#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hfz n ARG 2 N 0.00 0.00 -3.75 2.12 1.74 -1.26 -3.59 116.66 111.92 3hfz n ARG 2 Ca 0.00 0.00 -0.36 0.00 -0.77 0.00 0.00 57.85 56.72 3hfz n ARG 2 Cb 0.00 -0.90 -0.10 0.00 -1.02 0.00 0.00 32.46 30.43 3hfz n ARG 2 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3hfz s VAL 3 N 1.98 3.53 -0.19 1.55 1.01 0.21 -4.82 120.40 123.66 3hfz s VAL 3 Ca 0.64 -2.84 -0.29 0.00 0.00 0.00 0.00 61.98 59.49 3hfz s VAL 3 Cb -0.90 -3.33 -0.04 0.00 0.00 0.00 0.00 36.38 32.10 3hfz s VAL 3 CO 0.49 -0.84 1.84 -2.84 0.00 0.00 0.00 175.10 173.75 3hfz s PRO 4 N 0.12 3.64 0.17 2.72 0.02 -1.26 -1.94 135.00 138.46 3hfz s PRO 4 Ca 0.15 1.88 -0.18 0.00 0.02 0.00 0.00 61.00 62.87 3hfz s PRO 4 Cb -0.21 -4.16 0.11 0.00 0.02 0.00 0.00 34.50 30.26 3hfz s PRO 4 CO -0.03 -1.50 1.64 0.35 -0.33 0.00 0.00 177.00 177.12 3hfz h PHE 5 N 12.01 -0.46 0.00 6.54 3.57 -1.66 -1.26 116.94 135.68 3hfz h PHE 5 Ca -0.38 0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.14 3hfz h PHE 5 Cb 1.19 0.26 -0.00 0.00 2.79 0.00 0.00 35.95 40.19 3hfz h PHE 5 CO 0.93 -0.27 -0.09 0.66 -2.23 0.00 0.00 178.31 177.31 3hfz h SER 6 N -0.10 0.00 0.23 0.41 4.64 -1.91 -1.07 113.55 115.75 3hfz h SER 6 Ca 0.20 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.51 3hfz h SER 6 Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 3hfz h SER 6 CO -0.48 0.09 -0.11 -0.25 -0.87 0.00 0.00 176.83 175.21 3hfz h TRP 7 N 0.00 -0.29 -0.07 4.77 2.91 -1.71 -3.22 115.95 118.35 3hfz h TRP 7 Ca -0.00 -0.01 0.02 0.00 1.13 0.00 0.00 58.89 60.03 3hfz h TRP 7 Cb 0.18 0.10 -0.00 0.00 -0.51 0.00 0.00 29.16 28.93 3hfz h TRP 7 CO 0.00 -0.18 0.33 1.25 -1.03 0.00 0.00 178.44 178.80 3hfz h LEU 8 N -0.78 0.00 0.00 0.65 5.85 -1.13 0.69 115.31 120.58 3hfz h LEU 8 Ca -0.03 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.69 3hfz h LEU 8 Cb 0.24 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.27 3hfz h LEU 8 CO 0.05 0.00 0.00 1.17 -0.34 0.00 0.00 178.44 179.32 3hfz n LYS 9 N -3.06 0.21 0.11 1.25 4.81 -0.42 -1.92 118.16 119.14 3hfz n LYS 9 Ca -0.01 0.05 0.01 0.00 -0.87 0.00 0.00 58.31 57.49 3hfz n LYS 9 Cb 0.40 -1.50 -0.01 0.00 0.02 0.00 0.00 35.03 33.93 3hfz n LYS 9 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3hfz h ALA 10 N 3.08 0.63 0.00 3.14 0.00 0.36 -2.05 119.26 124.42 3hfz h ALA 10 Ca 0.00 -0.59 -0.32 0.00 0.00 0.00 0.00 54.91 54.00 3hfz h ALA 10 Cb 0.33 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.05 3hfz h ALA 10 CO 0.00 0.76 -2.11 0.66 0.00 0.00 0.00 179.25 178.56 3hfz n TYR 11 N -3.17 0.36 -3.43 0.00 4.01 -1.12 -4.50 117.16 109.31 3hfz n TYR 11 Ca -0.01 0.13 -0.27 0.00 -0.16 0.00 0.00 57.90 57.60 3hfz n TYR 11 Cb 0.78 -1.04 -0.08 0.00 -0.31 0.00 0.00 39.34 38.69 3hfz n TYR 11 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 3hfz n VAL 12 N -2.83 1.93 -0.34 -0.72 0.31 -0.81 0.15 118.33 116.03 3hfz n VAL 12 Ca -0.25 -5.04 0.29 0.00 -0.01 0.00 0.00 64.34 59.32 3hfz n VAL 12 Cb 1.08 -2.09 0.61 0.00 -0.91 0.00 0.00 33.84 32.54 3hfz n VAL 12 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 3hfz h PRO 13 N 4.25 0.21 -0.47 5.55 0.13 -1.55 -2.63 132.00 137.49 3hfz h PRO 13 Ca 0.18 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 3hfz h PRO 13 Cb 0.69 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 31.78 3hfz h PRO 13 CO 0.78 0.14 0.00 0.39 -0.23 0.00 0.00 178.00 179.08 3hfz n GLU 14 N -4.47 1.37 -1.87 0.86 1.02 -1.26 -4.93 120.64 111.36 3hfz n GLU 14 Ca 0.27 -0.39 -0.41 0.00 -0.02 0.00 0.00 57.16 56.60 3hfz n GLU 14 Cb 1.08 -1.31 -0.02 0.00 -0.02 0.00 0.00 31.44 31.17 3hfz n GLU 14 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3hfz s LEU 15 N -0.73 4.36 -0.05 -4.62 1.43 -0.99 -4.93 118.68 113.15 3hfz s LEU 15 Ca 0.07 2.82 -0.26 0.00 -1.03 0.00 0.00 54.13 55.73 3hfz s LEU 15 Cb 0.04 -3.63 -0.21 0.00 0.03 0.00 0.00 46.19 42.42 3hfz s LEU 15 CO 0.04 -0.83 1.13 -0.33 0.23 0.00 0.00 176.35 176.58 3hfz h GLU 16 N 5.13 -0.01 -1.16 1.70 3.07 -1.93 -3.49 114.58 117.89 3hfz h GLU 16 Ca -0.46 0.00 0.35 0.00 -0.50 0.00 0.00 59.36 58.75 3hfz h GLU 16 Cb 1.22 0.00 -0.15 0.00 -0.84 0.00 0.00 28.75 28.98 3hfz h GLU 16 CO 0.80 0.59 0.94 -1.54 -1.40 0.00 0.00 179.01 178.40 3hfz s SER 17 N -5.80 -0.03 0.17 1.42 1.04 -1.26 -4.98 113.70 104.26 3hfz s SER 17 Ca -0.16 -0.03 -0.24 0.00 0.48 0.00 0.00 55.95 55.99 3hfz s SER 17 Cb 0.00 0.06 0.06 0.00 0.10 0.00 0.00 66.02 66.24 3hfz s SER 17 CO 0.67 -0.10 1.57 -0.65 0.98 0.00 0.00 173.24 175.71 3hfz h PRO 18 N 2.00 -0.20 -0.38 4.02 0.11 -1.97 -0.24 132.00 135.34 3hfz h PRO 18 Ca -0.24 0.01 0.03 0.00 0.11 0.00 0.00 66.00 65.91 3hfz h PRO 18 Cb 1.18 0.05 -0.03 0.00 0.11 0.00 0.00 31.00 32.30 3hfz h PRO 18 CO 0.26 -0.14 0.19 0.93 -0.21 0.00 0.00 178.00 179.04 3hfz h GLU 19 N -0.21 0.38 -0.42 1.05 3.07 -1.99 -0.04 114.58 116.41 3hfz h GLU 19 Ca 0.19 -0.02 -0.01 0.00 -0.50 0.00 0.00 59.36 59.02 3hfz h GLU 19 Cb 0.56 -0.08 -0.02 0.00 -0.84 0.00 0.00 28.75 28.37 3hfz h GLU 19 CO -0.68 0.25 0.21 0.28 -1.40 0.00 0.00 179.01 177.67 3hfz h VAL 20 N 0.39 1.14 0.35 3.13 2.07 -1.80 -1.91 116.25 119.63 3hfz h VAL 20 Ca 0.16 -0.39 -0.02 0.00 0.82 0.00 0.00 66.70 67.27 3hfz h VAL 20 Cb 0.07 0.60 0.00 0.00 -1.52 0.00 0.00 31.29 30.43 3hfz h VAL 20 CO -0.11 0.16 -0.17 0.25 0.02 0.00 0.00 177.57 177.72 3hfz h LEU 21 N 0.59 -0.40 -1.19 2.57 5.85 0.12 0.12 115.31 122.97 3hfz h LEU 21 Ca 0.15 -0.11 0.25 0.00 0.84 0.00 0.00 57.88 59.01 3hfz h LEU 21 Cb 0.05 0.10 -0.11 0.00 0.37 0.00 0.00 40.66 41.08 3hfz h LEU 21 CO -0.02 -0.12 0.63 -0.08 -0.34 0.00 0.00 178.44 178.51 3hfz h GLU 22 N -0.70 0.50 -0.24 1.25 4.81 -0.73 0.35 114.58 119.82 3hfz h GLU 22 Ca -0.05 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.10 3hfz h GLU 22 Cb 0.49 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.75 