90 55.76 1hxj n TYR 392 Cb 0.84 -0.61 0.00 0.00 -0.31 0.00 0.00 39.34 39.26 1hxj n TYR 392 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1hxj n GLY 393 N -1.11 0.54 4.01 2.72 0.00 -1.22 -4.25 105.19 105.87 1hxj n GLY 393 Ca 0.40 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.14 1hxj n GLY 393 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1hxj n ASN 394 N 0.00 -1.32 -4.72 1.61 4.05 -0.05 -4.94 115.26 109.90 1hxj n ASN 394 Ca 0.00 -0.99 -0.30 0.00 0.45 0.00 0.00 54.58 53.74 1hxj n ASN 394 Cb 0.00 -3.06 0.13 0.00 1.23 0.00 0.00 39.78 38.08 1hxj n ASN 394 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 1hxj s PRO 395 N -6.64 1.52 0.20 1.20 0.04 -1.26 -4.62 135.00 125.44 1hxj s PRO 395 Ca 0.22 1.13 -0.32 0.00 0.04 0.00 0.00 61.00 62.06 1hxj s PRO 395 Cb -0.12 -1.82 -0.12 0.00 0.04 0.00 0.00 34.50 32.48 1hxj s PRO 395 CO 0.89 -2.15 1.68 -2.30 0.04 0.00 0.00 177.00 175.16 1hxj n PRO 396 N -3.86 2.62 -4.86 0.56 -0.02 -1.26 -4.64 135.00 123.54 1hxj n PRO 396 Ca 0.09 0.94 -0.25 0.00 -2.02 0.00 0.00 63.50 62.26 1hxj n PRO 396 Cb 0.54 -2.77 -0.15 0.00 -0.02 0.00 0.00 33.50 31.09 1hxj n PRO 396 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1hxj s ILE 397 N 1.05 1.41 -0.07 4.25 1.01 -0.89 -1.70 121.20 126.24 1hxj s ILE 397 Ca 0.75 -0.76 0.04 0.00 0.00 0.00 0.00 60.65 60.68 1hxj s ILE 397 Cb -0.55 -1.17 0.00 0.00 0.01 0.00 0.00 42.46 40.75 1hxj s ILE 397 CO 0.34 0.40 -0.19 -0.31 0.00 0.00 0.00 174.94 175.18 1hxj s TYR 398 N -0.39 2.01 -0.87 3.97 1.51 -0.47 0.89 117.35 124.00 1hxj s TYR 398 Ca 0.06 -0.72 -0.22 0.00 -1.01 0.00 0.00 57.07 55.18 1hxj s TYR 398 Cb -0.07 -1.37 0.08 0.00 -0.11 0.00 0.00 41.96 40.49 1hxj s TYR 398 CO -0.00 -0.29 1.20 0.42 -1.11 0.00 0.00 175.55 175.76 1hxj s ILE 399 N 0.31 4.29 -1.48 2.71 -1.09 -0.36 -0.79 121.20 124.79 1hxj s ILE 399 Ca -0.12 -0.85 0.24 0.00 -2.23 0.00 0.00 60.65 57.69 1hxj s ILE 399 Cb -0.15 -4.85 0.45 0.00 -1.58 0.00 0.00 42.46 36.32 1hxj s ILE 399 CO 0.05 -1.66 1.80 0.35 -1.23 0.00 0.00 174.94 174.26 1hxj n THR 400 N 6.09 0.21 -3.64 2.92 -2.24 -0.78 0.15 114.28 117.00 1hxj n THR 400 Ca 0.18 0.05 -0.09 0.00 -2.27 0.00 0.00 64.05 61.93 1hxj n THR 400 Cb 0.49 -0.66 -0.07 0.00 -2.10 0.00 0.00 70.33 67.99 1hxj n THR 400 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1hxj s GLU 401 N -2.52 0.69 -0.29 -0.78 2.02 -1.22 -4.71 118.70 111.88 1hxj s GLU 401 Ca 0.24 1.02 -0.16 0.00 0.02 0.00 0.00 54.97 56.10 1hxj s GLU 401 Cb 0.16 0.23 0.16 0.00 0.10 0.00 0.00 34.13 34.77 1hxj s GLU 401 CO 0.36 -0.12 1.01 1.21 0.02 0.00 0.00 175.26 177.74 1hxj s ASN 402 N 1.07 -0.48 0.00 -0.19 3.84 -1.15 -1.29 114.94 116.75 1hxj s ASN 402 Ca -0.05 0.73 0.00 0.00 0.21 0.00 0.00 52.86 53.75 1hxj s ASN 402 Cb -0.05 1.29 0.00 0.00 -0.55 0.00 0.00 41.25 41.94 1hxj s ASN 402 CO -0.11 -0.11 0.00 0.61 -2.79 0.00 0.00 177.10 174.69 1hxj n GLY 403 N 3.94 -1.19 3.18 1.21 0.00 -1.26 -0.37 105.19 110.69 1hxj n GLY 403 Ca -0.16 -1.03 -0.11 0.00 0.00 0.00 0.00 46.02 44.72 1hxj n GLY 403 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1hxj s ILE 404 N -3.00 0.28 -0.22 -0.61 -4.36 -1.26 -4.89 121.20 107.14 1hxj s ILE 404 Ca 0.00 -1.93 0.02 0.00 -0.26 0.00 0.00 60.65 58.47 1hxj s ILE 404 Cb 0.00 -2.08 0.04 0.00 1.25 0.00 0.00 42.46 41.67 1hxj s ILE 404 CO 0.00 -0.46 -0.14 -0.83 0.24 0.00 0.00 174.94 173.75 1hxj s GLY 405 N -3.09 1.54 0.00 6.27 0.00 -1.26 -4.21 107.32 106.57 1hxj s GLY 405 Ca 0.24 -1.50 -0.30 0.00 0.00 0.00 0.00 44.72 43.16 1hxj s GLY 405 CO 