#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ewx n GLY 3 N 0.00 -1.25 0.10 0.23 0.00 0.56 -2.53 105.19 102.30 1ewx n GLY 3 Ca 0.00 0.04 0.13 0.00 0.00 0.00 0.00 46.02 46.18 1ewx n GLY 3 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1ewx h LEU 4 N 0.00 0.00 -1.76 0.99 3.38 -1.84 -3.33 115.31 112.75 1ewx h LEU 4 Ca 0.00 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 1ewx h LEU 4 Cb 0.37 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 1ewx h LEU 4 CO 0.00 0.03 0.08 -0.78 0.09 0.00 0.00 178.44 177.85 1ewx h ASP 5 N 0.00 0.20 0.64 -0.43 3.58 -1.75 -1.24 116.42 117.42 1ewx h ASP 5 Ca 0.00 -0.01 -0.05 0.00 0.42 0.00 0.00 57.03 57.38 1ewx h ASP 5 Cb 0.76 -0.05 -0.01 0.00 1.72 0.00 0.00 39.33 41.75 1ewx h ASP 5 CO 0.00 0.18 -0.26 0.07 -2.88 0.00 0.00 179.24 176.35 1ewx h LYS 6 N 0.23 0.00 0.00 0.28 2.10 -1.80 -1.88 116.57 115.51 1ewx h LYS 6 Ca 0.06 0.00 -0.19 0.00 -2.00 0.00 0.00 60.65 58.52 1ewx h LYS 6 Cb 0.04 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 31.34 1ewx h LYS 6 CO -0.01 0.26 -1.49 0.66 -2.00 0.00 0.00 179.45 176.87 1ewx n TYR 7 N -3.62 0.95 -3.21 0.07 4.01 -0.56 -4.52 117.16 110.29 1ewx n TYR 7 Ca -0.01 0.32 -0.23 0.00 -0.16 0.00 0.00 57.90 57.82 1ewx n TYR 7 Cb 0.39 -1.09 -0.06 0.00 -0.31 0.00 0.00 39.34 38.27 1ewx n TYR 7 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1ewx n LEU 8 N -2.90 1.49 -4.65 7.72 4.77 -0.67 -4.72 117.00 118.03 1ewx n LEU 8 Ca -0.11 -5.02 -0.45 0.00 -0.03 0.00 0.00 56.01 50.40 1ewx n LEU 8 Cb 0.87 0.28 -0.04 0.00 -2.33 0.00 0.00 43.42 42.21 1ewx n LEU 8 CO 0.43 2.15 1.62 -2.65 -1.33 0.00 0.00 177.39 177.62 1ewx n PRO 9 N 0.84 2.39 -0.97 3.23 -0.02 -0.72 -1.89 135.00 137.86 1ewx n PRO 9 Ca 0.25 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.57 1ewx n PRO 9 Cb 0.52 -2.90 0.00 0.00 -0.02 0.00 0.00 33.50 31.11 1ewx n PRO 9 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ewx n GLY 10 N 4.81 0.51 3.50 -1.23 0.00 -1.26 -4.97 105.19 106.55 1ewx n GLY 10 Ca 0.24 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.83 1ewx n GLY 10 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ewx s ILE 11 N -2.24 4.42 -0.28 -0.61 1.01 -0.79 -4.87 121.20 117.83 1ewx s ILE 11 Ca 0.00 0.07 0.22 0.00 0.00 0.00 0.00 60.65 60.94 1ewx s ILE 11 Cb 0.00 -4.54 0.09 0.00 0.01 0.00 0.00 42.46 38.02 1ewx s ILE 11 CO 0.00 -1.15 1.21 -0.33 0.00 0.00 0.00 174.94 174.67 1ewx h GLU 12 N 9.33 0.00 -4.86 2.79 5.08 -1.93 -3.44 114.58 121.55 1ewx h GLU 12 Ca -0.27 0.00 -0.35 0.00 -1.00 0.00 0.00 59.36 57.74 1ewx h GLU 12 Cb 1.08 0.00 -0.23 0.00 0.50 0.00 0.00 28.75 30.09 1ewx h GLU 12 CO 1.09 0.05 -0.76 0.15 -1.00 0.00 0.00 179.01 178.54 1ewx s LYS 13 N -3.26 0.67 0.20 2.33 3.01 -1.26 -0.28 119.74 121.14 1ewx s LYS 13 Ca 0.02 -0.70 0.11 0.00 -1.01 0.00 0.00 55.97 54.39 1ewx s LYS 13 Cb 0.08 -0.57 -0.04 0.00 -1.01 0.00 0.00 37.83 36.28 1ewx s LYS 13 CO 0.75 0.13 -0.23 -0.51 0.51 0.00 0.00 175.35 176.01 1ewx s LEU 14 N -1.27 2.48 0.43 3.17 1.43 -0.04 -4.71 118.68 120.18 1ewx s LEU 14 Ca -0.04 -0.86 -0.22 0.00 -1.03 0.00 0.00 54.13 51.98 1ewx s LEU 14 Cb -0.08 -1.20 -0.09 0.00 0.03 0.00 0.00 46.19 44.84 1ewx s LEU 14 CO 0.01 0.11 1.02 -0.13 0.23 0.00 0.00 176.35 177.59 1ewx s ARG 15 N -2.74 4.07 -0.17 1.70 1.81 0.44 -0.15 118.95 123.91 1ewx s ARG 15 Ca 0.22 1.36 -0.05 0.00 -1.72 0.00 0.00 55.73 55.54 1ewx s ARG 15 Cb -0.08 -2.32 0.08 0.00 -0.45 0.00 0.00 34.95 32.19 1ewx s ARG 15 CO 0.11 -0.20 0.29 0.50 -0.68 0.00 0.00 175.30 175.32 1ewx s ARG 16 N -2.88 0.20 6.95 3.54 3.52 -0.19 -1.62 118.95 128.47 1ewx s ARG 16 Ca 0.62 0.65 0.00 0.00 -0.13 0.00 0.00 55.73 56.86 1ewx s ARG 16 Cb -0.17 -0.28 0.00 0.00 -1.56 0.00 0.00 34.95 32.94 1ewx s ARG 16 CO 0.21 -0.40 0.00 0.41 -0.81 0.00 0.00 175.30 174.71 1ewx n GLY 17 N 5.35 3.71 1.24 8.12 0.00 -1.26 -0.56 105.19 121.79 1ewx n GLY 17 Ca -0.06 0.01 0.09 0.00 0.00 0.00 0.00 46.02 46.06 1ewx n GLY 17 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ewx n ASP 18 N 5.77 4.13 0.00 1.61 8.00 -1.26 -4.95 116.55 129.84 1ewx n ASP 18 Ca 0.00 -2.37 0.00 0.00 0.71 0.00 0.00 54.79 53.13 1ewx n ASP 18 Cb 0.00 -0.48 0.00 0.00 -0.02 0.00 0.00 41.12 40.62 1ewx n ASP 18 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ewx n GLY 19 N 0.81 5.52 3.08 0.44 0.00 0.27 -5.18 105.19 110.15 1ewx n GLY 19 Ca 0.22 -1.64 -0.09 0.00 0.00 0.00 0.00 46.02 44.51 1ewx n GLY 19 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1ewx s GLU 20 N 1.81 0.54 0.12 1.61 -1.05 -1.26 -1.03 118.70 119.45 1ewx s GLU 20 Ca 0.00 -0.83 0.05 0.00 -0.15 0.00 0.00 54.97 54.04 1ewx s GLU 20 Cb 0.00 0.20 -0.04 0.00 -0.44 0.00 0.00 34.13 33.86 1ewx s GLU 20 CO 0.00 -0.12 -0.12 0.14 0.95 0.00 0.00 175.26 176.11 1ewx s VAL 21 N -2.68 1.21 0.29 1.83 -7.23 0.79 -4.78 120.40 109.82 1ewx s VAL 21 Ca -0.04 -1.76 -0.25 0.00 -1.81 0.00 0.00 61.98 58.11 1ewx s VAL 21 Cb -0.01 -1.55 -0.09 0.00 0.56 0.00 0.00 36.38 35.29 1ewx s VAL 21 CO -0.05 -0.51 0.89 -1.61 -0.31 0.00 0.00 175.10 173.50 1ewx s GLU 22 N -2.90 4.54 0.40 4.82 2.02 -1.26 -0.86 118.70 125.45 1ewx s GLU 22 Ca 0.10 1.24 0.09 0.00 0.02 0.00 0.00 54.97 56.41 1ewx s GLU 22 Cb -0.03 -2.88 0.83 0.00 0.10 0.00 0.00 34.13 32.15 1ewx s GLU 22 CO 0.02 0.34 1.98 0.28 0.02 0.00 0.00 175.26 177.90 1ewx h VAL 23 N 2.72 1.14 -0.00 2.63 2.07 -0.93 -2.00 116.25 121.88 1ewx h VAL 23 Ca -0.47 -0.51 0.00 0.00 0.82 0.00 0.00 66.70 66.54 1ewx h VAL 23 Cb 1.19 0.93 -0.00 0.00 -1.52 0.00 0.00 31.29 31.89 1ewx h VAL 23 CO 0.65 0.18 0.08 0.07 0.02 0.00 0.00 177.57 178.57 1ewx h LYS 24 N 0.34 0.00 0.00 1.57 2.10 -1.93 -0.87 116.57 117.78 1ewx h LYS 24 Ca 0.08 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.73 1ewx h LYS 24 Cb 0.19 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.52 1ewx h LYS 24 CO 0.00 0.00 0.00 -1.13 -2.00 0.00 0.00 179.45 176.32 1ewx n SER 25 N -3.04 0.42 -0.47 7.07 3.41 -0.75 -2.01 113.62 118.25 1ewx n SER 25 Ca -0.03 0.62 0.09 0.00 -0.26 0.00 0.00 58.87 59.29 1ewx n SER 25 Cb 0.14 -0.70 0.35 0.00 -0.26 0.00 0.00 64.21 63.74 1ewx n SER 25 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1ewx n LEU 26 N -1.98 1.40 -4.59 1.04 4.77 -0.33 -4.96 117.00 112.35 1ewx n LEU 26 Ca 0.02 -0.61 -0.50 0.00 -0.03 0.00 0.00 56.01 54.89 1ewx n LEU 26 Cb 0.18 -0.11 -0.05 0.00 -2.33 0.00 0.00 43.42 41.11 1ewx n LEU 26 CO 0.16 0.30 0.84 0.00 -1.33 0.00 0.00 177.39 177.36 1ewx n ALA 27 N 0.17 -0.75 -0.09 -1.18 0.00 -0.85 -1.31 120.51 116.50 1ewx n ALA 27 Ca 0.15 0.49 0.00 0.00 0.00 0.00 0.00 53.44 54.07 1ewx n ALA 27 Cb 0.27 -2.07 0.00 0.00 0.00 0.00 0.00 19.45 17.65 1ewx n ALA 27 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ewx n GLY 28 N 2.33 2.02 3.95 0.00 0.00 -1.26 -5.02 105.19 107.20 1ewx n GLY 28 Ca 0.17 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.95 1ewx n GLY 28 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ewx s LYS 29 N -0.28 2.96 0.04 1.61 1.02 -0.42 -4.91 119.74 119.76 1ewx s LYS 29 Ca 0.00 -0.45 -0.23 0.00 0.02 0.00 0.00 55.97 55.32 1ewx s LYS 29 Cb 0.00 -2.50 -0.06 0.00 -0.52 0.00 0.00 37.83 34.75 1ewx s LYS 29 CO 0.00 -0.41 0.68 -1.17 -0.92 0.00 0.00 175.35 173.52 1ewx s LEU 30 N -4.66 4.46 -0.13 3.17 2.96 -0.80 -1.28 118.68 122.40 1ewx s LEU 30 Ca 0.51 1.33 0.02 0.00 -0.22 0.00 0.00 54.13 55.77 1ewx s LEU 30 Cb -0.10 -3.08 0.01 0.00 0.50 0.00 0.00 46.19 43.52 1ewx s LEU 30 CO 0.39 0.10 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.64 1ewx s VAL 31 N -0.35 1.84 -0.22 1.68 1.01 0.80 -1.45 120.40 123.71 1ewx s VAL 31 Ca 0.34 -0.84 -0.10 0.00 0.00 0.00 0.00 61.98 61.38 1ewx s VAL 31 Cb -0.20 -1.65 -0.05 0.00 0.00 0.00 0.00 36.38 34.49 1ewx s VAL 31 CO 0.21 0.51 0.13 -0.36 0.00 0.00 0.00 175.10 175.58 1ewx s PHE 32 N 0.94 3.32 -0.11 5.22 0.08 0.30 -0.59 117.98 127.14 1ewx s PHE 32 Ca -0.05 0.19 -0.23 0.00 0.12 0.00 0.00 56.93 56.95 1ewx s PHE 32 Cb -0.15 -2.21 -0.03 0.00 -0.57 0.00 0.00 43.02 40.06 1ewx s PHE 32 CO -0.03 0.12 0.72 -0.06 -0.10 0.00 0.00 175.22 175.87 1ewx s PHE 33 N 0.79 3.51 -0.35 0.36 0.08 0.96 0.29 117.98 123.61 1ewx s PHE 33 Ca 0.07 1.20 -0.03 0.00 0.12 0.00 0.00 56.93 58.30 1ewx s PHE 33 Cb -0.13 -2.85 0.08 0.00 -0.57 0.00 0.00 43.02 39.55 1ewx s PHE 33 CO 0.02 -0.03 0.10 -0.47 -0.10 0.00 0.00 175.22 174.74 1ewx s TYR 34 N 1.28 3.42 -0.24 0.36 5.04 0.02 -1.22 117.35 126.02 1ewx s TYR 34 Ca 0.36 -2.10 -0.18 0.00 -2.44 0.00 0.00 57.07 52.72 1ewx s TYR 34 Cb -0.17 -2.65 -0.03 0.00 0.35 0.00 0.00 41.96 39.46 1ewx s TYR 34 CO 0.16 -0.88 0.49 -0.06 -1.34 0.00 0.00 175.55 173.92 1ewx s PHE 35 N 1.21 3.30 0.34 4.97 0.40 -0.21 -0.26 117.98 127.73 1ewx s PHE 35 Ca 0.02 0.65 -0.18 0.00 -0.60 0.00 0.00 56.93 56.82 1ewx s PHE 35 Cb -0.21 -2.67 0.05 0.00 0.51 0.00 0.00 43.02 40.69 1ewx s PHE 35 CO -0.02 -0.20 0.80 0.45 0.70 0.00 0.00 175.22 176.94 1ewx s SER 36 N 1.40 -0.06 -0.00 1.36 0.15 -1.21 -1.99 113.70 113.34 1ewx s SER 36 Ca 0.21 -0.96 -0.27 0.00 0.70 0.00 0.00 55.95 55.63 1ewx s SER 36 Cb -0.15 0.79 0.06 0.00 -1.71 0.00 0.00 66.02 65.00 1ewx s SER 36 CO 0.09 -1.53 0.60 0.00 1.20 0.00 0.00 173.24 173.60 1ewx s ALA 37 N -2.71 -1.56 0.39 5.45 0.00 -1.26 -1.08 121.76 121.00 1ewx s ALA 37 Ca 0.15 0.97 0.27 0.00 0.00 0.00 0.00 51.96 53.35 1ewx s ALA 37 Cb -0.05 0.19 1.40 0.00 0.00 0.00 0.00 23.12 24.67 1ewx s ALA 37 CO 0.10 -0.43 2.05 0.66 0.00 0.00 0.00 175.76 178.13 1ewx h SER 38 N 2.92 0.00 0.30 0.00 4.64 -1.94 -2.50 113.55 116.96 1ewx h SER 38 Ca -0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 1ewx h SER 38 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1ewx