3hfz h GLU 22 CO 0.08 0.33 -0.05 1.49 -0.73 0.00 0.00 179.01 180.13 3hfz h GLU 23 N 0.51 0.46 -0.46 1.92 4.81 -0.86 -1.96 114.58 119.00 3hfz h GLU 23 Ca 0.61 -0.17 -0.09 0.00 -0.13 0.00 0.00 59.36 59.58 3hfz h GLU 23 Cb 1.31 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.65 3hfz h GLU 23 CO -0.37 0.68 -0.05 0.00 -0.73 0.00 0.00 179.01 178.54 3hfz h ARG 24 N 0.21 0.85 0.33 1.92 2.47 0.14 -3.04 114.38 117.25 3hfz h ARG 24 Ca 0.06 -0.29 -0.02 0.00 -1.26 0.00 0.00 59.98 58.47 3hfz h ARG 24 Cb 0.51 -0.06 0.00 0.00 -1.65 0.00 0.00 29.97 28.77 3hfz h ARG 24 CO 0.02 0.92 -0.16 -0.07 0.56 0.00 0.00 179.97 181.25 3hfz h LEU 25 N 0.69 -0.37 -1.22 3.04 3.38 -0.42 -2.19 115.31 118.22 3hfz h LEU 25 Ca 0.12 -0.10 0.37 0.00 0.09 0.00 0.00 57.88 58.36 3hfz h LEU 25 Cb 0.57 0.10 -0.14 0.00 0.09 0.00 0.00 40.66 41.28 3hfz h LEU 25 CO 0.03 -0.12 0.70 0.00 0.09 0.00 0.00 178.44 179.14 3hfz h ALA 26 N -0.02 2.33 -0.02 1.53 0.00 -0.44 0.77 119.26 123.40 3hfz h ALA 26 Ca -0.04 0.15 -0.20 0.00 0.00 0.00 0.00 54.91 54.82 3hfz h ALA 26 Cb 0.45 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 3hfz h ALA 26 CO 0.07 -0.94 -0.83 0.78 0.00 0.00 0.00 179.25 178.33 3hfz h GLY 27 N 0.21 0.35 2.00 0.00 0.00 -1.36 -3.06 103.07 101.21 3hfz h GLY 27 Ca 0.76 -0.57 -0.04 0.00 0.00 0.00 0.00 47.33 47.48 3hfz h GLY 27 CO -0.50 0.51 -0.17 1.41 0.00 0.00 0.00 176.54 177.78 3hfz h LEU 28 N 0.19 0.00 0.00 3.11 3.38 0.11 -3.46 115.31 118.64 3hfz h LEU 28 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 3hfz h LEU 28 Cb 1.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.19 3hfz h LEU 28 CO 0.14 0.17 0.00 0.61 0.09 0.00 0.00 178.44 179.45 3hfz n GLY 29 N -0.05 0.74 3.39 0.83 0.00 -0.20 -5.02 105.19 104.87 3hfz n GLY 29 Ca -0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 3hfz n GLY 29 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hfz s PHE 30 N -0.96 3.22 -0.30 1.61 0.08 -0.75 -4.93 117.98 115.94 3hfz s PHE 30 Ca 0.00 -0.85 -0.17 0.00 0.12 0.00 0.00 56.93 56.03 3hfz s PHE 30 Cb 0.00 -2.39 -0.02 0.00 -0.57 0.00 0.00 43.02 40.04 3hfz s PHE 30 CO 0.00 -0.58 0.45 -2.00 -0.10 0.00 0.00 175.22 172.99 3hfz s GLU 31 N 1.56 3.86 0.00 0.44 2.12 -1.26 -1.47 118.70 123.95 3hfz s GLU 31 Ca 0.03 -0.00 -0.30 0.00 0.36 0.00 0.00 54.97 55.06 3hfz s GLU 31 Cb -0.18 -3.72 -0.03 0.00 0.26 0.00 0.00 34.13 30.46 3hfz s GLU 31 CO 0.06 -0.44 0.96 0.95 -0.54 0.00 0.00 175.26 176.26 3hfz s THR 32 N 2.23 4.86 -1.82 -1.70 -4.23 -1.26 -3.21 115.64 110.51 3hfz s THR 32 Ca 0.17 2.03 0.28 0.00 -1.18 0.00 0.00 61.69 62.99 3hfz s THR 32 Cb -0.16 -4.31 0.45 0.00 1.34 0.00 0.00 72.50 69.82 3hfz s THR 32 CO 0.11 0.17 1.79 0.47 -0.54 0.00 0.00 174.62 176.62 3hfz n ASP 33 N 3.85 0.74 0.00 3.99 8.00 -0.10 -4.95 116.55 128.08 3hfz n ASP 33 Ca 0.05 -0.82 0.00 0.00 0.71 0.00 0.00 54.79 54.73 3hfz n ASP 33 Cb 0.51 -0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.61 3hfz n ASP 33 CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 3hfz n ARG 34 N -0.71 0.00 -4.56 -1.24 1.85 -1.25 -4.96 116.66 105.79 3hfz n ARG 34 Ca 0.15 0.00 -0.21 0.00 -1.00 0.00 0.00 57.85 56.79 3hfz n ARG 34 Cb 0.30 0.00 -0.15 0.00 -1.05 0.00 0.00 32.46 31.56 3hfz n ARG 34 CO 0.00 0.00 0.00 0.42 -0.01 0.00 0.00 177.63 178.04 3hfz s ILE 35 N -2.00 0.99 0.01 8.89 1.09 -1.26 -0.59 121.20 128.33 3hfz s ILE 35 Ca 0.00 -0.52 0.01 0.00 -1.10 0.00 0.00 60.65 59.04 3hfz s ILE 35 Cb 0.00 -0.83 -0.01 0.00 -1.06 0.00 0.00 42.46 40.56 3hfz s ILE 35 CO 0.00 0.28 -0.04 -1.61 -0.10 0.00 0.00 174.94 173.47 3hfz s GLU 36 N -0.23 0.30 -0.14 2.79 2.02 -0.68 -4.93 118.70 117.84 3hfz s GLU 36 Ca 0.04 -0.33 -0.11 0.00 0.02 0.00 0.00 54.97 54.59 3hfz s GLU 36 Cb -0.06 -0.18 -0.05 0.00 0.10 0.00 0.00 34.13 33.95 3hfz s GLU 36 CO -0.00 0.04 0.22 1.03 0.02 0.00 0.00 175.26 176.56 3hfz s ARG 37 N -0.63 3.94 0.00 1.61 0.52 -1.25 0.41 118.95 123.55 3hfz s ARG 37 Ca -0.04 -0.02 0.00 0.00 -0.52 0.00 0.00 55.73 55.15 3hfz s ARG 37 Cb -0.05 -3.32 0.00 0.00 0.52 0.00 0.00 34.95 32.10 3hfz s ARG 37 CO -0.00 0.48 0.00 1.33 0.02 0.00 0.00 175.30 177.13 3hfz n VAL 38 N 2.84 0.00 -2.95 3.52 0.24 0.40 -4.91 118.33 117.46 3hfz n VAL 38 Ca -0.16 0.00 -0.38 0.00 -2.04 0.00 0.00 64.34 61.77 3hfz n VAL 38 Cb 0.53 -0.72 -0.01 0.00 -1.47 0.00 0.00 33.84 32.17 3hfz n VAL 38 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 3hfz n PHE 39 N -1.78 2.86 -2.10 6.34 3.72 -1.26 -4.84 117.46 120.41 3hfz n PHE 39 Ca 0.00 -3.01 -0.38 0.00 -0.05 0.00 0.00 57.45 54.01 3hfz n PHE 39 Cb 0.39 -1.02 -0.03 0.00 -0.94 0.00 0.00 39.48 37.88 3hfz n PHE 39 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 3hfz s PRO 40 N -3.31 2.69 -0.33 -1.08 0.04 -1.26 -3.69 135.00 128.06 3hfz s PRO 40 Ca 0.37 0.48 -0.04 0.00 0.04 0.00 0.00 61.00 61.85 3hfz s PRO 40 Cb 0.14 -4.39 0.05 0.00 0.04 0.00 0.00 34.50 30.34 3hfz s PRO 40 CO -0.01 -2.69 0.07 0.42 0.04 0.00 0.00 177.00 174.82 3hfz s ILE 41 N 8.73 3.36 1.05 0.56 1.01 -1.26 -4.94 121.20 129.71 3hfz s ILE 41 Ca 0.64 -1.36 -0.16 0.00 0.00 0.00 0.00 60.65 59.77 3hfz s ILE 41 Cb -0.12 -2.96 0.13 0.00 0.01 0.00 0.00 42.46 39.52 3hfz s ILE 41 CO 0.19 -0.21 0.08 -2.65 0.00 0.00 0.00 174.94 172.36 3hfz n PRO 42 N 4.70 -1.94 0.06 2.79 -0.02 -1.26 -4.65 135.00 134.69 3hfz n PRO 42 Ca -0.12 -0.56 -0.04 0.00 -2.02 0.00 0.00 63.50 60.76 3hfz n PRO 42 Cb 0.44 -1.52 -0.08 0.00 -0.02 0.00 0.00 33.50 32.32 3hfz n PRO 42 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 3hfz h ARG 43 N -2.38 0.00 0.00 -0.52 2.43 -1.99 -3.28 114.38 108.65 3hfz h ARG 43 Ca -0.36 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 58.81 3hfz h ARG 43 Cb 1.02 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.57 3hfz h ARG 43 CO 0.24 0.68 -0.04 0.78 -1.51 0.00 0.00 179.97 180.12 3hfz h GLY 44 N 