0.03 0.46 1.22 0.99 0.00 0.00 0.00 173.10 175.79 1hxj s ASP 406 N 1.21 7.05 0.09 1.64 -0.00 -0.30 -3.70 116.67 122.65 1hxj s ASP 406 Ca -0.02 1.93 -0.31 0.00 -0.00 0.00 0.00 52.55 54.15 1hxj s ASP 406 Cb -0.17 -2.57 -0.07 0.00 -0.00 0.00 0.00 42.92 40.11 1hxj s ASP 406 CO -0.08 -0.54 1.37 -0.69 -0.00 0.00 0.00 175.17 175.22 1hxj s VAL 407 N 1.72 3.47 -0.36 -1.27 1.01 -1.26 -1.34 120.40 122.36 1hxj s VAL 407 Ca 0.58 1.03 0.02 0.00 0.00 0.00 0.00 61.98 63.60 1hxj s VAL 407 Cb -0.27 -3.66 0.15 0.00 0.00 0.00 0.00 36.38 32.60 1hxj s VAL 407 CO 0.26 0.06 0.31 -0.62 0.00 0.00 0.00 175.10 175.11 1hxj s ASP 408 N 1.25 1.85 0.39 3.32 3.68 0.55 -4.59 116.67 123.13 1hxj s ASP 408 Ca 0.64 -1.80 0.08 0.00 2.13 0.00 0.00 52.55 53.59 1hxj s ASP 408 Cb -0.35 0.20 -0.04 0.00 -1.45 0.00 0.00 42.92 41.28 1hxj s ASP 408 CO 0.29 -0.28 0.23 0.42 0.13 0.00 0.00 175.17 175.96 1hxj s THR 409 N 1.31 2.62 0.24 1.71 -4.23 -1.20 -4.17 115.64 111.92 1hxj s THR 409 Ca 0.17 -1.59 0.02 0.00 -1.18 0.00 0.00 61.69 59.11 1hxj s THR 409 Cb -0.18 -3.00 0.00 0.00 1.34 0.00 0.00 72.50 70.66 1hxj s THR 409 CO -0.02 -0.05 1.62 0.11 -0.54 0.00 0.00 174.62 175.73 1hxj h LYS 410 N 1.35 0.42 0.07 3.99 1.57 -1.98 0.01 116.57 122.00 1hxj h LYS 410 Ca -0.43 -0.22 -0.00 0.00 -1.87 0.00 0.00 60.65 58.13 1hxj h LYS 410 Cb 1.26 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.57 1hxj h LYS 410 CO 0.65 0.78 -0.03 0.93 -0.57 0.00 0.00 179.45 181.21 1hxj h GLU 411 N 0.34 -0.09 -2.52 3.15 5.08 -2.05 -3.35 114.58 115.14 1hxj h GLU 411 Ca 0.03 0.01 -0.61 0.00 -1.00 0.00 0.00 59.36 57.79 1hxj h GLU 411 Cb 0.92 0.02 -0.42 0.00 0.50 0.00 0.00 28.75 29.77 1hxj h GLU 411 CO 0.08 0.19 -0.61 2.41 -1.00 0.00 0.00 179.01 180.07 1hxj n THR 412 N -5.00 1.90 -1.77 1.13 -1.04 -1.18 -5.09 114.28 103.23 1hxj n THR 412 Ca -0.08 -5.01 -0.41 0.00 -2.04 0.00 0.00 64.05 56.51 1hxj n THR 412 Cb 0.18 -2.12 0.00 0.00 -1.82 0.00 0.00 70.33 66.57 1hxj n THR 412 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1hxj n PRO 413 N 1.33 2.61 -3.23 -2.82 -0.04 -0.02 -3.28 135.00 129.55 1hxj n PRO 413 Ca 0.26 0.92 -0.41 0.00 -0.04 0.00 0.00 63.50 64.23 1hxj n PRO 413 Cb 0.39 -2.65 -0.08 0.00 -0.04 0.00 0.00 33.50 31.13 1hxj n PRO 413 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1hxj s LEU 414 N -2.04 4.26 0.22 1.53 2.96 -1.26 -4.92 118.68 119.43 1hxj s LEU 414 Ca 0.54 0.11 -0.32 0.00 -0.22 0.00 0.00 54.13 54.24 1hxj s LEU 414 Cb -0.48 -2.61 -0.13 0.00 0.50 0.00 0.00 46.19 43.47 1hxj s LEU 414 CO 0.63 -0.44 1.51 -2.65 -1.32 0.00 0.00 176.35 174.09 1hxj n PRO 415 N 5.71 2.21 -0.32 0.98 -0.02 -1.26 -4.76 135.00 137.54 1hxj n PRO 415 Ca -0.04 0.79 0.14 0.00 -2.02 0.00 0.00 63.50 62.36 1hxj n PRO 415 Cb 0.49 -2.52 0.36 0.00 -0.02 0.00 0.00 33.50 31.81 1hxj n PRO 415 CO 0.00 0.00 0.00 1.98 1.98 0.00 0.00 175.50 179.46 1hxj h MET 416 N 5.06 0.69 -0.76 -0.52 4.05 -1.98 0.16 114.93 121.63 1hxj h MET 416 Ca -0.45 -0.04 -0.02 0.00 -0.28 0.00 0.00 59.70 58.90 1hxj h MET 416 Cb 1.26 -0.15 -0.04 0.00 -0.80 0.00 0.00 31.60 31.87 1hxj h MET 416 CO 0.82 0.45 0.38 1.49 0.23 0.00 0.00 176.91 180.29 1hxj h GLU 417 N 0.71 1.07 -0.03 0.39 4.81 -2.00 0.08 114.58 119.61 1hxj h GLU 417 Ca 0.54 -0.14 -0.17 0.00 -0.13 0.00 0.00 59.36 59.46 1hxj h GLU 417 Cb 0.91 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 30.07 1hxj h GLU 417 CO -0.31 0.81 -0.72 0.00 -0.73 0.00 0.00 179.01 178.06 1hxj h ALA 418 N 1.35 0.71 -0.27 2.92 0.00 -1.16 -2.30 119.26 120.51 1hxj h ALA 418 Ca 0.26 -0.62 -0.07 0.00 0.00 0.00 0.00 54.91 54.48 1hxj h ALA 418 Cb 0.08 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1hxj h ALA 418 CO -0.04 0.82 -0.15 0.00 0.00 0.00 0.00 179.25 179.88 1hxj h ALA 419 N 1.11 1.25 0.02 0.00 0.00 0.08 -2.87 119.26 118.84 1hxj h ALA 419 Ca -0.02 -0.28 -0.21 0.00 0.00 0.00 0.00 54.91 54.40 1hxj h ALA 419 Cb 1.28 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 1hxj h ALA 419 CO 0.11 0.49 -1.00 -0.07 0.00 0.00 0.00 179.25 178.78 1hxj h LEU 420 N 0.43 0.08 -5.79 0.00 3.38 -0.87 -3.32 115.31 109.21 1hxj h LEU 420 Ca 0.08 -0.08 -0.75 0.00 0.09 0.00 0.00 57.88 57.22 1hxj h LEU 420 Cb 0.51 -0.03 -0.13 0.00 0.09 0.00 0.00 40.66 41.10 1hxj h LEU 420 CO 0.03 1.03 2.33 0.59 0.09 0.00 0.00 178.44 182.51 1hxj n ASN 421 N -3.43 7.55 -3.16 -0.43 3.02 -0.88 -0.64 115.26 117.29 1hxj n ASN 421 Ca -0.02 -3.15 -0.36 0.00 -0.03 0.00 0.00 54.58 51.03 1hxj n ASN 421 Cb 0.92 -1.38 -0.05 0.00 -0.61 0.00 0.00 39.78 38.67 1hxj n ASN 421 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 1hxj n ASP 422 N 2.05 8.36 0.13 6.41 3.85 -1.25 -4.67 116.55 131.42 1hxj n ASP 422 Ca 0.58 -2.56 0.05 0.00 -0.71 0.00 0.00 54.79 52.16 1hxj n ASP 422 Cb 0.27 -1.54 0.51 0.00 -1.35 0.00 0.00 41.12 39.01 1hxj n ASP 422 CO 0.00 0.00 0.00 1.88 -1.01 0.00 0.00 177.20 178.07 1hxj h TYR 423 N 4.77 0.25 -0.33 2.11 -1.99 -1.90 -0.58 116.97 119.31 1hxj h TYR 423 Ca 0.80 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 61.51 1hxj h TYR 423 Cb 0.42 -0.08 -0.01 0.00 2.00 0.00 0.00 36.73 39.05 1hxj h TYR 423 CO 1.88 0.19 0.12 -0.22 -0.00 0.00 0.00 178.16 180.13 1hxj h LYS 424 N 0.27 0.51 -0.56 4.88 3.64 -1.99 0.75 116.57 124.05 1hxj h LYS 424 Ca 0.07 -0.10 -0.05 0.00 -1.27 0.00 0.00 60.65 59.30 1hxj h LYS 424 Cb 0.02 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.74 1hxj h LYS 424 CO -0.01 0.52 0.14 -0.09 -2.27 0.00 0.00 179.45 177.74 1hxj h ARG 425 N 0.39 0.90 -0.49 1.90 2.43 -1.74 -1.29 114.38 116.47 1hxj h ARG 425 Ca 0.11 -0.21 0.01 0.00 -0.81 0.00 0.00 59.98 59.08 1hxj h ARG 425 Cb 0.21 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.61 1hxj h ARG 425 CO -0.01 0.84 0.31 1.25 -1.51 0.00 0.00 179.97 180.85 1hxj h LEU 426 N 0.80 0.53 -0.04 3.80 5.85 -0.78 0.70 115.31 126.17 1hxj h LEU 426 Ca 0.18 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.90 1hxj h LEU 426 Cb 0.34 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.24 1hxj h LEU 426 CO 0.00 0.38 -0.02 -0.78 -0.34 0.00 0.00 178.44 177.68 1hxj h ASP 427 N 0.63 -0.06 -0.41 1.25 3.58 -0.61 -0.39 116.42 120.41 1hxj h ASP 427 Ca 0.19 0.02 0.04 0.00 0.42 0.00 0.00 57.03 57.69 1hxj h ASP 427 Cb -0.03 0.04 -0.04 0.00 1.72 0.00 0.00 39.33 41.01 1hxj h ASP 427 CO -0.06 -0.03 0.18 0.22 -2.88 0.00 0.00 179.24 176.67 1hxj h TYR 428 N -0.02 0.33 -0.16 0.28 5.03 -0.86 -1.07 116.97 120.51 1hxj h TYR 428 Ca 0.02 0.02 -0.00 0.00 2.58 0.00 0.00 58.73 61.35 1hxj h TYR 428 Cb 0.05 -0.09 -0.01 0.00 1.55 0.00 0.00 36.73 38.23 1hxj h TYR 428 CO -0.11 0.16 0.09 0.82 -1.32 0.00 0.00 178.16 177.79 1hxj h ILE 429 N 0.37 1.11 -0.74 1.81 2.04 -0.62 -2.31 117.51 119.18 1hxj h ILE 429 Ca 0.18 -0.30 0.03 0.00 1.00 0.00 0.00 64.86 65.77 1hxj h ILE 429 Cb 0.12 1.01 -0.04 0.00 -0.74 0.00 0.00 36.82 37.16 1hxj h ILE 429 CO -0.15 0.10 0.47 1.56 0.00 0.00 0.00 178.15 180.13 1hxj h GLN 430 N 0.15 0.89 -0.47 2.37 4.20 -0.82 -1.83 115.11 119.60 1hxj h GLN 430 Ca 0.06 -0.05 -0.09 0.00 0.06 0.00 0.00 58.65 58.63 1hxj h GLN 430 Cb 0.08 -0.20 -0.02 0.00 0.30 0.00 0.00 27.48 