h SER 38 CO 0.39 0.13 -0.16 -2.67 -0.87 0.00 0.00 176.83 173.65 1ewx n TRP 39 N -3.63 0.00 -3.03 4.77 4.27 -1.26 -4.87 117.44 113.69 1ewx n TRP 39 Ca -0.02 0.00 -0.41 0.00 -3.89 0.00 0.00 57.50 53.18 1ewx n TRP 39 Cb 0.25 -0.15 -0.06 0.00 -1.36 0.00 0.00 31.31 29.99 1ewx n TRP 39 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1ewx h PRO 41 N 8.01 -0.08 0.00 0.00 0.11 -1.89 -2.77 132.00 135.39 1ewx h PRO 41 Ca -0.25 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1ewx h PRO 41 Cb 1.11 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1ewx h PRO 41 CO 0.83 -0.05 0.00 -1.00 -0.21 0.00 0.00 178.00 177.57 1ewx h PRO 42 N -0.08 0.00 -0.11 1.05 0.13 -1.94 -2.98 132.00 128.07 1ewx h PRO 42 Ca 0.06 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 65.00 1ewx h PRO 42 Cb 0.17 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.30 1ewx h PRO 42 CO -0.15 0.00 -0.73 0.00 -0.23 0.00 0.00 178.00 176.89 1ewx h ARG 44 N 0.36 0.15 0.00 0.00 2.43 -1.50 -1.61 114.38 114.21 1ewx h ARG 44 Ca -0.03 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 1ewx h ARG 44 Cb 1.32 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.83 1ewx h ARG 44 CO 0.13 0.10 -0.45 0.78 -1.51 0.00 0.00 179.97 179.03 1ewx h GLY 45 N 0.15 0.00 1.27 2.80 0.00 -1.77 -3.33 103.07 102.19 1ewx h GLY 45 Ca 0.29 0.00 -0.30 0.00 0.00 0.00 0.00 47.33 47.32 1ewx h GLY 45 CO -0.44 0.00 -1.25 -2.75 0.00 0.00 0.00 176.54 172.09 1ewx h PHE 46 N 0.00 0.98 -0.72 5.60 3.57 -1.44 -3.35 116.94 121.59 1ewx h PHE 46 Ca 0.00 -0.62 0.13 0.00 3.53 0.00 0.00 57.97 61.01 1ewx h PHE 46 Cb 0.83 -0.08 -0.09 0.00 2.79 0.00 0.00 35.95 39.40 1ewx h PHE 46 CO 0.00 1.46 0.28 1.15 -2.23 0.00 0.00 178.31 178.97 1ewx h THR 47 N 0.26 0.68 0.00 4.41 2.02 -1.43 0.22 112.91 119.08 1ewx h THR 47 Ca -0.19 -0.15 -0.08 0.00 0.77 0.00 0.00 66.41 66.77 1ewx h THR 47 Cb 1.92 0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 68.53 1ewx h THR 47 CO 0.24 0.08 -0.37 1.55 0.37 0.00 0.00 175.52 177.39 1ewx h PRO 48 N 0.44 0.00 -0.22 6.66 0.13 -1.75 0.60 132.00 137.85 1ewx h PRO 48 Ca 0.39 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 65.38 1ewx h PRO 48 Cb 0.56 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.68 1ewx h PRO 48 CO -0.38 0.37 -0.45 1.96 -0.23 0.00 0.00 178.00 179.27 1ewx h GLN 49 N 0.00 0.57 -0.09 0.86 4.20 -0.75 -0.78 115.11 119.13 1ewx h GLN 49 Ca -0.00 -0.31 -0.12 0.00 0.06 0.00 0.00 58.65 58.27 1ewx h GLN 49 Cb 0.68 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.46 1ewx h GLN 49 CO 0.05 0.90 -0.50 1.25 -0.67 0.00 0.00 178.83 179.86 1ewx h LEU 50 N 0.46 0.25 -0.47 1.46 5.85 0.11 -2.04 115.31 120.92 1ewx h LEU 50 Ca 0.03 -0.12 -0.08 0.00 0.84 0.00 0.00 57.88 58.55 1ewx h LEU 50 Cb 0.96 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.91 1ewx h LEU 50 CO 0.09 0.71 -0.03 0.40 -0.34 0.00 0.00 178.44 179.26 1ewx h ILE 51 N 0.18 1.27 -0.44 4.05 2.04 -0.63 0.61 117.51 124.58 1ewx h ILE 51 Ca 0.01 -1.12 0.01 0.00 1.00 0.00 0.00 64.86 64.76 1ewx h ILE 51 Cb 0.95 1.05 -0.02 0.00 -0.74 0.00 0.00 36.82 38.06 1ewx h ILE 51 CO 0.08 0.39 0.28 -0.08 0.00 0.00 0.00 178.15 178.81 1ewx h GLU 52 N 0.70 0.55 -0.68 2.37 4.81 -1.03 0.19 114.58 121.50 1ewx h GLU 52 Ca 0.13 -0.03 -0.08 0.00 -0.13 0.00 0.00 59.36 59.25 1ewx h GLU 52 Cb 0.55 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.78 1ewx h GLU 52 CO 0.03 0.36 0.12 0.35 -0.73 0.00 0.00 179.01 179.15 1ewx h PHE 53 N 0.57 1.19 -0.25 0.92 3.57 -1.07 -2.17 116.94 119.69 1ewx h PHE 53 Ca 0.17 -0.16 -0.03 0.00 3.53 0.00 0.00 57.97 61.48 1ewx h PHE 53 Cb -0.04 -0.33 -0.01 0.00 2.79 0.00 0.00 35.95 38.37 1ewx h PHE 53 CO -0.05 0.98 0.05 -0.92 -2.23 0.00 0.00 178.31 176.14 1ewx h TYR 54 N 1.05 0.43 -0.59 0.41 5.03 -0.40 -0.78 116.97 122.11 1ewx h TYR 54 Ca 0.21 -0.05 -0.02 0.00 2.58 0.00 0.00 58.73 61.45 1ewx h TYR 54 Cb 0.43 -0.12 -0.03 0.00 1.55 0.00 0.00 36.73 38.56 1ewx h TYR 54 CO 0.03 0.51 0.30 -0.44 -1.32 0.00 0.00 178.16 177.24 1ewx h ASP 55 N 0.23 0.74 -0.27 -2.11 3.32 -0.51 0.35 116.42 118.18 1ewx h ASP 55 Ca 0.08 -0.07 -0.14 0.00 0.02 0.00 0.00 57.03 56.92 1ewx h ASP 55 Cb 0.30 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 39.66 1ewx h ASP 55 CO 0.00 0.62 -0.39 0.11 -1.72 0.00 0.00 179.24 177.86 1ewx h LYS 56 N 0.83 0.75 0.00 3.56 1.57 -1.22 -3.41 116.57 118.65 1ewx h LYS 56 Ca 0.21 -0.44 0.00 0.00 -1.87 0.00 0.00 60.65 58.55 1ewx h LYS 56 Cb 0.06 0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.41 1ewx h LYS 56 CO -0.03 1.06 0.00 1.19 -0.57 0.00 0.00 179.45 181.10 1ewx n PHE 57 N -4.18 0.00 0.15 -1.35 3.72 -0.31 -4.71 117.46 110.78 1ewx n PHE 57 Ca -0.04 0.00 0.02 0.00 -0.05 0.00 0.00 57.45 57.38 1ewx n PHE 57 Cb 0.54 0.00 0.38 0.00 -0.94 0.00 0.00 39.48 