3.32 0.00 -7.45 2.80 0.00 -1.92 -3.38 103.07 96.43 3hfz h GLY 44 Ca -0.08 0.00 -0.58 0.00 0.00 0.00 0.00 47.33 46.68 3hfz h GLY 44 CO 0.09 0.00 1.66 0.14 0.00 0.00 0.00 176.54 178.43 3hfz s VAL 45 N -4.17 3.92 0.48 4.60 1.01 -1.24 -1.46 120.40 123.54 3hfz s VAL 45 Ca -0.03 -1.19 0.01 0.00 0.00 0.00 0.00 61.98 60.76 3hfz s VAL 45 Cb 0.13 -4.97 0.01 0.00 0.00 0.00 0.00 36.38 31.55 3hfz s VAL 45 CO 0.52 -1.79 0.70 0.68 0.00 0.00 0.00 175.10 175.21 3hfz s VAL 46 N 5.76 3.63 -0.13 2.92 -7.23 0.14 -1.93 120.40 123.55 3hfz s VAL 46 Ca 0.54 -0.54 -0.19 0.00 -1.81 0.00 0.00 61.98 59.98 3hfz s VAL 46 Cb 0.01 -3.35 -0.04 0.00 0.56 0.00 0.00 36.38 33.56 3hfz s VAL 46 CO 0.00 -0.24 0.52 0.12 -0.31 0.00 0.00 175.10 175.18 3hfz s PHE 47 N -2.61 3.48 0.24 2.82 5.36 -0.79 -0.73 117.98 125.75 3hfz s PHE 47 Ca 0.51 0.91 0.07 0.00 -0.96 0.00 0.00 56.93 57.46 3hfz s PHE 47 Cb -0.10 -2.62 -0.05 0.00 -0.34 0.00 0.00 43.02 39.91 3hfz s PHE 47 CO 0.38 0.09 -0.10 0.00 -1.46 0.00 0.00 175.22 174.13 3hfz s ALA 48 N 0.91 2.18 -0.17 11.12 0.00 -0.62 -0.46 121.76 134.72 3hfz s ALA 48 Ca 0.27 -1.78 -0.04 0.00 0.00 0.00 0.00 51.96 50.40 3hfz s ALA 48 Cb -0.15 0.06 -0.03 0.00 0.00 0.00 0.00 23.12 22.99 3hfz s ALA 48 CO 0.11 -0.00 -0.02 0.50 0.00 0.00 0.00 175.76 176.35 3hfz s ARG 49 N -3.69 3.68 -0.60 0.00 3.52 -0.25 -0.85 118.95 120.76 3hfz s ARG 49 Ca 0.26 -0.51 -0.25 0.00 -0.13 0.00 0.00 55.73 55.10 3hfz s ARG 49 Cb 0.01 -2.99 0.04 0.00 -1.56 0.00 0.00 34.95 30.46 3hfz s ARG 49 CO 0.09 0.18 1.06 0.08 -0.81 0.00 0.00 175.30 175.90 3hfz s VAL 50 N 0.55 4.19 -0.11 7.11 1.01 -0.20 -0.68 120.40 132.28 3hfz s VAL 50 Ca -0.02 0.38 0.20 0.00 0.00 0.00 0.00 61.98 62.55 3hfz s VAL 50 Cb -0.14 -4.66 0.19 0.00 0.00 0.00 0.00 36.38 31.77 3hfz s VAL 50 CO 0.02 -1.32 1.63 -0.07 0.00 0.00 0.00 175.10 175.36 3hfz h LEU 51 N 11.56 0.00 0.00 3.92 3.38 -0.65 -2.43 115.31 131.10 3hfz h LEU 51 Ca -0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.71 3hfz h LEU 51 Cb 1.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.82 3hfz h LEU 51 CO 1.15 0.29 0.00 1.21 0.09 0.00 0.00 178.44 181.18 3hfz n GLU 52 N -3.25 0.00 -3.36 1.13 4.07 -1.14 -4.80 120.64 113.29 3hfz n GLU 52 Ca 0.02 0.00 -0.38 0.00 -0.06 0.00 0.00 57.16 56.73 3hfz n GLU 52 Cb 0.57 0.00 -0.07 0.00 -0.06 0.00 0.00 31.44 31.88 3hfz n GLU 52 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 3hfz s ALA 53 N 0.00 3.55 -0.09 4.31 0.00 -1.26 -1.64 121.76 126.63 3hfz s ALA 53 Ca 0.00 -0.51 0.02 0.00 0.00 0.00 0.00 51.96 51.47 3hfz s ALA 53 Cb 0.00 -2.67 -0.02 0.00 0.00 0.00 0.00 23.12 20.43 3hfz s ALA 53 CO 0.00 -0.35 -0.16 -1.01 0.00 0.00 0.00 175.76 174.25 3hfz s HIS 54 N 1.41 2.71 0.57 0.00 3.76 -0.74 -4.88 115.29 118.12 3hfz s HIS 54 Ca 0.20 -0.53 -0.16 0.00 -0.15 0.00 0.00 55.06 54.42 3hfz s HIS 54 Cb -0.15 -1.74 -0.05 0.00 1.11 0.00 0.00 32.58 31.75 3hfz s HIS 54 CO 0.08 -0.10 1.03 -1.25 -0.85 0.00 0.00 174.74 173.65 3hfz s PRO 55 N -0.05 3.52 -0.31 8.40 0.04 -1.26 0.20 135.00 145.54 3hfz s PRO 55 Ca -0.04 1.11 -0.09 0.00 0.04 0.00 0.00 61.00 62.02 3hfz s PRO 55 Cb -0.14 -2.07 0.00 0.00 0.04 0.00 0.00 34.50 32.33 3hfz s PRO 55 CO 0.04 -0.63 0.14 0.42 0.04 0.00 0.00 177.00 177.01 3hfz s ILE 56 N -2.54 4.41 -0.41 0.56 -1.09 0.64 -4.69 121.20 118.09 3hfz s ILE 56 Ca 0.62 -0.56 -0.39 0.00 -2.23 0.00 0.00 60.65 58.09 3hfz s ILE 56 Cb -0.14 -3.29 -0.14 0.00 -1.58 0.00 0.00 42.46 37.31 3hfz s ILE 56 CO 0.36 0.03 2.17 -2.65 -1.23 0.00 0.00 174.94 173.61 3hfz n PRO 57 N 4.95 0.65 0.00 2.79 -0.02 -1.26 -0.33 135.00 141.78 3hfz n PRO 57 Ca -0.14 0.18 0.00 0.00 -2.02 0.00 0.00 63.50 61.52 3hfz n PRO 57 Cb 0.48 -2.07 0.00 0.00 -0.02 0.00 0.00 33.50 31.89 3hfz n PRO 57 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hfz n GLY 58 N 6.91 0.83 3.58 -1.23 0.00 -1.26 -5.06 105.19 108.96 3hfz n GLY 58 Ca 0.47 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.22 3hfz n GLY 58 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hfz s THR 59 N -2.14 1.40 -0.26 2.61 -4.23 0.56 -5.02 115.64 108.56 3hfz s THR 59 Ca 0.00 -2.00 0.13 0.00 -1.18 0.00 0.00 61.69 58.64 3hfz s THR 59 Cb 0.00 -2.70 0.68 0.00 1.34 0.00 0.00 72.50 71.81 3hfz s THR 59 CO 0.00 0.00 1.65 -2.11 -0.54 0.00 0.00 174.62 173.62 3hfz n ARG 60 N -0.92 3.54 -4.13 3.99 -4.01 -1.26 -4.58 116.66 109.29 3hfz n ARG 60 Ca -0.07 -3.05 -0.28 0.00 -1.04 0.00 0.00 57.85 53.41 3hfz n ARG 60 Cb 0.67 -2.08 -0.07 0.00 -3.04 0.00 0.00 32.46 27.94 3hfz n ARG 60 CO 0.00 0.00 0.00 -0.51 -3.04 0.00 0.00 177.63 174.08 3hfz s LEU 61 N -2.93 3.56 0.03 2.89 1.43 -1.26 -4.67 118.68 117.73 3hfz s LEU 61 Ca 0.50 -0.20 0.09 0.00 -1.03 0.00 0.00 54.13 53.49 3hfz s LEU 61 Cb 0.40 -2.23 -0.03 0.00 0.03 0.00 0.00 46.19 44.37 3hfz s LEU 61 CO 0.11 0.12 -0.26 -0.54 0.23 0.00 0.00 176.35 176.01 3hfz s LYS 62 N -2.73 1.86 -0.54 1.70 1.02 0.82 -0.26 119.74 121.61 3hfz s LYS 62 Ca 0.28 -1.05 -0.17 0.00 0.02 0.00 0.00 55.97 55.05 3hfz s LYS 62 Cb -0.11 -1.96 0.10 0.00 -0.52 0.00 0.00 37.83 35.34 3hfz s LYS 62 CO 0.20 0.52 0.58 0.50 -0.92 0.00 0.00 175.35 176.22 3hfz s ARG 63 N -1.05 3.03 0.43 1.68 3.52 0.55 0.94 118.95 128.04 3hfz s ARG 63 Ca 0.11 -1.37 -0.22 0.00 -0.13 0.00 0.00 55.73 54.12 3hfz s ARG 63 Cb -0.10 -4.22 -0.09 0.00 -1.56 0.00 0.00 34.95 28.97 3hfz s ARG 63 CO 0.01 -1.33 1.01 -0.51 -0.81 0.00 0.00 175.30 173.67 3hfz s LEU 64 N 2.17 4.02 -0.31 -0.88 1.43 0.17 -1.80 118.68 123.48 3hfz s LEU 64 Ca 0.08 1.90 0.03 0.00 -1.03 0.00 0.00 54.13 55.12 3hfz s LEU 64 Cb -0.25 -4.37 0.08 0.00 0.03 0.00 0.00 46.19 41.68 3hfz s LEU 64 CO 0.06 -0.51 -0.01 -0.69 0.23 0.00 0.00 176.35 175.43 3hfz s VAL 65 N -1.88 2.17 0.01 -1.59 1.01 -0.65 -1.36 120.40 118.10 3hfz s VAL 65 Ca 0.61 -2.02 -0.02 0.00 0.00 0.00 0.00 61.98 60.56 3hfz s VAL 65 Cb -0.17 -2.47 -0.04 