27.64 1hxj h GLN 430 CO -0.01 0.59 -0.06 0.00 -0.67 0.00 0.00 178.83 178.68 1hxj h ARG 431 N 0.92 0.82 -0.03 1.46 3.08 -1.04 -0.88 114.38 118.71 1hxj h ARG 431 Ca 0.29 -0.25 -0.18 0.00 0.07 0.00 0.00 59.98 59.91 1hxj h ARG 431 Cb 0.01 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 29.97 1hxj h ARG 431 CO -0.11 0.86 -0.77 0.45 -1.07 0.00 0.00 179.97 179.34 1hxj h HIS 432 N 0.75 0.35 -0.41 3.04 3.86 -1.14 -1.35 115.15 120.25 1hxj h HIS 432 Ca 0.13 -0.16 -0.11 0.00 -1.16 0.00 0.00 60.37 59.07 1hxj h HIS 432 Cb 0.54 -0.05 -0.01 0.00 1.06 0.00 0.00 27.41 28.95 1hxj h HIS 432 CO 0.03 0.92 -0.17 0.82 0.86 0.00 0.00 177.93 180.39 1hxj h ILE 433 N 0.16 1.28 -0.74 2.45 2.04 -1.21 -2.03 117.51 119.46 1hxj h ILE 433 Ca -0.03 -1.29 0.02 0.00 1.00 0.00 0.00 64.86 64.56 1hxj h ILE 433 Cb 1.34 1.25 -0.04 0.00 -0.74 0.00 0.00 36.82 38.64 1hxj h ILE 433 CO 0.12 0.43 0.49 0.00 0.00 0.00 0.00 178.15 179.19 1hxj h ALA 434 N 0.83 1.52 -0.18 1.87 0.00 -1.01 -0.72 119.26 121.57 1hxj h ALA 434 Ca 0.09 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 1hxj h ALA 434 Cb 0.72 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1hxj h ALA 434 CO 0.05 0.42 -0.19 1.15 0.00 0.00 0.00 179.25 180.68 1hxj h THR 435 N 0.95 1.22 -0.49 0.00 2.02 -0.74 -2.05 112.91 113.82 1hxj h THR 435 Ca 0.28 -1.02 -0.07 0.00 0.77 0.00 0.00 66.41 66.38 1hxj h THR 435 Cb -0.03 1.30 -0.02 0.00 -1.74 0.00 0.00 68.15 67.66 1hxj h THR 435 CO -0.07 0.32 0.02 -0.07 0.37 0.00 0.00 175.52 176.08 1hxj h LEU 436 N 0.28 0.76 -0.69 2.58 3.38 -0.44 0.75 115.31 121.93 1hxj h LEU 436 Ca 0.05 -0.17 -0.07 0.00 0.09 0.00 0.00 57.88 57.78 1hxj h LEU 436 Cb 0.51 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.03 1hxj h LEU 436 CO 0.03 0.81 0.15 0.50 0.09 0.00 0.00 178.44 180.03 1hxj h LYS 437 N 0.75 1.11 -0.52 1.13 1.63 -1.02 0.56 116.57 120.21 1hxj h LYS 437 Ca 0.15 -0.28 -0.09 0.00 -0.85 0.00 0.00 60.65 59.58 1hxj h LYS 437 Cb 0.42 -0.14 -0.02 0.00 -0.60 0.00 0.00 32.23 31.90 1hxj h LYS 437 CO 0.02 0.99 -0.04 0.93 -3.45 0.00 0.00 179.45 177.90 1hxj h GLU 438 N 1.04 0.95 -0.21 1.90 5.08 -0.78 -2.10 114.58 120.46 1hxj h GLU 438 Ca 0.21 -0.32 -0.13 0.00 -1.00 0.00 0.00 59.36 58.12 1hxj h GLU 438 Cb 0.39 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 1hxj h GLU 438 CO 0.01 0.98 -0.40 0.77 -1.00 0.00 0.00 179.01 179.37 1hxj h SER 439 N 0.82 0.52 -0.42 1.42 0.02 -0.59 -2.70 113.55 112.62 1hxj h SER 439 Ca 0.14 -0.23 -0.04 0.00 -0.84 0.00 0.00 61.79 60.83 1hxj h SER 439 Cb 0.58 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 62.96 1hxj h SER 439 CO 0.04 0.87 0.12 0.40 -1.14 0.00 0.00 176.83 177.11 1hxj h ILE 440 N 0.41 1.22 0.00 3.27 2.04 -0.75 -0.67 117.51 123.03 1hxj h ILE 440 Ca 0.04 -0.75 0.00 0.00 1.00 0.00 0.00 64.86 65.15 1hxj h ILE 440 Cb 0.88 0.92 0.00 0.00 -0.74 0.00 0.00 36.82 37.88 1hxj h ILE 440 CO 0.07 0.26 0.00 0.44 0.00 0.00 0.00 178.15 178.93 1hxj h ASP 441 N 0.53 0.00 -0.22 1.72 3.32 -1.19 -0.35 116.42 120.24 1hxj h ASP 441 Ca 0.13 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.18 1hxj h ASP 441 Cb 0.28 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.83 1hxj h ASP 441 CO -0.00 0.00 0.00 0.18 -1.72 0.00 0.00 179.24 177.70 1hxj n LEU 442 N -2.54 2.70 0.00 1.55 4.77 -0.38 -4.94 117.00 118.16 1hxj n LEU 442 Ca -0.01 -1.08 0.00 0.00 -0.03 0.00 0.00 56.01 54.89 1hxj n LEU 442 Cb 0.11 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.07 1hxj n LEU 442 CO 0.16 0.54 0.00 0.61 -1.33 0.00 0.00 177.39 177.37 