39.46 1ewx n PHE 57 CO 0.00 0.00 0.00 1.12 -0.05 0.00 0.00 176.76 177.83 1ewx h HIS 58 N 0.00 0.16 0.12 1.38 2.07 -1.09 0.57 115.15 118.35 1ewx h HIS 58 Ca 0.00 -0.02 -0.22 0.00 -2.85 0.00 0.00 60.37 57.28 1ewx h HIS 58 Cb 0.14 -0.04 0.01 0.00 2.57 0.00 0.00 27.41 30.09 1ewx h HIS 58 CO 0.00 0.37 -1.07 1.49 -3.07 0.00 0.00 177.93 175.65 1ewx h GLU 59 N 0.14 0.25 0.00 5.12 4.81 -1.83 -0.78 114.58 122.29 1ewx h GLU 59 Ca 0.02 -0.43 -0.08 0.00 -0.13 0.00 0.00 59.36 58.74 1ewx h GLU 59 Cb 0.48 0.16 -0.01 0.00 0.63 0.00 0.00 28.75 30.01 1ewx h GLU 59 CO 0.03 1.21 -0.37 0.66 -0.73 0.00 0.00 179.01 179.81 1ewx h SER 60 N -0.39 0.00 -0.35 1.04 4.64 -1.80 -2.49 113.55 114.20 1ewx h SER 60 Ca -0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.10 1ewx h SER 60 Cb 1.66 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.75 1ewx h SER 60 CO 0.09 0.37 0.00 0.29 -0.87 0.00 0.00 176.83 176.71 1ewx n LYS 61 N -3.76 2.30 -3.64 4.77 5.02 0.18 -5.02 118.16 118.02 1ewx n LYS 61 Ca -0.01 -2.10 -0.20 0.00 -2.02 0.00 0.00 58.31 53.99 1ewx n LYS 61 Cb 0.45 -1.41 0.00 0.00 -0.02 0.00 0.00 35.03 34.05 1ewx n LYS 61 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1ewx n ASN 62 N 1.15 -5.47 -4.20 4.39 5.15 -0.88 -4.85 115.26 110.55 1ewx n ASN 62 Ca 0.16 -0.78 -0.12 0.00 -0.60 0.00 0.00 54.58 53.24 1ewx n ASN 62 Cb 0.51 -2.45 -0.10 0.00 -0.53 0.00 0.00 39.78 37.22 1ewx n ASN 62 CO 0.00 0.00 0.00 0.72 1.40 0.00 0.00 177.26 179.38 1ewx s PHE 63 N -3.00 1.15 0.05 1.20 -0.12 -0.35 -1.90 117.98 115.01 1ewx s PHE 63 Ca 0.01 -1.36 0.01 0.00 -0.05 0.00 0.00 56.93 55.53 1ewx s PHE 63 Cb -0.00 -0.56 -0.03 0.00 -0.63 0.00 0.00 43.02 41.79 1ewx s PHE 63 CO 0.87 -0.62 -0.05 -2.00 -0.05 0.00 0.00 175.22 173.37 1ewx s GLU 64 N -4.15 0.55 -0.07 1.99 2.56 -0.53 -4.68 118.70 114.37 1ewx s GLU 64 Ca 0.38 -0.95 0.03 0.00 0.00 0.00 0.00 54.97 54.42 1ewx s GLU 64 Cb 0.07 -0.02 -0.02 0.00 2.00 0.00 0.00 34.13 36.16 1ewx s GLU 64 CO 0.11 -0.04 -0.15 0.08 -0.56 0.00 0.00 175.26 174.71 1ewx s VAL 65 N -2.53 3.00 -0.21 3.70 1.01 -1.26 -0.54 120.40 123.58 1ewx s VAL 65 Ca -0.03 -0.73 0.01 0.00 0.00 0.00 0.00 61.98 61.24 1ewx s VAL 65 Cb -0.02 -2.19 0.05 0.00 0.00 0.00 0.00 36.38 34.21 1ewx s VAL 65 CO -0.04 0.57 -0.10 -0.69 0.00 0.00 0.00 175.10 174.84 1ewx s VAL 66 N -0.42 1.72 -0.02 2.92 1.01 0.14 -1.73 120.40 124.02 1ewx s VAL 66 Ca 0.05 -1.11 -0.30 0.00 0.00 0.00 0.00 61.98 60.62 1ewx s VAL 66 Cb -0.12 -1.81 -0.05 0.00 0.00 0.00 0.00 36.38 34.40 1ewx s VAL 66 CO 0.02 0.13 1.45 0.12 0.00 0.00 0.00 175.10 176.82 1ewx s PHE 67 N 1.35 2.67 -0.43 5.22 5.36 0.19 -0.80 117.98 131.54 1ewx s PHE 67 Ca -0.02 0.70 -0.02 0.00 -0.96 0.00 0.00 56.93 56.63 1ewx s PHE 67 Cb -0.17 -3.71 0.12 0.00 -0.34 0.00 0.00 43.02 38.92 1ewx s PHE 67 CO -0.08 -2.70 0.22 0.00 -1.46 0.00 0.00 175.22 171.20 1ewx s THR 69 N 0.89 3.89 -0.97 0.00 -1.32 -1.26 -3.33 115.64 113.54 1ewx s THR 69 Ca 0.10 1.17 0.11 0.00 -1.21 0.00 0.00 61.69 61.87 1ewx s THR 69 Cb -0.22 -3.47 0.33 0.00 -1.51 0.00 0.00 72.50 67.62 1ewx s THR 69 CO -0.04 -0.26 1.27 0.79 -2.21 0.00 0.00 174.62 174.17 1ewx n TRP 70 N -0.94 0.50 -2.40 9.09 7.02 -0.24 -4.86 117.44 125.61 1ewx n TRP 70 Ca 0.09 -0.51 -0.41 0.00 -1.02 0.00 0.00 57.50 55.65 1ewx n TRP 70 Cb 0.53 -0.03 -0.04 0.00 -2.42 0.00 0.00 31.31 29.35 1ewx n TRP 70 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1ewx s ASP 71 N -1.01 7.12 0.00 -0.99 1.01 -1.26 -4.92 116.67 116.61 1ewx s ASP 71 Ca 0.25 2.23 0.14 0.00 0.71 0.00 0.00 52.55 55.87 1ewx s ASP 71 Cb 0.13 -2.61 0.10 0.00 1.01 0.00 0.00 42.92 41.55 1ewx s ASP 71 CO 0.17 -0.33 0.92 -0.62 0.21 0.00 0.00 175.17 175.52 1ewx n GLU 72 N 2.31 0.94 -4.50 8.23 1.02 -1.26 -4.90 120.64 122.48 1ewx n GLU 72 Ca 0.03 -1.28 -0.34 0.00 -0.02 0.00 0.00 57.16 55.56 1ewx n GLU 72 Cb 0.45 -1.26 -0.12 0.00 -0.02 0.00 0.00 31.44 30.49 1ewx n GLU 72 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1ewx s GLU 73 N -1.16 3.47 0.22 3.49 2.02 -1.26 -5.02 118.70 120.46 1ewx s GLU 73 Ca 0.16 -0.55 -0.06 0.00 0.02 0.00 0.00 54.97 54.54 1ewx s GLU 73 Cb 0.11 -2.81 0.21 0.00 0.10 0.00 0.00 34.13 31.74 1ewx s GLU 73 CO 0.18 0.31 1.72 1.49 0.02 0.00 0.00 175.26 178.98 1ewx h GLU 74 N 6.44 0.97 -0.90 1.61 4.81 -1.99 -2.01 114.58 123.51 1ewx h GLU 74 Ca -0.33 -0.26 -0.00 0.00 -0.13 0.00 0.00 59.36 58.63 1ewx h GLU 74 Cb 1.19 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 30.41 1ewx h GLU 74 CO 0.60 0.92 0.55 -0.44 -0.73 0.00 0.00 179.01 179.91 1ewx h ASP 75 N 0.91 1.08 -0.32 1.04 3.32 -1.98 0.26 116.42 120.72 1ewx h ASP 75 Ca 0.18 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.15 1ewx h ASP 75 Cb 0.45 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 1ewx h ASP 75 CO 0.02 0.82 0.16 1.23 -1.72 0.00 0.00 