0.00 0.00 0.00 0.00 36.38 33.70 3hfz s VAL 65 CO 0.21 -0.37 0.17 -0.76 0.00 0.00 0.00 175.10 174.35 3hfz s LEU 66 N 1.01 4.28 -0.47 3.92 1.43 0.25 0.12 118.68 129.22 3hfz s LEU 66 Ca 0.03 0.29 -0.07 0.00 -1.03 0.00 0.00 54.13 53.35 3hfz s LEU 66 Cb -0.19 -2.63 0.12 0.00 0.03 0.00 0.00 46.19 43.52 3hfz s LEU 66 CO -0.07 0.24 0.32 -0.62 0.23 0.00 0.00 176.35 176.45 3hfz s ASP 67 N -2.05 5.55 -0.44 2.29 -1.08 0.15 -0.42 116.67 120.68 3hfz s ASP 67 Ca 0.28 -2.05 0.07 0.00 -0.52 0.00 0.00 52.55 50.33 3hfz s ASP 67 Cb -0.13 -1.95 0.42 0.00 -1.46 0.00 0.00 42.92 39.81 3hfz s ASP 67 CO 0.20 -0.62 1.07 0.00 0.52 0.00 0.00 175.17 176.35 3hfz n ALA 68 N 4.66 4.82 0.00 3.66 0.00 -1.26 -1.09 120.51 131.30 3hfz n ALA 68 Ca -0.04 -4.21 0.00 0.00 0.00 0.00 0.00 53.44 49.18 3hfz n ALA 68 Cb 0.41 -0.61 0.00 0.00 0.00 0.00 0.00 19.45 19.25 3hfz n ALA 68 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hfz n GLY 69 N -0.41 2.51 3.53 0.00 0.00 -1.21 -3.88 105.19 105.74 3hfz n GLY 69 Ca 0.35 -0.54 -0.25 0.00 0.00 0.00 0.00 46.02 45.57 3hfz n GLY 69 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3hfz s ARG 70 N 0.00 1.79 -0.40 1.61 1.70 -1.26 -5.00 118.95 117.38 3hfz s ARG 70 Ca 0.00 -1.94 -0.20 0.00 -0.47 0.00 0.00 55.73 53.12 3hfz s ARG 70 Cb 0.00 -1.57 0.01 0.00 -0.57 0.00 0.00 34.95 32.82 3hfz s ARG 70 CO 0.00 0.09 0.63 0.99 -1.08 0.00 0.00 175.30 175.93 3hfz s THR 71 N -2.72 4.86 0.25 4.99 2.01 -1.26 -4.41 115.64 119.37 3hfz s THR 71 Ca 0.32 0.30 0.12 0.00 0.31 0.00 0.00 61.69 62.74 3hfz s THR 71 Cb 0.04 -4.14 -0.05 0.00 0.01 0.00 0.00 72.50 68.36 3hfz s THR 71 CO 0.16 -0.47 -0.20 0.68 -0.69 0.00 0.00 174.62 174.10 3hfz s VAL 72 N 2.75 2.51 0.11 3.82 -7.23 0.44 -4.96 120.40 117.85 3hfz s VAL 72 Ca 0.23 -2.26 0.07 0.00 -1.81 0.00 0.00 61.98 58.21 3hfz s VAL 72 Cb -0.14 -2.29 -0.04 0.00 0.56 0.00 0.00 36.38 34.47 3hfz s VAL 72 CO 0.17 -0.31 -0.07 -1.61 -0.31 0.00 0.00 175.10 172.97 3hfz s GLU 73 N -3.27 2.24 -0.16 4.82 2.02 -1.26 0.85 118.70 123.93 3hfz s GLU 73 Ca 0.27 -1.00 -0.09 0.00 0.02 0.00 0.00 54.97 54.17 3hfz s GLU 73 Cb -0.06 -2.36 0.06 0.00 0.10 0.00 0.00 34.13 31.87 3hfz s GLU 73 CO 0.14 0.51 0.40 0.08 0.02 0.00 0.00 175.26 176.41 3hfz s VAL 74 N -1.29 -0.02 0.04 2.63 1.01 -0.47 -1.47 120.40 120.83 3hfz s VAL 74 Ca 0.23 0.09 -0.29 0.00 0.00 0.00 0.00 61.98 62.01 3hfz s VAL 74 Cb -0.11 -0.59 -0.04 0.00 0.00 0.00 0.00 36.38 35.64 3hfz s VAL 74 CO 0.15 0.04 0.92 -0.69 0.00 0.00 0.00 175.10 175.51 3hfz s VAL 75 N 1.28 4.75 -0.00 2.92 1.01 -1.26 0.44 120.40 129.53 3hfz s VAL 75 Ca -0.09 1.94 -0.04 0.00 0.00 0.00 0.00 61.98 63.79 3hfz s VAL 75 Cb -0.08 -4.26 -0.00 0.00 0.00 0.00 0.00 36.38 32.03 3hfz s VAL 75 CO -0.11 0.25 0.08 -0.55 0.00 0.00 0.00 175.10 174.77 3hfz s SER 76 N 0.50 0.05 -0.37 3.32 0.15 0.27 -4.85 113.70 112.77 3hfz s SER 76 Ca 0.47 -0.18 0.09 0.00 0.70 0.00 0.00 55.95 57.03 3hfz s SER 76 Cb -0.21 0.18 0.44 0.00 -1.71 0.00 0.00 66.02 64.72 3hfz s SER 76 CO 0.27 -0.27 1.11 0.61 1.20 0.00 0.00 173.24 176.16 3hfz n GLY 77 N 1.89 5.13 3.47 9.45 0.00 -1.26 0.29 105.19 124.15 3hfz n GLY 77 Ca -0.20 -2.39 -0.33 0.00 0.00 0.00 0.00 46.02 43.09 3hfz n GLY 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hfz s ALA 78 N -3.52 2.90 0.39 4.61 0.00 -1.26 -4.96 121.76 119.92 3hfz s ALA 78 Ca 0.44 -0.84 0.16 0.00 0.00 0.00 0.00 51.96 51.73 3hfz s ALA 78 Cb 0.40 -1.45 1.04 0.00 0.00 0.00 0.00 23.12 23.12 3hfz s ALA 78 CO -0.08 0.24 1.79 0.93 0.00 0.00 0.00 175.76 178.64 3hfz h GLU 79 N 6.63 0.44 -0.00 0.00 4.39 -1.96 0.51 114.58 124.59 3hfz h GLU 79 Ca -0.30 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.37 3hfz h GLU 79 Cb 1.20 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.75 3hfz h GLU 79 CO 0.61 0.29 -0.14 0.27 -1.16 0.00 0.00 179.01 178.88 3hfz n ASN 80 N -4.63 0.48 -4.55 1.42 2.04 -1.26 -4.79 115.26 103.97 3hfz n ASN 80 Ca 0.24 -0.51 -0.31 0.00 -0.44 0.00 0.00 54.58 53.56 3hfz n ASN 80 Cb 0.80 -0.07 -0.06 0.00 -2.53 0.00 0.00 39.78 37.93 3hfz n ASN 80 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 3hfz n ALA 81 N -1.00 0.65 -2.49 -2.53 0.00 0.18 -4.85 120.51 110.46 3hfz n ALA 81 Ca 0.13 -0.99 -0.10 0.00 0.00 0.00 0.00 53.44 52.49 3hfz n ALA 81 Cb 0.29 -3.12 -0.08 0.00 0.00 0.00 0.00 19.45 16.53 3hfz n ALA 81 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 3hfz s ARG 82 N 8.47 1.09 0.74 0.00 1.70 -1.26 -4.92 118.95 124.77 3hfz s ARG 82 Ca 1.01 -1.30 -0.11 0.00 -0.47 0.00 0.00 55.73 54.86 3hfz s ARG 82 Cb -0.28 0.32 0.04 0.00 -0.57 0.00 0.00 34.95 34.46 3hfz s ARG 82 CO 0.25 -0.37 1.08 0.21 -1.08 0.00 0.00 175.30 175.39 3hfz s LYS 83 N -4.01 2.51 0.00 3.89 2.20 -1.26 -3.99 119.74 119.07 3hfz s LYS 83 Ca 0.21 1.05 0.00 0.00 -0.36 0.00 0.00 55.97 56.87 3hfz s LYS 83 Cb 0.05 -1.93 0.00 0.00 -1.51 0.00 0.00 37.83 34.44 3hfz s LYS 83 CO 0.02 -1.43 0.00 0.41 -0.36 0.00 0.00 175.35 173.98 3hfz n GLY 84 N -1.57 2.46 3.85 5.54 0.00 -0.91 -5.00 105.19 109.55 3hfz n GLY 84 Ca 0.08 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.89 3hfz n GLY 84 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3hfz s ILE 85 N -2.22 3.02 -0.12 -0.61 -4.36 -1.26 -4.32 121.20 111.33 3hfz s ILE 85 Ca 0.00 -1.40 -0.07 0.00 -0.26 0.00 0.00 60.65 58.92 3hfz s ILE 85 Cb 0.00 -3.07 -0.04 0.00 1.25 0.00 0.00 42.46 40.60 3hfz s ILE 85 CO 0.00 -0.08 0.13 -0.83 0.24 0.00 0.00 174.94 174.39 3hfz s GLY 86 N -4.04 2.13 0.39 6.27 0.00 0.06 -1.03 107.32 111.10 3hfz s GLY 86 Ca 0.44 -0.65 0.08 0.00 0.00 0.00 0.00 44.72 44.58 3hfz s GLY 86 CO 0.27 -0.37 0.00 -1.34 0.00 0.00 0.00 173.10 171.66 3hfz s VAL 87 N -0.96 2.13 -0.84 1.40 -7.23 -0.03 -1.64 120.40 113.24 3hfz s VAL 87 Ca 0.15 -2.02 -0.14 0.00 -1.81 0.00 0.00 61.98 58.16 3hfz s VAL 87 Cb -0.12 -2.90 0.22 0.00 0.56 0.00 0.00 36.38 34.14 