1hxj n GLY 443 N 1.34 0.47 3.75 -0.72 0.00 -0.14 -5.07 105.19 104.83 1hxj n GLY 443 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 1hxj n GLY 443 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1hxj n SER 444 N 0.00 3.76 -1.89 1.61 2.88 -0.48 -4.89 113.62 114.61 1hxj n SER 444 Ca 0.00 1.18 -0.18 0.00 -1.33 0.00 0.00 58.87 58.54 1hxj n SER 444 Cb 0.00 -1.60 0.09 0.00 -0.75 0.00 0.00 64.21 61.95 1hxj n SER 444 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1hxj n ASN 445 N 1.42 4.85 -4.74 -3.46 5.15 -1.26 -4.57 115.26 112.65 1hxj n ASN 445 Ca 0.06 -3.14 -0.41 0.00 -0.60 0.00 0.00 54.58 50.48 1hxj n ASN 445 Cb 0.37 -0.85 -0.03 0.00 -0.53 0.00 0.00 39.78 38.75 1hxj n ASN 445 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1hxj s VAL 446 N -2.51 3.25 -0.15 3.44 0.11 -1.26 -2.11 120.40 121.16 1hxj s VAL 446 Ca 0.39 1.05 0.04 0.00 -2.93 0.00 0.00 61.98 60.52 1hxj s VAL 446 Cb 0.32 -3.67 -0.04 0.00 -1.53 0.00 0.00 36.38 31.45 1hxj s VAL 446 CO 0.04 0.17 0.15 0.00 -3.33 0.00 0.00 175.10 172.13 1hxj n GLN 447 N 2.40 5.37 -3.76 1.54 1.13 0.26 -4.85 117.38 119.47 1hxj n GLN 447 Ca 0.05 -0.00 -0.05 0.00 -1.94 0.00 0.00 57.00 55.06 1hxj n GLN 447 Cb 0.43 -0.70 -0.02 0.00 0.11 0.00 0.00 30.24 30.06 1hxj n GLN 447 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1hxj s GLY 448 N -1.42 -0.22 -0.07 1.08 0.00 -1.20 -1.75 107.32 103.75 1hxj s GLY 448 Ca 0.01 0.06 -0.03 0.00 0.00 0.00 0.00 44.72 44.77 1hxj s GLY 448 CO 0.15 -0.00 0.15 -0.47 0.00 0.00 0.00 173.10 172.92 1hxj s TYR 449 N -3.44 -0.17 -0.20 1.90 6.14 0.07 -1.22 117.35 120.42 1hxj s TYR 449 Ca 0.11 0.49 0.01 0.00 0.64 0.00 0.00 57.07 58.32 1hxj s TYR 449 Cb -0.02 -0.07 0.04 0.00 0.42 0.00 0.00 41.96 42.32 1hxj s TYR 449 CO 0.03 -0.16 -0.12 -0.06 0.64 0.00 0.00 175.55 175.87 1hxj s PHE 450 N 1.13 2.56 0.14 4.97 0.40 0.12 -1.06 117.98 126.24 1hxj s PHE 450 Ca -0.09 -1.67 -0.31 0.00 -0.60 0.00 0.00 56.93 54.26 1hxj s PHE 450 Cb -0.11 -1.71 -0.08 0.00 0.51 0.00 0.00 43.02 41.62 1hxj s PHE 450 CO -0.06 -0.77 1.39 0.00 0.70 0.00 0.00 175.22 176.49 1hxj s ALA 451 N 1.35 3.60 0.01 5.36 0.00 -0.48 -2.91 121.76 128.68 1hxj s ALA 451 Ca -0.01 1.14 -0.30 0.00 0.00 0.00 0.00 51.96 52.79 1hxj s ALA 451 Cb -0.16 -3.54 -0.04 0.00 0.00 0.00 0.00 23.12 19.38 1hxj s ALA 451 CO -0.09 -0.62 1.12 -0.46 0.00 0.00 0.00 175.76 175.72 1hxj s TRP 452 N 0.90 3.45 0.00 0.00 -0.11 0.50 -1.30 118.94 122.38 1hxj s TRP 452 Ca 0.63 1.42 0.00 0.00 1.22 0.00 0.00 56.10 59.37 1hxj s TRP 452 Cb -0.38 -3.32 0.00 0.00 -1.50 0.00 0.00 33.47 28.28 1hxj s TRP 452 CO 0.32 -0.85 0.00 0.45 -4.62 0.00 0.00 176.95 172.25 1hxj n SER 453 N 4.27 -1.96 0.21 5.86 2.88 0.33 -4.57 113.62 120.65 1hxj n SER 453 Ca 0.09 0.00 0.06 0.00 -1.33 0.00 0.00 58.87 57.69 1hxj n SER 453 Cb 0.48 -0.98 0.44 0.00 -0.75 0.00 0.00 64.21 63.40 1hxj n SER 453 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 1hxj h LEU 454 N 0.00 0.00 -8.37 2.46 5.85 -1.61 -1.66 115.31 111.98 1hxj h LEU 454 Ca 0.00 0.00 -0.37 0.00 0.84 0.00 0.00 57.88 58.35 1hxj h LEU 454 Cb 0.00 0.00 -0.21 0.00 0.37 0.00 0.00 40.66 40.82 1hxj h LEU 454 CO 0.00 0.31 -0.76 -0.76 -0.34 0.00 0.00 178.44 176.88 1hxj s LEU 455 N -7.47 2.29 0.21 2.25 1.43 -1.26 -1.98 118.68 114.15 1hxj s LEU 455 Ca -0.02 -0.63 -0.30 0.00 -1.03 0.00 0.00 54.13 52.16 1hxj s LEU 455 Cb 0.13 -0.42 -0.09 0.00 0.03 0.00 0.00 46.19 45.83 1hxj s LEU 455 CO 0.67 -0.12 1.40 -1.81 0.23 0.00 0.00 176.35 176.72 1hxj s ASP 456 N -1.79 6.75 0.09 2.29 1.01 -1.00 -3.77 116.67 120.24 1hxj s ASP 456 Ca -0.03 2.54 0.01 0.00 0.71 0.00 0.00 52.55 55.79 1hxj s ASP 456 Cb -0.09 -2.61 -0.00 0.00 1.01 0.00 0.00 42.92 41.22 1hxj s ASP 456 CO 0.02 -0.65 0.10 -0.46 0.21 0.00 0.00 175.17 174.39 1hxj n ASN 457 N 2.69 -0.26 -4.64 0.27 0.23 -1.26 -4.71 115.26 107.58 1hxj n ASN 457 Ca 0.07 -1.54 -0.43 0.00 -0.53 0.00 0.00 54.58 52.16 1hxj n ASN 457 Cb 0.41 0.54 -0.02 0.00 -2.08 0.00 0.00 39.78 38.63 1hxj n ASN 457 CO 0.00 0.00 0.00 0.12 -0.93 0.00 0.00 177.26 176.45 1hxj s PHE 458 N -3.31 2.79 -0.89 -2.53 5.36 -1.01 -4.74 117.98 113.66 1hxj s PHE 458 Ca 0.09 0.95 -0.03 0.00 -0.96 0.00 0.00 56.93 56.98 1hxj s PHE 458 Cb 0.00 -3.80 0.23 0.00 -0.34 0.00 0.00 43.02 39.11 1hxj s PHE 458 CO 0.07 -1.55 2.22 0.39 -1.46 0.00 0.00 175.22 174.88 1hxj n GLU 459 N 7.12 3.70 0.00 10.12 -0.58 0.11 -4.65 120.64 136.46 1hxj n GLU 459 Ca 0.14 -3.53 0.00 0.00 -0.42 0.00 0.00 57.16 53.35 1hxj n GLU 459 Cb 0.46 -2.36 0.00 0.00 -0.57 0.00 0.00 31.44 28.98 1hxj n GLU 459 CO 0.00 0.00 0.00 0.91 -0.48 0.00 0.00 177.13 177.56 1hxj n TRP 460 N 0.32 0.00 0.28 -0.32 7.02 -1.26 -1.50 117.44 121.99 1hxj n TRP 460 Ca 0.52 0.00 0.07 0.00 -1.02 0.00 0.00 57.50 57.07 1hxj n TRP 460 Cb 0.32 0.00 0.31 0.00 -2.42 0.00 0.00 31.31 29.51 1hxj n TRP 460 CO 0.00 0.00 0.00 1.97 -2.02 0.00 0.00 177.69 177.64 1hxj n PHE 461 N 14.00 0.29 1.07 -5.99 1.16 -1.26 -0.53 117.46 126.19 1hxj n PHE 461 Ca 0.00 0.13 0.13 0.00 -1.87 0.00 0.00 57.45 55.84 1hxj n PHE 461 Cb 0.00 -0.71 0.42 0.00 -1.61 0.00 0.00 39.48 37.59 1hxj n PHE 461 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1hxj n ALA 462 N -1.60 3.03 -0.87 1.98 0.00 -0.56 -0.21 120.51 122.28 1hxj n ALA 462 Ca 0.01 -0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.19 1hxj n ALA 462 Cb 0.11 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.30 1hxj n ALA 462 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hxj n GLY 463 N 1.46 3.37 1.61 0.00 0.00 0.31 -1.72 105.19 110.21 1hxj n GLY 463 Ca 0.08 -0.13 0.08 0.00 0.00 0.00 0.00 46.02 46.05 1hxj n GLY 463 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1hxj n PHE 464 N 14.00 1.65 1.12 1.61 3.01 -1.26 0.05 117.46 137.64 1hxj n PHE 464 Ca 0.00 -0.69 0.12 0.00 1.01 0.00 0.00 57.45 57.89 1hxj n PHE 464 Cb 0.00 -0.37 0.60 0.00 -0.01 0.00 0.00 39.48 39.71 1hxj n PHE 464 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 1hxj n THR 465 N 0.68 0.24 -4.21 4.37 -2.24 -0.70 -4.69 114.28 107.72 1hxj n THR 465 Ca 0.26 0.06 -0.20 0.00 -2.27 0.00 0.00 64.05 61.89 1hxj n THR 465 Cb 1.01 -0.66 -0.16 0.00 -2.10 0.00 0.00 70.33 68.43 1hxj n THR 465 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1hxj s GLU 466 N -2.61 0.93 -0.34 -0.78 2.02 -1.26 -0.33 118.70 116.33 1hxj s GLU 466 Ca 0.22 -0.14 -0.08 0.00 0.02 0.00 0.00 54.97 54.99 1hxj s GLU 466 Cb 0.16 -0.90 0.03 0.00 0.10 0.00 0.00 34.13 33.52 1hxj s GLU 466 CO 0.38 -0.07 0.12 1.03 0.02 0.00 0.00 175.26 176.74 1hxj s ARG 467 N 0.88 2.75 0.00 1.61 0.52 -0.45 -4.64 118.95 119.63 1hxj s ARG 467 Ca -0.12 -1.10 0.22 0.00 -0.52 0.00 0.00 55.73 54.21 1hxj s ARG 467 Cb -0.14 -3.51 0.10 0.00 0.52 0.00 0.00 34.95 31.92 1hxj s ARG 467 CO 0.01 -0.63 1.13 0.66 0.02 0.00 0.00 175.30 176.48 1hxj n TYR 468 N 4.86 0.00 -2.01 -0.53 4.02 -1.26 -1.15 117.16 121.09 1hxj n TYR 468 Ca -0.13 0.00 -0.33 0.00 -0.01 0.00 0.00 57.90 57.43 1hxj n TYR 468 Cb 0.46 0.00 0.02 0.00 -0.02 0.00 0.00 39.34 39.79 1hxj n TYR 468 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 1hxj s