179.24 179.74 1ewx h GLY 76 N 1.24 0.49 0.75 2.75 0.00 -1.89 -0.44 103.07 105.97 1ewx h GLY 76 Ca 0.32 -0.24 0.00 0.00 0.00 0.00 0.00 47.33 47.41 1ewx h GLY 76 CO -0.06 0.23 -0.21 -2.75 0.00 0.00 0.00 176.54 173.76 1ewx h PHE 77 N 0.38 -0.54 -0.74 5.60 3.57 -1.04 -2.29 116.94 121.89 1ewx h PHE 77 Ca 0.11 0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.55 1ewx h PHE 77 Cb 0.12 0.21 -0.03 0.00 2.79 0.00 0.00 35.95 39.04 1ewx h PHE 77 CO -0.02 -0.31 0.21 0.00 -2.23 0.00 0.00 178.31 175.97 1ewx h ALA 78 N 0.30 0.97 -0.24 2.41 0.00 -0.39 0.17 119.26 122.47 1ewx h ALA 78 Ca 0.00 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.60 1ewx h ALA 78 Cb 0.42 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1ewx h ALA 78 CO -0.05 0.67 -0.19 0.78 0.00 0.00 0.00 179.25 180.46 1ewx h GLY 79 N 1.11 0.46 0.72 0.00 0.00 -1.06 -0.53 103.07 103.77 1ewx h GLY 79 Ca 0.24 -0.34 -0.11 0.00 0.00 0.00 0.00 47.33 47.12 1ewx h GLY 79 CO -0.00 0.31 -0.39 -1.82 0.00 0.00 0.00 176.54 174.64 1ewx h TYR 80 N 0.39 0.51 -0.01 5.60 3.20 -1.15 -3.17 116.97 122.33 1ewx h TYR 80 Ca 0.07 -0.23 -0.05 0.00 3.14 0.00 0.00 58.73 61.65 1ewx h TYR 80 Cb 0.56 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.75 1ewx h TYR 80 CO 0.02 0.99 -0.23 0.35 -1.64 0.00 0.00 178.16 177.65 1ewx h PHE 81 N -0.12 0.01 -0.04 -3.82 3.57 -0.51 -1.87 116.94 114.16 1ewx h PHE 81 Ca -0.03 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.48 1ewx h PHE 81 Cb 1.05 -0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.79 1ewx h PHE 81 CO 0.13 0.24 0.03 0.00 -2.23 0.00 0.00 178.31 176.49 1ewx h ALA 82 N 1.76 1.88 0.00 2.41 0.00 -1.06 -0.47 119.26 123.78 1ewx h ALA 82 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ewx h ALA 82 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1ewx h ALA 82 CO 0.03 -0.05 -0.05 1.63 0.00 0.00 0.00 179.25 180.81 1ewx n LYS 83 N -4.29 0.02 -3.62 0.00 5.02 -0.70 -4.86 118.16 109.73 1ewx n LYS 83 Ca -0.02 0.02 -0.32 0.00 -2.02 0.00 0.00 58.31 55.97 1ewx n LYS 83 Cb 0.13 -1.52 -0.05 0.00 -0.02 0.00 0.00 35.03 33.57 1ewx n LYS 83 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 1ewx s MET 84 N -3.01 3.66 0.00 1.97 -1.94 -0.18 -5.02 119.30 114.78 1ewx s MET 84 Ca 0.13 -0.01 0.24 0.00 -1.71 0.00 0.00 55.69 54.35 1ewx s MET 84 Cb 0.18 -2.82 0.28 0.00 2.01 0.00 0.00 34.83 34.49 1ewx s MET 84 CO 0.55 0.44 1.27 -0.35 -0.01 0.00 0.00 175.02 176.92 1ewx n PRO 85 N 0.08 1.16 0.00 2.03 -0.04 -1.26 -4.87 135.00 132.10 1ewx n PRO 85 Ca -0.02 -0.88 0.00 0.00 -0.04 0.00 0.00 63.50 62.56 1ewx n PRO 85 Cb 0.52 -1.48 0.00 0.00 -0.04 0.00 0.00 33.50 32.50 1ewx n PRO 85 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1ewx n TRP 86 N -0.15 0.00 -3.53 0.54 2.14 -1.26 -4.91 117.44 110.27 1ewx n TRP 86 Ca 0.11 0.00 -0.20 0.00 2.07 0.00 0.00 57.50 59.48 1ewx n TRP 86 Cb 0.43 0.00 -0.02 0.00 -0.81 0.00 0.00 31.31 30.91 1ewx n TRP 86 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 1ewx s LEU 87 N 0.00 3.63 0.00 5.67 1.43 -0.71 -4.43 118.68 124.27 1ewx s LEU 87 Ca 0.00 -0.49 -0.03 0.00 -1.03 0.00 0.00 54.13 52.58 1ewx s LEU 87 Cb 0.00 -2.36 -0.01 0.00 0.03 0.00 0.00 46.19 43.86 1ewx s LEU 87 CO 0.00 -0.53 0.06 0.00 0.23 0.00 0.00 176.35 176.11 1ewx s ALA 88 N -2.33 -0.12 0.17 4.21 0.00 -0.64 0.54 121.76 123.59 1ewx s ALA 88 Ca 0.46 -0.23 -0.30 0.00 0.00 0.00 0.00 51.96 51.89 1ewx s ALA 88 Cb -0.07 0.07 -0.09 0.00 0.00 0.00 0.00 23.12 23.04 1ewx s ALA 88 CO 0.29 -0.15 1.34 0.08 0.00 0.00 0.00 175.76 177.32 1ewx s VAL 89 N -1.08 3.21 0.51 0.00 1.01 -0.49 -0.42 120.40 123.14 1ewx s VAL 89 Ca -0.12 0.96 -0.22 0.00 0.00 0.00 0.00 61.98 62.60 1ewx s VAL 89 Cb -0.07 -3.61 -0.07 0.00 0.00 0.00 0.00 36.38 32.63 1ewx s VAL 89 CO 0.00 0.12 1.10 -2.65 0.00 0.00 0.00 175.10 173.67 1ewx n PRO 90 N 3.03 1.36 -0.33 2.72 -0.02 -1.26 -4.84 135.00 135.66 1ewx n PRO 90 Ca 0.08 0.50 0.13 0.00 -2.02 0.00 0.00 63.50 62.18 1ewx n PRO 90 Cb 0.42 -2.24 0.35 0.00 -0.02 0.00 0.00 33.50 32.01 1ewx n PRO 90 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 1ewx h PHE 91 N 1.25 0.96 0.00 6.00 3.57 -1.99 -0.84 116.94 125.89 1ewx h PHE 91 Ca -0.48 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.05 1ewx h PHE 91 Cb 1.33 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 39.78 1ewx h PHE 91 CO 0.42 0.27 0.00 0.00 -2.23 0.00 0.00 178.31 176.78 1ewx h ALA 92 N 1.61 1.00 -0.95 2.41 0.00 -2.03 -2.26 119.26 119.05 1ewx h ALA 92 Ca 0.53 0.00 -0.56 0.00 0.00 0.00 0.00 54.91 54.88 1ewx h ALA 92 Cb 0.85 0.00 -0.29 0.00 0.00 0.00 0.00 17.79 18.35 1ewx h ALA 92 CO -0.30 0.00 0.65 1.04 0.00 0.00 0.00 179.25 180.64 1ewx n GLN 93 N -2.34 2.43 0.26 0.00 1.13 -0.32 -4.63 117.38 113.90 1ewx n GLN 93 Ca 0.00 -3.16 0.10 0.00 -1.94 0.00 0.00 57.00 52.00 1ewx n GLN 