3hfz s VAL 87 CO 0.04 -0.06 0.78 0.00 -0.31 0.00 0.00 175.10 175.55 3hfz s ALA 88 N -2.66 4.12 -0.37 1.32 0.00 -1.26 -1.59 121.76 121.31 3hfz s ALA 88 Ca 0.35 -3.35 -0.26 0.00 0.00 0.00 0.00 51.96 48.70 3hfz s ALA 88 Cb 0.07 -3.52 0.02 0.00 0.00 0.00 0.00 23.12 19.69 3hfz s ALA 88 CO 0.18 -2.28 0.93 -1.17 0.00 0.00 0.00 175.76 173.42 3hfz s LEU 89 N 0.09 4.00 -0.68 0.00 0.20 0.09 -1.80 118.68 120.58 3hfz s LEU 89 Ca 0.19 0.56 -0.17 0.00 0.69 0.00 0.00 54.13 55.39 3hfz s LEU 89 Cb -0.10 -3.26 0.14 0.00 -0.43 0.00 0.00 46.19 42.54 3hfz s LEU 89 CO -0.09 -0.86 0.73 0.00 -0.29 0.00 0.00 176.35 175.84 3hfz s ALA 90 N 3.48 3.60 0.84 5.97 0.00 -0.75 0.25 121.76 135.16 3hfz s ALA 90 Ca 0.38 -2.59 -0.14 0.00 0.00 0.00 0.00 51.96 49.61 3hfz s ALA 90 Cb -0.12 -3.55 0.04 0.00 0.00 0.00 0.00 23.12 19.49 3hfz s ALA 90 CO 0.19 -2.36 0.72 1.28 0.00 0.00 0.00 175.76 175.59 3hfz n LEU 91 N 5.65 1.64 -4.69 0.00 4.77 -0.53 -3.01 117.00 120.83 3hfz n LEU 91 Ca -0.01 0.48 -0.43 0.00 -0.03 0.00 0.00 56.01 56.02 3hfz n LEU 91 Cb 0.44 -1.31 -0.03 0.00 -2.33 0.00 0.00 43.42 40.18 3hfz n LEU 91 CO 0.51 -2.83 1.41 -0.81 -1.33 0.00 0.00 177.39 174.34 3hfz n PRO 92 N -2.06 2.62 0.00 3.23 -0.04 -1.26 -2.19 135.00 135.31 3hfz n PRO 92 Ca 0.10 0.95 0.00 0.00 -0.04 0.00 0.00 63.50 64.51 3hfz n PRO 92 Cb 0.52 -2.81 0.00 0.00 -0.04 0.00 0.00 33.50 31.16 3hfz n PRO 92 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3hfz n GLY 93 N 4.06 3.49 3.36 0.55 0.00 1.21 -4.92 105.19 112.94 3hfz n GLY 93 Ca 0.18 -0.99 -0.52 0.00 0.00 0.00 0.00 46.02 44.69 3hfz n GLY 93 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3hfz n THR 94 N 0.00 0.98 -3.75 2.61 -1.04 -0.93 -4.21 114.28 107.94 3hfz n THR 94 Ca 0.00 -0.24 -0.36 0.00 -2.04 0.00 0.00 64.05 61.40 3hfz n THR 94 Cb 0.00 0.00 -0.10 0.00 -1.82 0.00 0.00 70.33 68.41 3hfz n THR 94 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 3hfz s GLU 95 N -0.49 3.94 -0.04 -2.82 2.02 -1.26 -1.05 118.70 119.00 3hfz s GLU 95 Ca 0.75 -0.34 0.02 0.00 0.02 0.00 0.00 54.97 55.42 3hfz s GLU 95 Cb -1.07 -3.44 -0.03 0.00 0.10 0.00 0.00 34.13 29.69 3hfz s GLU 95 CO 0.55 0.01 -0.07 -0.51 0.02 0.00 0.00 175.26 175.26 3hfz s LEU 96 N 1.15 3.15 0.17 1.80 1.43 -1.24 -4.80 118.68 120.33 3hfz s LEU 96 Ca 0.06 -0.08 -0.06 0.00 -1.03 0.00 0.00 54.13 53.03 3hfz s LEU 96 Cb -0.14 -1.73 0.03 0.00 0.03 0.00 0.00 46.19 44.38 3hfz s LEU 96 CO 0.05 0.33 1.46 1.55 0.23 0.00 0.00 176.35 179.97 3hfz h PRO 97 N 4.99 0.65 0.00 1.29 0.13 -1.85 -2.98 132.00 134.22 3hfz h PRO 97 Ca -0.48 -0.43 0.00 0.00 -0.87 0.00 0.00 66.00 64.22 3hfz h PRO 97 Cb 1.17 0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.36 3hfz h PRO 97 CO 0.53 1.05 0.00 0.41 -0.23 0.00 0.00 178.00 179.75 3hfz n GLY 98 N 0.34 -0.61 0.01 1.56 0.00 -1.17 -3.31 105.19 102.02 3hfz n GLY 98 Ca -0.04 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.90 3hfz n GLY 98 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 3hfz n LEU 99 N -0.83 0.00 -2.16 0.99 -0.00 -1.23 -4.54 117.00 109.24 3hfz n LEU 99 Ca 0.10 -0.19 -0.08 0.00 -0.00 0.00 0.00 56.01 55.83 3hfz n LEU 99 Cb 0.04 0.00 -0.01 0.00 -0.00 0.00 0.00 43.42 43.45 3hfz n LEU 99 CO 0.07 0.18 -0.03 0.61 -0.00 0.00 0.00 177.39 178.22 3hfz n GLY 100 N 0.00 -0.26 3.16 1.47 0.00 -1.13 -4.83 105.19 103.60 3hfz n GLY 100 Ca 0.00 0.01 -0.10 0.00 0.00 0.00 0.00 46.02 45.93 3hfz n GLY 100 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3hfz s GLN 101 N -3.39 0.93 -0.06 1.61 -1.52 -1.26 -5.06 119.66 110.90 3hfz s GLN 101 Ca 0.16 -1.44 -0.19 0.00 -1.95 0.00 0.00 55.36 51.94 3hfz s GLN 101 Cb -0.09 0.15 -0.05 0.00 -0.22 0.00 0.00 33.01 32.80 3hfz s GLN 101 CO 0.19 -0.23 0.52 0.21 -0.25 0.00 0.00 175.29 175.73 3hfz s LYS 102 N -4.02 4.28 -0.11 2.91 2.20 -1.26 -3.64 119.74 120.10 3hfz s LYS 102 Ca 0.23 0.56 -0.29 0.00 -0.36 0.00 0.00 55.97 56.11 3hfz s LYS 102 Cb 0.07 -3.38 -0.01 0.00 -1.51 0.00 0.00 37.83 33.00 3hfz s LYS 102 CO 0.01 0.30 0.99 0.08 -0.36 0.00 0.00 175.35 176.37 3hfz s VAL 103 N 0.13 4.79 0.00 4.02 1.01 -0.21 -4.92 120.40 125.22 3hfz s VAL 103 Ca 0.28 2.00 0.00 0.00 0.00 0.00 0.00 61.98 64.26 3hfz s VAL 103 Cb -0.16 -4.30 0.00 0.00 0.00 0.00 0.00 36.38 31.92 3hfz s VAL 103 CO 0.13 0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.85 3hfz n GLY 104 N 3.13 6.46 3.03 4.51 0.00 -1.26 0.38 105.19 121.43 3hfz n GLY 104 Ca 0.08 -2.09 -0.34 0.00 0.00 0.00 0.00 46.02 43.67 3hfz n GLY 104 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3hfz n GLU 105 N -0.01 2.47 -2.74 1.61 2.13 -1.26 -2.73 120.64 120.11 3hfz n GLU 105 Ca 0.00 -4.49 -0.22 0.00 0.66 0.00 0.00 57.16 53.11 3hfz n GLU 105 Cb 0.00 -2.38 0.03 0.00 0.27 0.00 0.00 31.44 29.36 3hfz n GLU 105 CO 0.00 0.00 0.00 -0.98 -0.41 0.00 0.00 177.13 175.74 3hfz s ARG 106 N -1.48 2.73 -0.30 5.31 1.70 -1.13 -4.87 118.95 120.91 3hfz s ARG 106 Ca 0.28 -0.64 -0.10 0.00 -0.47 0.00 0.00 55.73 54.79 3hfz s ARG 106 Cb -0.05 -2.50 -0.02 0.00 -0.57 0.00 0.00 34.95 31.81 3hfz s ARG 106 CO -0.13 -0.57 0.17 0.08 -1.08 0.00 0.00 175.30 173.77 3hfz s VAL 107 N -2.71 4.91 -0.17 4.99 1.01 -1.26 -0.88 120.40 126.30 3hfz s VAL 107 Ca 0.54 -0.18 0.01 0.00 0.00 0.00 0.00 61.98 62.35 3hfz s VAL 107 Cb -0.10 -3.44 0.02 0.00 0.00 0.00 0.00 36.38 32.86 3hfz s VAL 107 CO 0.39 0.14 -0.20 -0.63 0.00 0.00 0.00 175.10 174.79 3hfz s ILE 108 N 1.68 2.02 -0.84 2.22 1.01 -0.01 -4.88 121.20 122.41 3hfz s ILE 108 Ca 0.06 -0.93 -0.02 0.00 0.00 0.00 0.00 60.65 59.76 3hfz s ILE 108 Cb -0.17 -1.82 0.00 0.00 0.01 0.00 0.00 42.46 40.48 3hfz s ILE 108 CO 0.08 0.54 0.63 0.00 0.00 0.00 0.00 174.94 176.19 3hfz n GLN 109 N 4.52 -1.44 -0.09 2.79 1.13 -1.26 -2.02 117.38 121.01 3hfz n GLN 109 Ca -0.21 0.86 0.00 0.00 -1.94 0.00 0.00 57.00 55.71 3hfz n GLN 109 Cb 0.50 -3.00 0.00 0.00 0.11 0.00 