GLY 469 N -2.05 2.20 0.00 2.72 0.00 -1.25 -4.40 107.32 104.54 1hxj s GLY 469 Ca 0.22 0.48 0.24 0.00 0.00 0.00 0.00 44.72 45.66 1hxj s GLY 469 CO 0.38 0.81 1.25 0.29 0.00 0.00 0.00 173.10 175.84 1hxj n ILE 470 N -2.02 0.00 -4.41 0.90 -5.35 -0.62 -4.72 119.36 103.13 1hxj n ILE 470 Ca 0.09 -0.03 -0.28 0.00 -0.27 0.00 0.00 62.75 62.26 1hxj n ILE 470 Cb 0.52 0.56 -0.17 0.00 -1.74 0.00 0.00 39.64 38.81 1hxj n ILE 470 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 1hxj s VAL 471 N -2.91 1.45 0.35 7.28 1.01 -0.84 -2.38 120.40 124.36 1hxj s VAL 471 Ca 0.12 -0.61 -0.26 0.00 0.00 0.00 0.00 61.98 61.23 1hxj s VAL 471 Cb 0.17 -1.34 -0.09 0.00 0.00 0.00 0.00 36.38 35.13 1hxj s VAL 471 CO 0.73 0.43 1.05 -0.47 0.00 0.00 0.00 175.10 176.84 1hxj s TYR 472 N 1.03 3.42 -0.20 5.22 5.04 0.21 -2.37 117.35 129.70 1hxj s TYR 472 Ca -0.06 1.68 0.01 0.00 -2.44 0.00 0.00 57.07 56.26 1hxj s TYR 472 Cb -0.15 -3.15 0.05 0.00 0.35 0.00 0.00 41.96 39.06 1hxj s TYR 472 CO -0.02 -0.50 -0.09 0.08 -1.34 0.00 0.00 175.55 173.68 1hxj s VAL 473 N -1.49 1.61 -0.91 3.14 1.01 -1.26 -0.60 120.40 121.91 1hxj s VAL 473 Ca 0.53 -1.04 -0.20 0.00 0.00 0.00 0.00 61.98 61.27 1hxj s VAL 473 Cb -0.25 -1.72 0.11 0.00 0.00 0.00 0.00 36.38 34.52 1hxj s VAL 473 CO 0.32 0.12 1.15 -0.62 0.00 0.00 0.00 175.10 176.06 1hxj s ASP 474 N 1.40 6.55 0.62 3.32 -1.08 0.01 -4.84 116.67 122.66 1hxj s ASP 474 Ca -0.02 -1.82 0.40 0.00 -0.52 0.00 0.00 52.55 50.58 1hxj s ASP 474 Cb -0.17 -2.43 2.08 0.00 -1.46 0.00 0.00 42.92 40.95 1hxj s ASP 474 CO -0.08 -1.18 2.26 0.03 0.52 0.00 0.00 175.17 176.73 1hxj h ARG 475 N 9.07 0.00 -0.26 4.34 3.08 -1.88 -0.12 114.38 128.60 1hxj h ARG 475 Ca 0.11 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.99 1hxj h ARG 475 Cb 1.03 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.08 1hxj h ARG 475 CO 1.16 0.01 -0.49 -0.91 -1.07 0.00 0.00 179.97 178.68 1hxj h ASN 476 N 0.00 0.88 -3.14 7.04 2.35 -1.98 -3.38 115.58 117.35 1hxj h ASN 476 Ca -0.00 -0.54 -0.71 0.00 -0.55 0.00 0.00 56.30 54.51 1hxj h ASN 476 Cb 0.13 -0.25 -0.35 0.00 0.05 0.00 0.00 38.32 37.90 1hxj h ASN 476 CO 0.00 1.25 -0.03 -3.20 -1.65 0.00 0.00 177.43 173.80 1hxj n ASN 477 N -4.10 4.46 -3.21 5.81 5.15 -0.75 -4.82 115.26 117.80 1hxj n ASN 477 Ca -0.05 -3.20 -0.22 0.00 -0.60 0.00 0.00 54.58 50.51 1hxj n ASN 477 Cb 0.59 -1.04 0.00 0.00 -0.53 0.00 0.00 39.78 38.80 1hxj n ASN 477 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1hxj n ASN 478 N 2.02 -4.21 -3.10 1.20 5.03 -1.25 -1.70 115.26 113.24 1hxj n ASN 478 Ca 0.23 -0.31 -0.20 0.00 0.87 0.00 0.00 54.58 55.17 1hxj n ASN 478 Cb 0.37 -3.47 -0.00 0.00 -1.02 0.00 0.00 39.78 35.66 1hxj n ASN 478 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1hxj n THR 480 N -3.83 1.80 -3.46 0.00 -1.04 -0.69 -4.42 114.28 102.65 1hxj n THR 480 Ca -0.05 -0.45 -0.35 0.00 -2.04 0.00 0.00 64.05 61.15 1hxj n THR 480 Cb 0.56 -1.93 -0.06 0.00 -1.82 0.00 0.00 70.33 67.09 1hxj n THR 480 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 1hxj s ARG 481 N -1.76 3.89 -0.03 -2.82 3.00 -1.26 -0.81 118.95 119.15 1hxj s ARG 481 Ca 0.56 0.36 -0.00 0.00 0.00 0.00 0.00 55.73 56.64 1hxj s ARG 481 Cb -0.49 -2.99 0.03 0.00 0.00 0.00 0.00 34.95 31.49 1hxj s ARG 481 CO 0.61 0.54 0.02 0.71 0.00 0.00 0.00 175.30 177.18 1hxj s TYR 482 N -1.39 0.21 0.21 -0.53 1.51 0.23 -4.96 117.35 112.64 1hxj s TYR 482 Ca 0.34 0.08 -0.30 0.00 -1.01 0.00 0.00 57.07 56.17 1hxj s TYR 482 Cb -0.15 -0.41 -0.09 0.00 -0.11 0.00 0.00 41.96 41.19 1hxj s TYR 482 CO 