93 Cb 0.13 -2.20 0.68 0.00 0.11 0.00 0.00 30.24 28.96 1ewx n GLN 93 CO 0.00 0.00 0.00 0.77 -1.44 0.00 0.00 177.06 176.39 1ewx h SER 94 N 1.41 0.00 -0.83 1.08 0.02 -1.50 -2.10 113.55 111.62 1ewx h SER 94 Ca 0.59 0.00 0.01 0.00 -0.84 0.00 0.00 61.79 61.56 1ewx h SER 94 Cb 1.99 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 64.48 1ewx h SER 94 CO 1.24 0.11 0.55 -0.08 -1.14 0.00 0.00 176.83 177.51 1ewx h GLU 95 N 0.00 1.09 -0.29 3.45 4.81 -1.88 0.36 114.58 122.12 1ewx h GLU 95 Ca -0.00 -0.07 -0.05 0.00 -0.13 0.00 0.00 59.36 59.11 1ewx h GLU 95 Cb 0.24 -0.25 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 1ewx h GLU 95 CO 0.01 0.72 -0.06 0.00 -0.73 0.00 0.00 179.01 178.96 1ewx h ALA 96 N 1.31 1.37 -0.29 2.92 0.00 -1.76 -0.66 119.26 122.14 1ewx h ALA 96 Ca 0.31 -0.22 -0.15 0.00 0.00 0.00 0.00 54.91 54.85 1ewx h ALA 96 Cb -0.12 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 1ewx h ALA 96 CO -0.07 0.43 -0.44 0.28 0.00 0.00 0.00 179.25 179.46 1ewx h VAL 97 N 0.43 1.29 -0.55 0.00 2.07 -1.09 -1.36 116.25 117.05 1ewx h VAL 97 Ca 0.09 -1.62 -0.10 0.00 0.82 0.00 0.00 66.70 65.89 1ewx h VAL 97 Cb 0.38 1.53 -0.02 0.00 -1.52 0.00 0.00 31.29 31.66 1ewx h VAL 97 CO 0.02 0.52 -0.06 1.56 0.02 0.00 0.00 177.57 179.63 1ewx h GLN 98 N 0.59 1.01 -0.66 1.57 4.20 -0.62 0.24 115.11 121.45 1ewx h GLN 98 Ca 0.04 -0.35 -0.06 0.00 0.06 0.00 0.00 58.65 58.34 1ewx h GLN 98 Cb 0.99 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 28.66 1ewx h GLN 98 CO 0.09 1.03 0.18 0.87 -0.67 0.00 0.00 178.83 180.34 1ewx h LYS 99 N 0.89 1.01 -0.59 1.46 1.57 -1.02 -1.91 116.57 117.99 1ewx h LYS 99 Ca 0.15 -0.22 -0.10 0.00 -1.87 0.00 0.00 60.65 58.61 1ewx h LYS 99 Cb 0.61 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.76 1ewx h LYS 99 CO 0.04 0.88 -0.03 1.25 -0.57 0.00 0.00 179.45 181.02 1ewx h LEU 100 N 0.97 1.04 -1.37 2.94 5.85 -0.87 -0.20 115.31 123.68 1ewx h LEU 100 Ca 0.21 -0.32 -0.06 0.00 0.84 0.00 0.00 57.88 58.56 1ewx h LEU 100 Cb 0.31 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 1ewx h LEU 100 CO -0.00 1.11 -0.18 0.28 -0.34 0.00 0.00 178.44 179.30 1ewx h SER 101 N 0.95 0.18 0.44 1.25 0.02 -0.29 -1.63 113.55 114.47 1ewx h SER 101 Ca 0.16 -0.04 -0.23 0.00 -0.84 0.00 0.00 61.79 60.84 1ewx h SER 101 Cb 0.59 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.09 1ewx h SER 101 CO 0.04 0.38 -1.00 0.50 -1.14 0.00 0.00 176.83 175.61 1ewx h LYS 102 N 0.18 0.34 -0.88 3.45 3.64 -0.89 -0.28 116.57 122.13 1ewx h LYS 102 Ca 0.03 -0.41 0.06 0.00 -1.27 0.00 0.00 60.65 59.07 1ewx h LYS 102 Cb 0.43 0.13 -0.06 0.00 -0.41 0.00 0.00 32.23 32.32 1ewx h LYS 102 CO 0.03 1.11 0.54 1.25 -2.27 0.00 0.00 179.45 180.11 1ewx h HIS 103 N 0.17 1.01 -0.38 1.91 2.76 -0.45 -0.06 115.15 120.11 1ewx h HIS 103 Ca -0.09 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.11 1ewx h HIS 103 Cb 1.65 -0.32 0.00 0.00 1.55 0.00 0.00 27.41 30.29 1ewx h HIS 103 CO 0.06 0.51 0.00 1.19 -1.30 0.00 0.00 177.93 178.38 1ewx n PHE 104 N -4.61 0.50 -3.86 5.26 3.72 -0.67 -4.94 117.46 112.86 1ewx n PHE 104 Ca 0.13 -0.25 -0.24 0.00 -0.05 0.00 0.00 57.45 57.04 1ewx n PHE 104 Cb 0.19 0.00 -0.00 0.00 -0.94 0.00 0.00 39.48 38.72 1ewx n PHE 104 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 1ewx n ASN 105 N 0.79 -0.71 -4.58 4.37 3.02 -0.04 -4.86 115.26 113.26 1ewx n ASN 105 Ca 0.16 -0.94 -0.42 0.00 -0.03 0.00 0.00 54.58 53.36 1ewx n ASN 105 Cb 0.40 -3.43 -0.03 0.00 -0.61 0.00 0.00 39.78 36.11 1ewx n ASN 105 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1ewx s VAL 106 N -3.84 3.88 -0.66 2.41 1.01 -0.20 -4.83 120.40 118.18 1ewx s VAL 106 Ca 0.02 0.77 0.24 0.00 0.00 0.00 0.00 61.98 63.01 1ewx s VAL 106 Cb -0.01 -4.57 -0.01 0.00 0.00 0.00 0.00 36.38 31.79 1ewx s VAL 106 CO 0.86 -1.25 1.22 -0.62 0.00 0.00 0.00 175.10 175.31 1ewx n GLU 107 N 8.57 0.27 -3.85 2.72 1.02 -1.26 -4.91 120.64 123.20 1ewx n GLU 107 Ca 0.11 0.05 -0.09 0.00 -0.02 0.00 0.00 57.16 57.20 1ewx n GLU 107 Cb 0.49 -1.64 -0.05 0.00 -0.02 0.00 0.00 31.44 30.23 1ewx n GLU 107 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 1ewx s SER 108 N -4.01 -0.16 0.09 1.62 1.04 -1.26 -5.17 113.70 105.85 1ewx s SER 108 Ca 0.06 -0.67 0.08 0.00 0.48 0.00 0.00 55.95 55.90 1ewx s SER 108 Cb 0.14 0.56 -0.03 0.00 0.10 0.00 0.00 66.02 66.79 1ewx s SER 108 CO 0.75 -1.06 -0.20 0.27 0.98 0.00 0.00 173.24 173.98 1ewx s ILE 109 N -3.93 1.61 0.49 -1.02 -4.36 -1.26 -4.32 121.20 108.41 1ewx s ILE 109 Ca 0.14 -1.49 -0.18 0.00 -0.26 0.00 0.00 60.65 58.86 1ewx s ILE 109 Cb -0.00 -1.47 -0.09 0.00 1.25 0.00 0.00 42.46 42.14 1ewx s ILE 109 CO 0.01 -0.07 0.98 -2.16 0.24 0.00 0.00 174.94 173.93 1ewx s PRO 110 N -1.84 4.03 -0.09 0.37 0.04 -1.26 -4.63 135.00 131.62 1ewx s PRO 110 Ca 0.05 1.03 -0.08 0.00 0.04 0.00 