0.00 30.24 27.86 3hfz n GLN 109 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3hfz n GLY 110 N -1.69 0.69 3.16 1.08 0.00 -1.26 -4.92 105.19 102.25 3hfz n GLY 110 Ca -0.25 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.50 3hfz n GLY 110 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hfz s VAL 111 N -1.55 1.55 -0.32 1.61 0.11 -0.85 -5.11 120.40 115.84 3hfz s VAL 111 Ca 0.00 -0.79 -0.17 0.00 -2.93 0.00 0.00 61.98 58.09 3hfz s VAL 111 Cb 0.00 -1.33 -0.01 0.00 -1.53 0.00 0.00 36.38 33.51 3hfz s VAL 111 CO 0.00 0.44 0.47 0.00 -3.33 0.00 0.00 175.10 172.68 3hfz s ARG 112 N -0.03 3.75 -0.22 1.54 1.70 -1.26 -0.83 118.95 123.60 3hfz s ARG 112 Ca -0.03 -0.08 -0.29 0.00 -0.47 0.00 0.00 55.73 54.86 3hfz s ARG 112 Cb -0.12 -3.76 0.00 0.00 -0.57 0.00 0.00 34.95 30.51 3hfz s ARG 112 CO 0.02 -0.52 1.16 0.45 -1.08 0.00 0.00 175.30 175.33 3hfz s SER 113 N 1.70 6.98 -1.39 -2.89 0.15 -0.06 -4.68 113.70 113.52 3hfz s SER 113 Ca 0.18 1.46 -0.10 0.00 0.70 0.00 0.00 55.95 58.18 3hfz s SER 113 Cb -0.16 -2.54 0.08 0.00 -1.71 0.00 0.00 66.02 61.70 3hfz s SER 113 CO 0.12 -0.76 2.22 0.33 1.20 0.00 0.00 173.24 176.35 3hfz n PHE 114 N 6.60 2.99 0.00 3.44 7.35 -0.54 -2.83 117.46 134.47 3hfz n PHE 114 Ca 0.13 -2.89 0.00 0.00 -0.76 0.00 0.00 57.45 53.93 3hfz n PHE 114 Cb 0.46 -2.20 0.00 0.00 0.35 0.00 0.00 39.48 38.09 3hfz n PHE 114 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3hfz n GLY 115 N 3.14 0.80 3.65 7.13 0.00 -1.10 -4.37 105.19 114.44 3hfz n GLY 115 Ca 0.53 -1.61 -0.02 0.00 0.00 0.00 0.00 46.02 44.91 3hfz n GLY 115 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 3hfz s MET 116 N 0.00 0.02 0.62 1.61 0.23 -1.16 -4.85 119.30 115.77 3hfz s MET 116 Ca 0.00 0.02 -0.11 0.00 -1.03 0.00 0.00 55.69 54.57 3hfz s MET 116 Cb 0.00 0.01 -0.03 0.00 -1.53 0.00 0.00 34.83 33.28 3hfz s MET 116 CO 0.00 -0.00 1.02 0.00 -2.03 0.00 0.00 175.02 174.01 3hfz s ALA 117 N -0.25 3.09 0.21 3.16 0.00 -1.26 -1.81 121.76 124.90 3hfz s ALA 117 Ca 0.08 -0.18 0.05 0.00 0.00 0.00 0.00 51.96 51.91 3hfz s ALA 117 Cb -0.04 -3.03 -0.05 0.00 0.00 0.00 0.00 23.12 20.00 3hfz s ALA 117 CO -0.15 -0.74 -0.05 -0.51 0.00 0.00 0.00 175.76 174.31 3hfz s LEU 118 N -5.18 2.37 0.28 0.00 1.43 -0.74 -4.91 118.68 111.93 3hfz s LEU 118 Ca 0.55 -1.14 0.06 0.00 -1.03 0.00 0.00 54.13 52.57 3hfz s LEU 118 Cb -0.11 -0.40 -0.03 0.00 0.03 0.00 0.00 46.19 45.69 3hfz s LEU 118 CO 0.53 -0.40 0.35 -0.94 0.23 0.00 0.00 176.35 176.12 3hfz s SER 119 N -3.30 5.97 0.64 2.29 1.04 -1.26 -1.56 113.70 117.54 3hfz s SER 119 Ca 0.25 -0.11 0.24 0.00 0.48 0.00 0.00 55.95 56.81 3hfz s SER 119 Cb 0.04 -1.53 1.27 0.00 0.10 0.00 0.00 66.02 65.90 3hfz s SER 119 CO 0.07 -0.18 1.72 -0.65 0.98 0.00 0.00 173.24 175.17 3hfz h PRO 120 N 1.17 0.00 0.11 4.02 0.11 -1.69 0.38 132.00 136.11 3hfz h PRO 120 Ca -0.49 0.00 -0.34 0.00 0.11 0.00 0.00 66.00 65.28 3hfz h PRO 120 Cb 1.24 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.33 3hfz h PRO 120 CO 0.59 0.00 -1.81 -0.09 -0.21 0.00 0.00 178.00 176.47 3hfz h ARG 121 N 0.00 0.24 -0.19 1.05 1.12 -0.83 0.17 114.38 115.94 3hfz h ARG 121 Ca 0.08 -0.41 -0.15 0.00 -1.11 0.00 0.00 59.98 58.39 3hfz h ARG 121 Cb 1.17 0.15 -0.01 0.00 -0.01 0.00 0.00 29.97 31.27 3hfz h ARG 121 CO -0.00 1.09 -0.53 0.93 -3.11 0.00 0.00 179.97 178.35 3hfz h GLU 122 N 0.07 0.54 -0.05 0.20 5.08 -1.19 -3.02 114.58 116.20 3hfz h GLU 122 Ca -0.35 -0.33 -0.20 0.00 -1.00 0.00 0.00 59.36 57.49 3hfz h GLU 122 Cb 2.04 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 31.32 3hfz h GLU 122 CO 0.12 0.93 -0.80 1.25 -1.00 0.00 0.00 179.01 179.51 3hfz h LEU 123 N 0.42 0.47 0.00 1.33 5.85 -1.48 -3.08 115.31 118.82 3hfz h LEU 123 Ca 0.01 -0.33 0.00 0.00 0.84 0.00 0.00 57.88 58.40 3hfz h LEU 123 Cb 1.06 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.95 3hfz h LEU 123 CO 0.10 1.09 0.00 0.61 -0.34 0.00 0.00 178.44 179.90 3hfz n GLY 124 N 0.69 0.52 0.09 3.75 0.00 -1.00 -4.65 105.19 104.59 3hfz n GLY 124 Ca -0.05 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.08 3hfz n GLY 124 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3hfz n VAL 125 N -1.49 0.76 -3.66 1.61 0.24 -0.78 -4.88 118.33 110.13 3hfz n VAL 125 Ca 0.00 0.13 -0.04 0.00 -2.04 0.00 0.00 64.34 62.39 3hfz n VAL 125 Cb 0.00 -0.98 -0.01 0.00 -1.47 0.00 0.00 33.84 31.37 3hfz n VAL 125 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 3hfz s GLY 126 N -3.40 -0.32 0.30 7.63 0.00 0.52 -4.72 107.32 107.33 3hfz s GLY 126 Ca 0.07 0.52 0.14 0.00 0.00 0.00 0.00 44.72 45.44 3hfz s GLY 126 CO 0.41 0.14 1.62 0.83 0.00 0.00 0.00 173.10 176.10 3hfz h GLU 127 N 2.00 0.00 -6.43 2.90 5.08 -1.90 -2.75 114.58 113.48 3hfz h GLU 127 Ca -0.24 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 57.59 3hfz h GLU 127 Cb 1.23 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.50 3hfz h GLU 127 CO 0.27 0.54 1.10 -0.47 -1.00 0.00 0.00 179.01 179.45 3hfz s TYR 128 N -3.50 2.04 -0.14 4.33 5.04 -1.26 -4.58 117.35 119.28 3hfz s TYR 128 Ca -0.00 0.02 0.16 0.00 -2.44 0.00 0.00 57.07 54.81 3hfz s TYR 128 Cb 0.11 -4.09 0.41 0.00 0.35 0.00 0.00 41.96 38.74 3hfz s TYR 128 CO 0.74 -4.57 1.20 0.41 -1.34 0.00 0.00 175.55 171.98 3hfz n GLY 129 N 4.21 3.78 1.44 8.97 0.00 -1.26 -1.18 105.19 121.15 3hfz n GLY 129 Ca 0.17 -1.14 0.10 0.00 0.00 0.00 0.00 46.02 45.15 3hfz n GLY 129 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hfz n GLY 130 N -0.61 2.44 0.00 -0.02 0.00 -1.26 -4.97 105.19 100.77 3hfz n GLY 130 Ca 0.15 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.38 3hfz n GLY 130 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hfz n GLY 131 N 1.30 1.65 3.16 -0.02 0.00 -1.26 -4.67 105.19 105.34 3hfz n GLY 131 Ca 0.24 -0.55 -0.25 0.00 0.00 0.00 0.00 46.02 45.46 3hfz n GLY 131 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3hfz