0.18 -0.15 1.40 -1.64 -1.11 0.00 0.00 175.55 174.23 1hxj s MET 483 N 1.37 4.31 0.40 -0.62 -1.94 -1.26 0.65 119.30 122.21 1hxj s MET 483 Ca -0.05 2.20 0.08 0.00 -1.71 0.00 0.00 55.69 56.21 1hxj s MET 483 Cb -0.13 -3.15 0.00 0.00 2.01 0.00 0.00 34.83 33.56 1hxj s MET 483 CO -0.03 -0.38 0.53 0.15 -0.01 0.00 0.00 175.02 175.29 1hxj s LYS 484 N -0.03 2.86 0.31 2.03 1.02 -1.00 -4.84 119.74 120.09 1hxj s LYS 484 Ca 0.60 -1.22 0.03 0.00 0.02 0.00 0.00 55.97 55.40 1hxj s LYS 484 Cb -0.40 -2.74 0.63 0.00 -0.52 0.00 0.00 37.83 34.80 1hxj s LYS 484 CO 0.39 -0.20 1.88 0.93 -0.92 0.00 0.00 175.35 177.43 1hxj h GLU 485 N 0.72 0.89 -0.27 1.68 4.39 -1.17 -0.78 114.58 120.04 1hxj h GLU 485 Ca -0.41 -0.05 0.01 0.00 0.34 0.00 0.00 59.36 59.24 1hxj h GLU 485 Cb 1.27 -0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 29.71 1hxj h GLU 485 CO 0.47 0.59 0.16 0.66 -1.16 0.00 0.00 179.01 179.73 1hxj h SER 486 N 0.91 0.26 -0.65 1.42 4.64 -1.83 -0.59 113.55 117.72 1hxj h SER 486 Ca 0.44 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.75 1hxj h SER 486 Cb 0.44 -0.05 -0.03 0.00 -0.31 0.00 0.00 62.40 62.44 1hxj h SER 486 CO -0.20 0.19 0.38 0.00 -0.87 0.00 0.00 176.83 176.34 1hxj h ALA 487 N 1.12 0.83 -0.72 5.18 0.00 -1.34 -1.14 119.26 123.20 1hxj h ALA 487 Ca 0.11 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1hxj h ALA 487 Cb -0.01 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.49 1hxj h ALA 487 CO -0.05 0.33 0.38 0.87 0.00 0.00 0.00 179.25 180.77 1hxj h LYS 488 N 0.89 1.00 -0.30 0.00 1.57 -0.73 0.23 116.57 119.23 1hxj h LYS 488 Ca 0.23 -0.12 -0.11 0.00 -1.87 0.00 0.00 60.65 58.78 1hxj h LYS 488 Cb -0.00 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.11 1hxj h LYS 488 CO -0.04 0.75 -0.25 2.35 -0.57 0.00 0.00 179.45 181.69 1hxj h TRP 489 N 1.00 0.83 -0.69 -1.35 7.01 -0.68 -2.25 115.95 119.82 1hxj h TRP 489 Ca 0.25 -0.24 -0.00 0.00 2.11 0.00 0.00 58.89 61.01 1hxj h TRP 489 Cb 0.05 -0.18 -0.03 0.00 -2.10 0.00 0.00 29.16 26.90 1hxj h TRP 489 CO 0.01 0.97 0.41 -0.07 -2.79 0.00 0.00 178.44 176.97 1hxj h LEU 490 N 0.45 0.82 -0.04 0.65 3.38 -0.79 0.33 115.31 120.11 1hxj h LEU 490 Ca 0.05 -0.04 0.01 0.00 0.09 0.00 0.00 57.88 57.99 1hxj h LEU 490 Cb 0.81 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 1hxj h LEU 490 CO 0.06 0.64 -0.02 0.50 0.09 0.00 0.00 178.44 179.71 1hxj h LYS 491 N 0.95 -0.02 -0.53 1.13 3.64 -0.74 -1.12 116.57 119.88 1hxj h LYS 491 Ca 0.25 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.61 1hxj h LYS 491 Cb -0.04 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.77 1hxj h LYS 491 CO -0.05 -0.02 0.23 0.93 -2.27 0.00 0.00 179.45 178.28 1hxj h GLU 492 N -0.02 0.78 -0.15 1.90 5.08 -0.74 -2.21 114.58 119.21 1hxj h GLU 492 Ca 0.03 -0.13 0.05 0.00 -1.00 0.00 0.00 59.36 58.31 1hxj h GLU 492 Cb 0.06 -0.13 -0.05 0.00 0.50 0.00 0.00 28.75 29.12 1hxj h GLU 492 CO -0.06 0.66 -0.20 0.35 -1.00 0.00 0.00 179.01 178.77 1hxj h PHE 493 N 0.71 -0.51 0.00 4.33 3.04 0.02 -2.72 116.94 121.81 1hxj h PHE 493 Ca 0.18 0.03 -0.08 0.00 3.98 0.00 0.00 57.97 62.07 1hxj h PHE 493 Cb 0.16 0.25 -0.01 0.00 2.56 0.00 0.00 35.95 38.90 1hxj h PHE 493 CO 0.00 -0.27 -0.39 -0.91 -2.02 0.00 0.00 178.31 174.72 1hxj h ASN 494 N -0.24 0.00 0.00 0.41 2.35 -1.12 -3.38 115.58 113.59 1hxj h ASN 494 Ca 0.10 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.85 1hxj h ASN 494 Cb 0.39 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.76 1hxj h ASN 494 CO -0.29 0.39 0.00 0.35 -1.65 0.00 0.00 177.43 176.23