0.00 61.00 62.04 1ewx s PRO 110 Cb -0.10 -2.15 0.02 0.00 0.04 0.00 0.00 34.50 32.32 1ewx s PRO 110 CO 0.04 -0.20 0.24 0.99 0.04 0.00 0.00 177.00 178.11 1ewx s THR 111 N -2.45 0.00 -0.09 1.26 2.01 -0.84 -4.93 115.64 110.60 1ewx s THR 111 Ca 0.60 -0.01 -0.01 0.00 0.31 0.00 0.00 61.69 62.58 1ewx s THR 111 Cb -0.10 -0.34 0.03 0.00 0.01 0.00 0.00 72.50 72.10 1ewx s THR 111 CO 0.25 -0.01 -0.04 -0.22 -0.69 0.00 0.00 174.62 173.91 1ewx s LEU 112 N 0.09 0.87 -0.12 4.42 2.96 -1.26 -1.05 118.68 124.60 1ewx s LEU 112 Ca -0.00 -0.19 0.03 0.00 -0.22 0.00 0.00 54.13 53.75 1ewx s LEU 112 Cb -0.02 -0.63 0.01 0.00 0.50 0.00 0.00 46.19 46.05 1ewx s LEU 112 CO 0.00 -0.16 -0.21 -0.63 -1.32 0.00 0.00 176.35 174.04 1ewx s ILE 113 N 1.83 1.89 -0.14 6.68 1.01 -0.36 -2.83 121.20 129.29 1ewx s ILE 113 Ca 0.05 -0.89 -0.04 0.00 0.00 0.00 0.00 60.65 59.77 1ewx s ILE 113 Cb -0.12 -1.67 -0.03 0.00 0.01 0.00 0.00 42.46 40.65 1ewx s ILE 113 CO -0.06 0.52 -0.01 -0.83 0.00 0.00 0.00 174.94 174.55 1ewx s GLY 114 N 0.70 1.78 0.11 6.18 0.00 0.24 -0.02 107.32 116.30 1ewx s GLY 114 Ca -0.11 -0.80 0.06 0.00 0.00 0.00 0.00 44.72 43.86 1ewx s GLY 114 CO 0.02 -0.19 -0.14 -1.34 0.00 0.00 0.00 173.10 171.44 1ewx s VAL 115 N 0.01 1.29 -0.03 1.40 -7.23 0.24 -0.79 120.40 115.29 1ewx s VAL 115 Ca 0.02 -1.64 -0.30 0.00 -1.81 0.00 0.00 61.98 58.25 1ewx s VAL 115 Cb -0.13 -1.45 -0.03 0.00 0.56 0.00 0.00 36.38 35.33 1ewx s VAL 115 CO 0.02 -0.38 1.08 -0.62 -0.31 0.00 0.00 175.10 174.90 1ewx s ASP 116 N -2.32 7.20 0.26 4.85 2.15 0.04 -0.14 116.67 128.72 1ewx s ASP 116 Ca 0.07 1.73 -0.03 0.00 0.43 0.00 0.00 52.55 54.74 1ewx s ASP 116 Cb -0.06 -2.56 0.33 0.00 -0.30 0.00 0.00 42.92 40.32 1ewx s ASP 116 CO 0.03 -0.43 1.83 0.00 -0.17 0.00 0.00 175.17 176.43 1ewx h ALA 117 N 7.05 1.18 -0.07 3.66 0.00 -1.50 0.16 119.26 129.74 1ewx h ALA 117 Ca -0.37 -0.18 -0.23 0.00 0.00 0.00 0.00 54.91 54.13 1ewx h ALA 117 Cb 1.18 -0.26 0.02 0.00 0.00 0.00 0.00 17.79 18.72 1ewx h ALA 117 CO 0.82 0.58 -0.85 -0.44 0.00 0.00 0.00 179.25 179.36 1ewx h ASP 118 N 0.96 0.87 0.00 0.00 3.32 -1.88 0.16 116.42 119.85 1ewx h ASP 118 Ca 0.22 -0.69 0.00 0.00 0.02 0.00 0.00 57.03 56.58 1ewx h ASP 118 Cb 0.21 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.50 1ewx h ASP 118 CO -0.02 1.43 -1.85 -1.54 -1.72 0.00 0.00 179.24 175.55 1ewx n SER 119 N -3.96 0.36 0.00 6.45 3.41 -1.23 -2.62 113.62 116.04 1ewx n SER 119 Ca -0.09 -0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.43 1ewx n SER 119 Cb 0.79 1.85 0.00 0.00 -0.26 0.00 0.00 64.21 66.59 1ewx n SER 119 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ewx n GLY 120 N 1.35 0.84 3.77 5.00 0.00 0.56 -4.76 105.19 111.94 1ewx n GLY 120 Ca -0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.59 1ewx n GLY 120 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ewx s ASP 121 N -2.97 6.26 0.04 1.61 1.01 -1.24 -4.56 116.67 116.81 1ewx s ASP 121 Ca 0.00 2.76 -0.30 0.00 0.71 0.00 0.00 52.55 55.72 1ewx s ASP 121 Cb 0.00 -2.65 -0.04 0.00 1.01 0.00 0.00 42.92 41.24 1ewx s ASP 121 CO 0.00 -0.90 0.97 -0.69 0.21 0.00 0.00 175.17 174.76 1ewx s VAL 122 N -1.22 4.75 -0.25 -1.27 1.01 -1.26 -0.78 120.40 121.38 1ewx s VAL 122 Ca 0.57 2.05 -0.12 0.00 0.00 0.00 0.00 61.98 64.47 1ewx s VAL 122 Cb -0.40 -4.31 -0.11 0.00 0.00 0.00 0.00 36.38 31.56 1ewx s VAL 122 CO 0.52 0.22 -0.32 0.52 0.00 0.00 0.00 175.10 176.04 1ewx n VAL 123 N 3.51 1.36 -3.82 2.92 0.31 0.03 -4.92 118.33 117.72 1ewx n VAL 123 Ca 0.05 -0.33 -0.12 0.00 -0.01 0.00 0.00 64.34 63.92 1ewx n VAL 123 Cb 0.50 -1.85 -0.11 0.00 -0.91 0.00 0.00 33.84 31.48 1ewx n VAL 123 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1ewx s THR 124 N -2.46 0.03 -0.52 2.52 -1.32 -0.94 -1.39 115.64 111.55 1ewx s THR 124 Ca -0.34 -0.26 0.04 0.00 -1.21 0.00 0.00 61.69 59.92 1ewx s THR 124 Cb 0.13 -0.38 0.05 0.00 -1.51 0.00 0.00 72.50 70.80 1ewx s THR 124 CO 0.43 -0.14 0.74 0.35 -2.21 0.00 0.00 174.62 173.79 1ewx n THR 125 N 2.32 0.21 -1.59 5.08 -2.24 -1.26 -0.60 114.28 116.21 1ewx n THR 125 Ca -0.17 -0.60 0.06 0.00 -2.27 0.00 0.00 64.05 61.07 1ewx n THR 125 Cb 0.57 0.97 0.12 0.00 -2.10 0.00 0.00 70.33 69.90 1ewx n THR 125 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1ewx n ARG 126 N 0.18 0.99 0.28 -0.78 1.74 -1.25 -4.67 116.66 113.16 1ewx n ARG 126 Ca 0.03 -2.47 0.19 0.00 -0.77 0.00 0.00 57.85 54.82 1ewx n ARG 126 Cb 0.16 -1.17 0.86 0.00 -1.02 0.00 0.00 32.46 31.29 1ewx n ARG 126 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ewx h ALA 127 N 0.45 1.00 -0.41 7.54 0.00 -1.81 -0.67 119.26 125.37 1ewx h ALA 127 Ca -0.03 0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.75 1ewx h ALA 127 Cb 1.19 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 1ewx h ALA 127 CO 0.01 0.00 -0.24 -0.09 0.00 0.00 