n LEU 132 N 0.00 -1.51 -4.92 0.99 4.77 -1.26 -4.17 117.00 110.89 3hfz n LEU 132 Ca 0.00 -0.39 -0.26 0.00 -0.03 0.00 0.00 56.01 55.33 3hfz n LEU 132 Cb 0.00 -0.89 -0.02 0.00 -2.33 0.00 0.00 43.42 40.18 3hfz n LEU 132 CO 0.00 -3.45 0.24 -0.76 -1.33 0.00 0.00 177.39 172.09 3hfz s LEU 133 N -2.17 3.96 -0.17 2.23 2.01 -0.60 -4.72 118.68 119.22 3hfz s LEU 133 Ca 0.50 0.65 -0.00 0.00 0.01 0.00 0.00 54.13 55.28 3hfz s LEU 133 Cb -0.10 -3.51 0.04 0.00 0.01 0.00 0.00 46.19 42.63 3hfz s LEU 133 CO 0.50 -0.31 -0.06 -1.61 1.01 0.00 0.00 176.35 175.87 3hfz s GLU 134 N -4.08 1.55 0.34 1.70 2.02 -1.26 -4.64 118.70 114.33 3hfz s GLU 134 Ca 0.43 -0.54 0.08 0.00 0.02 0.00 0.00 54.97 54.96 3hfz s GLU 134 Cb -0.10 -2.03 -0.07 0.00 0.10 0.00 0.00 34.13 32.03 3hfz s GLU 134 CO 0.35 -0.41 -0.05 -0.06 0.02 0.00 0.00 175.26 175.11 3hfz s PHE 135 N 1.60 2.27 0.40 1.61 0.08 -0.65 -4.65 117.98 118.64 3hfz s PHE 135 Ca 0.01 -0.63 -0.26 0.00 0.12 0.00 0.00 56.93 56.17 3hfz s PHE 135 Cb -0.15 -1.39 -0.11 0.00 -0.57 0.00 0.00 43.02 40.81 3hfz s PHE 135 CO -0.08 0.42 1.21 -2.30 -0.10 0.00 0.00 175.22 174.37 3hfz n PRO 136 N -0.77 1.81 0.32 0.24 -0.02 -1.26 -0.76 135.00 134.56 3hfz n PRO 136 Ca -0.05 0.64 0.21 0.00 -2.02 0.00 0.00 63.50 62.28 3hfz n PRO 136 Cb 0.65 -2.28 1.02 0.00 -0.02 0.00 0.00 33.50 32.86 3hfz n PRO 136 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 3hfz h GLU 137 N 2.04 0.00 -0.17 -0.52 4.81 -1.87 -2.63 114.58 116.24 3hfz h GLU 137 Ca -0.46 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 3hfz h GLU 137 Cb 1.30 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.68 3hfz h GLU 137 CO 0.60 0.00 0.00 -0.40 -0.73 0.00 0.00 179.01 178.48 3hfz n ASP 138 N -3.09 2.35 -0.25 1.04 5.68 -1.26 -4.78 116.55 116.24 3hfz n ASP 138 Ca -0.02 -1.80 -0.07 0.00 -0.50 0.00 0.00 54.79 52.41 3hfz n ASP 138 Cb 0.16 -0.11 -0.06 0.00 -1.14 0.00 0.00 41.12 39.97 3hfz n ASP 138 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3hfz n ALA 139 N 0.27 -0.38 -2.33 2.12 0.00 -0.99 -4.58 120.51 114.62 3hfz n ALA 139 Ca 0.07 0.51 -0.17 0.00 0.00 0.00 0.00 53.44 53.84 3hfz n ALA 139 Cb 0.32 -0.05 -0.10 0.00 0.00 0.00 0.00 19.45 19.62 3hfz n ALA 139 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3hfz s LEU 140 N -9.22 2.36 0.37 0.00 1.43 -1.26 -5.06 118.68 107.31 3hfz s LEU 140 Ca -0.07 -1.15 -0.27 0.00 -1.03 0.00 0.00 54.13 51.61 3hfz s LEU 140 Cb 0.07 -0.40 -0.09 0.00 0.03 0.00 0.00 46.19 45.79 3hfz s LEU 140 CO 0.37 -0.41 1.25 -2.84 0.23 0.00 0.00 176.35 174.95 3hfz s PRO 141 N -3.79 4.15 0.13 1.29 0.02 -1.26 -4.87 135.00 130.67 3hfz s PRO 141 Ca 0.26 2.05 -0.35 0.00 0.02 0.00 0.00 61.00 62.98 3hfz s PRO 141 Cb 0.04 -2.85 -0.16 0.00 0.02 0.00 0.00 34.50 31.55 3hfz s PRO 141 CO 0.07 -0.30 1.31 -2.30 -0.33 0.00 0.00 177.00 175.45 3hfz n PRO 142 N 0.38 1.30 0.00 5.54 -0.02 -1.26 -1.88 135.00 139.06 3hfz n PRO 142 Ca 0.02 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 3hfz n PRO 142 Cb 0.44 -2.08 0.00 0.00 -0.02 0.00 0.00 33.50 31.84 3hfz n PRO 142 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hfz n GLY 143 N 2.43 2.81 3.50 -1.23 0.00 0.39 -3.34 105.19 109.74 3hfz n GLY 143 Ca 0.17 -0.74 -0.50 0.00 0.00 0.00 0.00 46.02 44.95 3hfz n GLY 143 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3hfz n THR 144 N 0.00 1.34 -1.95 2.61 -2.24 -0.79 -4.17 114.28 109.09 3hfz n THR 144 Ca 0.00 -0.33 -0.41 0.00 -2.27 0.00 0.00 64.05 61.03 3hfz n THR 144 Cb 0.00 -0.41 -0.02 0.00 -2.10 0.00 0.00 70.33 67.80 3hfz n THR 144 CO 0.00 0.00 0.00 -2.84 -0.57 0.00 0.00 175.07 171.66 3hfz s PRO 145 N -0.74 4.23 0.35 -0.78 0.02 -1.26 -1.88 135.00 134.94 3hfz s PRO 145 Ca 0.70 2.39 0.04 0.00 0.02 0.00 0.00 61.00 64.15 3hfz s PRO 145 Cb -0.93 -3.07 0.70 0.00 0.02 0.00 0.00 34.50 31.22 3hfz s PRO 145 CO 0.56 -0.45 1.97 1.25 -0.33 0.00 0.00 177.00 179.99 3hfz h LEU 146 N 4.59 0.70 -0.77 -5.54 5.85 -1.68 -2.06 115.31 116.39 3hfz h LEU 146 Ca -0.47 -0.00 0.18 0.00 0.84 0.00 0.00 57.88 58.43 3hfz h LEU 146 Cb 1.22 -0.15 -0.13 0.00 0.37 0.00 0.00 40.66 41.97 3hfz h LEU 146 CO 0.75 0.47 0.05 0.28 -0.34 0.00 0.00 178.44 179.65 3hfz h SER 147 N 0.80 -0.27 0.00 1.25 0.02 -1.78 0.53 113.55 114.10 3hfz h SER 147 Ca 0.29 0.19 0.00 0.00 -0.84 0.00 0.00 61.79 61.44 3hfz h SER 147 Cb 0.15 0.32 0.00 0.00 0.14 0.00 0.00 62.40 63.02 3hfz h SER 147 CO -0.09 -0.17 0.00 -0.62 -1.14 0.00 0.00 176.83 174.81 3hfz n GLU 148 N -5.31 0.00 0.00 3.45 1.02 -0.78 -1.02 120.64 118.00 3hfz n GLU 148 Ca 0.15 0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.29 3hfz n GLU 148 Cb 0.50 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.42 3hfz n GLU 148 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3hfz n ALA 149 N -0.93 0.00 -3.45 0.62 0.00 0.14 -4.93 120.51 111.96 3hfz n ALA 149 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.17 3hfz n ALA 149 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.35 3hfz n ALA 149 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 3hfz n TRP 150 N 0.00 0.23 -2.08 0.00 -0.00 0.10 -4.80 117.44 110.90 3hfz n TRP 150 Ca 0.00 -3.59 -0.33 0.00 -0.00 0.00 0.00 57.50 53.58 3hfz n TRP 150 Cb 0.05 -0.06 0.01 0.00 -0.00 0.00 0.00 31.31 31.30 3hfz n TRP 150 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 177.69 176.44 3hfz s PRO 151 N -0.62 3.37 1.07 5.87 0.04 -1.16 -4.43 135.00 139.16 3hfz s PRO 151 Ca 0.32 1.18 -0.13 0.00 0.04 0.00 0.00 61.00 62.42 3hfz s PRO 151 Cb 0.06 -2.04 0.20 0.00 0.04 0.00 0.00 34.50 32.75 3hfz s PRO 151 CO -0.17 -0.76 0.86 0.39 0.04 0.00 0.00 177.00 177.36 3hfz n GLU 152 N -1.99 -1.56 -3.99 4.56 1.02 -1.24 -4.70 120.64 112.74 3hfz n GLU 152 Ca 0.09 -0.41 -0.08 0.00 -0.02 0.00 0.00 57.16 56.73 3hfz n GLU 152 Cb 0.53 -2.14 -0.10 0.00 -0.02 0.00 0.00 31.44 29.72 3hfz