0.00 179.25 178.94 1ewx h ARG 128 N 0.00 0.88 -0.08 0.00 1.12 -1.87 -0.13 114.38 114.29 1ewx h ARG 128 Ca 0.00 -0.40 -0.13 0.00 -1.11 0.00 0.00 59.98 58.34 1ewx h ARG 128 Cb 0.28 -0.02 0.01 0.00 -0.01 0.00 0.00 29.97 30.23 1ewx h ARG 128 CO 0.00 1.05 -0.45 0.00 -3.11 0.00 0.00 179.97 177.46 1ewx h ALA 129 N 0.81 0.16 -0.08 2.80 0.00 -1.63 -3.29 119.26 118.02 1ewx h ALA 129 Ca 0.09 -0.49 -0.11 0.00 0.00 0.00 0.00 54.91 54.39 1ewx h ALA 129 Cb 0.81 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 1ewx h ALA 129 CO 0.07 0.31 -0.46 1.79 0.00 0.00 0.00 179.25 180.95 1ewx h THR 130 N -0.01 1.33 -0.61 0.00 1.35 -1.07 -2.99 112.91 110.90 1ewx h THR 130 Ca -0.04 -1.64 -0.08 0.00 -0.55 0.00 0.00 66.41 64.11 1ewx h THR 130 Cb 1.11 1.78 -0.02 0.00 -1.73 0.00 0.00 68.15 69.29 1ewx h THR 130 CO 0.09 0.49 0.07 0.25 -0.25 0.00 0.00 175.52 176.17 1ewx h LEU 131 N 0.17 0.98 -1.44 3.87 5.85 -1.14 -1.25 115.31 122.34 1ewx h LEU 131 Ca 0.01 -0.24 0.05 0.00 0.84 0.00 0.00 57.88 58.55 1ewx h LEU 131 Cb 0.88 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 41.61 1ewx h LEU 131 CO 0.07 0.99 0.43 0.58 -0.34 0.00 0.00 178.44 180.17 1ewx h VAL 132 N 0.95 1.03 0.00 1.05 2.07 -1.59 -2.14 116.25 117.62 1ewx h VAL 132 Ca 0.19 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 67.47 1ewx h VAL 132 Cb 0.45 0.28 0.00 0.00 -1.52 0.00 0.00 31.29 30.50 1ewx h VAL 132 CO 0.02 0.13 -0.24 0.11 0.02 0.00 0.00 177.57 177.60 1ewx h LYS 133 N 0.70 0.00 -2.02 1.57 1.79 -1.36 -3.39 116.57 113.85 1ewx h LYS 133 Ca 0.28 0.00 -0.53 0.00 -2.18 0.00 0.00 60.65 58.22 1ewx h LYS 133 Cb 0.21 0.00 -0.40 0.00 -1.58 0.00 0.00 32.23 30.46 1ewx h LYS 133 CO -0.08 0.00 -1.11 -3.47 -1.08 0.00 0.00 179.45 173.70 1ewx n ASP 134 N -2.61 0.77 0.31 0.86 2.03 -0.54 -4.97 116.55 112.40 1ewx n ASP 134 Ca 0.04 -2.90 0.18 0.00 0.52 0.00 0.00 54.79 52.63 1ewx n ASP 134 Cb 0.49 -0.63 1.00 0.00 -0.72 0.00 0.00 41.12 41.25 1ewx n ASP 134 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1ewx h PRO 135 N 3.51 0.00 -0.11 -0.67 0.13 -1.69 -0.66 132.00 132.51 1ewx h PRO 135 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 1ewx h PRO 135 Cb 0.90 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.03 1ewx h PRO 135 CO 0.51 0.02 0.00 0.39 -0.23 0.00 0.00 178.00 178.68 1ewx n GLU 136 N -3.48 1.87 -2.99 0.86 -0.58 -1.26 -4.87 120.64 110.18 1ewx n GLU 136 Ca -0.03 -1.28 -0.19 0.00 -0.42 0.00 0.00 57.16 55.24 1ewx n GLU 136 Cb 0.11 -1.45 0.04 0.00 -0.57 0.00 0.00 31.44 29.57 1ewx n GLU 136 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1ewx n GLY 137 N 1.22 -0.29 0.24 0.62 0.00 -0.26 -4.89 105.19 101.83 1ewx n GLY 137 Ca 0.17 -0.01 0.08 0.00 0.00 0.00 0.00 46.02 46.26 1ewx n GLY 137 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1ewx h GLU 138 N -1.38 0.00 -0.30 1.61 5.08 -1.93 -2.04 114.58 115.62 1ewx h GLU 138 Ca -0.44 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.92 1ewx h GLU 138 Cb 1.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.55 1ewx h GLU 138 CO 0.46 0.17 0.00 1.04 -1.00 0.00 0.00 179.01 179.69 1ewx n GLN 139 N -4.05 2.87 -1.65 2.33 1.13 -1.26 -5.01 117.38 111.74 1ewx n GLN 139 Ca -0.02 -2.14 -0.39 0.00 -1.94 0.00 0.00 57.00 52.50 1ewx n GLN 139 Cb 0.25 -1.34 0.03 0.00 0.11 0.00 0.00 30.24 29.29 1ewx n GLN 139 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 1ewx n PHE 140 N 0.24 1.38 -0.73 1.08 -0.00 -0.77 -0.92 117.46 117.74 1ewx n PHE 140 Ca 0.12 0.48 -0.19 0.00 -0.00 0.00 0.00 57.45 57.86 1ewx n PHE 140 Cb 0.49 -2.24 0.11 0.00 -0.00 0.00 0.00 39.48 37.84 1ewx n PHE 140 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.76 176.41 1ewx n PRO 141 N -0.49 1.98 -3.63 -7.13 -0.04 -1.26 -4.94 135.00 119.49 1ewx n PRO 141 Ca 0.11 -2.23 -0.20 0.00 -0.04 0.00 0.00 63.50 61.13 1ewx n PRO 141 Cb 0.43 -1.88 0.05 0.00 -0.04 0.00 0.00 33.50 32.06 1ewx n PRO 141 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 1ewx n TRP 142 N -0.59 -1.99 -1.70 0.54 8.01 -0.10 -4.61 117.44 117.00 1ewx n TRP 142 Ca 0.44 0.86 -0.43 0.00 -1.31 0.00 0.00 57.50 57.07 1ewx n TRP 142 Cb 1.18 -4.57 -0.01 0.00 -2.01 0.00 0.00 31.31 25.91 1ewx n TRP 142 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.69 178.31 1ewx n LYS 143 N -4.22 2.15 -1.82 -0.99 5.02 -1.26 -4.65 118.16 112.39 1ewx n LYS 143 Ca -0.30 0.76 -0.35 0.00 -2.02 0.00 0.00 58.31 56.40 1ewx n LYS 143 Cb 0.68 -2.36 0.05 0.00 -0.02 0.00 0.00 35.03 33.37 1ewx n LYS 143 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1ewx s ASP 144 N -0.17 4.95 0.00 4.39 1.11 -0.49 -5.00 116.67 121.46 1ewx s ASP 144 Ca 0.58 2.27 0.22 0.00 0.18 0.00 0.00 52.55 55.80 1ewx s ASP 144 Cb -0.58 -2.58 1.33 0.00 1.07 0.00 0.00 42.92 42.16 1ewx s ASP 144 CO 0.60 -1.75 1.70 0.00 1.18 0.00 0.00 175.17 176.90