n GLU 152 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 3hfz s GLU 153 N -4.27 0.60 -0.16 3.49 2.56 -1.26 -4.75 118.70 114.91 3hfz s GLU 153 Ca 0.65 -0.96 -0.01 0.00 0.00 0.00 0.00 54.97 54.66 3hfz s GLU 153 Cb -0.23 0.22 -0.01 0.00 2.00 0.00 0.00 34.13 36.12 3hfz s GLU 153 CO 0.63 -0.14 -0.12 0.08 -0.56 0.00 0.00 175.26 175.16 3hfz s VAL 154 N -3.19 2.98 -0.17 3.70 1.01 -1.24 0.15 120.40 123.64 3hfz s VAL 154 Ca 0.00 -0.66 0.01 0.00 0.00 0.00 0.00 61.98 61.32 3hfz s VAL 154 Cb 0.02 -2.28 0.02 0.00 0.00 0.00 0.00 36.38 34.15 3hfz s VAL 154 CO -0.07 0.50 -0.18 -0.69 0.00 0.00 0.00 175.10 174.66 3hfz s VAL 155 N 0.77 1.86 -0.16 2.92 1.01 0.17 -1.51 120.40 125.46 3hfz s VAL 155 Ca -0.05 -0.81 -0.22 0.00 0.00 0.00 0.00 61.98 60.90 3hfz s VAL 155 Cb -0.15 -1.70 -0.03 0.00 0.00 0.00 0.00 36.38 34.50 3hfz s VAL 155 CO 0.01 0.51 0.65 -0.76 0.00 0.00 0.00 175.10 175.51 3hfz s LEU 156 N 1.35 4.19 -1.05 3.92 1.02 -0.82 -1.68 118.68 125.61 3hfz s LEU 156 Ca 0.05 0.93 -0.19 0.00 0.02 0.00 0.00 54.13 54.94 3hfz s LEU 156 Cb -0.13 -2.94 0.10 0.00 0.02 0.00 0.00 46.19 43.24 3hfz s LEU 156 CO -0.12 -0.23 1.36 -0.62 0.02 0.00 0.00 176.35 176.76 3hfz s ASP 157 N 1.07 6.69 0.82 2.29 -1.08 0.24 0.66 116.67 127.36 3hfz s ASP 157 Ca 0.31 -2.07 -0.11 0.00 -0.52 0.00 0.00 52.55 50.15 3hfz s ASP 157 Cb -0.16 -2.48 0.08 0.00 -1.46 0.00 0.00 42.92 38.90 3hfz s ASP 157 CO 0.12 -1.16 1.09 -0.22 0.52 0.00 0.00 175.17 175.52 3hfz s LEU 158 N 3.42 2.57 -0.27 -1.34 0.20 -1.24 -0.92 118.68 121.09 3hfz s LEU 158 Ca 0.41 1.40 0.02 0.00 0.69 0.00 0.00 54.13 56.65 3hfz s LEU 158 Cb -0.02 -3.98 0.07 0.00 -0.43 0.00 0.00 46.19 41.83 3hfz s LEU 158 CO -0.06 -2.11 -0.04 -1.61 -0.29 0.00 0.00 176.35 172.24 3hfz s GLU 159 N -5.08 1.73 -0.14 1.98 0.41 -1.20 -1.19 118.70 115.21 3hfz s GLU 159 Ca 0.61 -1.32 -0.08 0.00 -0.41 0.00 0.00 54.97 53.77 3hfz s GLU 159 Cb -0.15 -2.79 -0.04 0.00 -1.78 0.00 0.00 34.13 29.36 3hfz s GLU 159 CO 0.55 -0.70 0.13 0.08 -0.49 0.00 0.00 175.26 174.83 3hfz s VAL 160 N 1.20 5.38 0.16 2.63 1.01 -1.26 -4.05 120.40 125.46 3hfz s VAL 160 Ca -0.02 0.17 0.05 0.00 0.00 0.00 0.00 61.98 62.18 3hfz s VAL 160 Cb -0.19 -3.37 -0.04 0.00 0.00 0.00 0.00 36.38 32.78 3hfz s VAL 160 CO -0.08 0.56 0.13 0.42 0.00 0.00 0.00 175.10 176.14 3hfz s THR 161 N -0.59 4.48 0.32 3.92 -4.23 -1.26 -4.99 115.64 113.29 3hfz s THR 161 Ca 0.12 -1.05 0.22 0.00 -1.18 0.00 0.00 61.69 59.81 3hfz s THR 161 Cb -0.12 -3.27 0.35 0.00 1.34 0.00 0.00 72.50 70.80 3hfz s THR 161 CO 0.02 -0.08 1.16 -2.65 -0.54 0.00 0.00 174.62 172.53 3hfz n PRO 162 N -0.26 -0.03 0.15 3.99 -0.02 -1.26 0.16 135.00 137.73 3hfz n PRO 162 Ca -0.08 0.95 0.13 0.00 -2.02 0.00 0.00 63.50 62.47 3hfz n PRO 162 Cb 0.54 -1.83 0.44 0.00 -0.02 0.00 0.00 33.50 32.63 3hfz n PRO 162 CO 0.00 0.00 0.00 -2.95 1.98 0.00 0.00 175.50 174.53 3hfz h ASN 163 N 0.00 0.00 -2.26 2.55 -1.07 -1.96 -3.36 115.58 109.48 3hfz h ASN 163 Ca 0.65 0.00 -0.60 0.00 0.07 0.00 0.00 56.30 56.42 3hfz h ASN 163 Cb 2.02 0.00 -0.42 0.00 -2.07 0.00 0.00 38.32 37.85 3hfz h ASN 163 CO -0.39 0.00 -0.62 0.54 0.07 0.00 0.00 177.43 177.04 3hfz n ARG 164 N -2.50 2.38 0.17 4.14 5.12 0.41 -4.11 116.66 122.27 3hfz n ARG 164 Ca 0.04 -4.58 0.02 0.00 -1.93 0.00 0.00 57.85 51.39 3hfz n ARG 164 Cb 0.37 -2.21 0.29 0.00 -1.16 0.00 0.00 32.46 29.74 3hfz n ARG 164 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 3hfz h PRO 165 N 4.28 0.00 -0.07 5.56 0.13 -1.72 -2.06 132.00 138.11 3hfz h PRO 165 Ca 0.19 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 65.34 3hfz h PRO 165 Cb 0.68 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.81 3hfz h PRO 165 CO 0.81 0.47 0.08 0.38 -0.23 0.00 0.00 178.00 179.51 3hfz h ASP 166 N 0.00 0.00 0.14 1.44 2.03 -1.88 0.42 116.42 118.57 3hfz h ASP 166 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 3hfz h ASP 166 Cb 0.89 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.39 3hfz h ASP 166 CO 0.06 0.00 0.00 0.00 -1.03 0.00 0.00 179.24 178.27 3hfz n ALA 167 N -2.33 2.20 1.46 4.15 0.00 -0.77 -2.10 120.51 123.11 3hfz n ALA 167 Ca -0.01 -0.12 0.09 0.00 0.00 0.00 0.00 53.44 53.40 3hfz n ALA 167 Cb 0.17 -1.34 0.40 0.00 0.00 0.00 0.00 19.45 18.69 3hfz n ALA 167 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3hfz n LEU 168 N -1.11 1.13 -4.22 0.00 4.77 0.15 -4.62 117.00 113.11 3hfz n LEU 168 Ca 0.14 -0.48 -0.33 0.00 -0.03 0.00 0.00 56.01 55.31 3hfz n LEU 168 Cb 0.11 -0.08 -0.16 0.00 -2.33 0.00 0.00 43.42 40.96 3hfz n LEU 168 CO 0.13 0.24 -0.52 -0.83 -1.33 0.00 0.00 177.39 175.08 3hfz s GLY 169 N -1.52 1.40 0.51 -0.72 0.00 -0.89 -4.09 107.32 102.01 3hfz s GLY 169 Ca 0.29 -1.04 0.31 0.00 0.00 0.00 0.00 44.72 44.28 3hfz s GLY 169 CO 0.23 -0.09 1.83 1.41 0.00 0.00 0.00 173.10 176.49 3hfz h LEU 170 N 7.15 0.10 -0.14 0.66 4.07 -1.00 1.78 115.31 127.93 3hfz h LEU 170 Ca -0.29 0.02 0.00 0.00 0.08 0.00 0.00 57.88 57.69 3hfz h LEU 170 Cb 1.20 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.94 3hfz h LEU 170 CO 0.54 0.02 -0.04 -0.11 -1.08 0.00 0.00 178.44 177.77 3hfz n LEU 171 N -4.30 0.26 -0.00 1.67 0.00 -0.80 -1.18 117.00 112.64 3hfz n LEU 171 Ca 0.23 0.07 -0.22 0.00 0.00 0.00 0.00 56.01 56.10 3hfz n LEU 171 Cb 1.07 -0.17 -0.14 0.00 0.00 0.00 0.00 43.42 44.19 3hfz n LEU 171 CO 0.37 0.05 -0.54 1.23 0.00 0.00 0.00 177.39 178.49 3hfz h GLY 172 N 4.98 0.26 0.89 -3.96 0.00 0.26 -3.23 103.07 102.27 3hfz h GLY 172 Ca 0.00 -0.66 -0.04 0.00 0.00 0.00 0.00 47.33 46.64 3hfz h GLY 172 CO 0.00 0.57 -0.44 1.41 0.00 0.00 0.00 176.54 178.08 3hfz h LEU 173 N -0.28 -1.10 0.00 3.11 4.07 -1.29 -2.15 115.31 117.67 3hfz h LEU 173 Ca -0.34 0.05 0.00 0.00 0.08 0.00 0.00 57.88 57.67 3hfz h LEU 173 Cb 1.79 0.31 0.00 0.00 1.08 0.00 0.00 40.66 43.84 3hfz h LEU 173 CO 0.04 -0.71 0.19 0.00 -1.08 0.00 0.00 178.44 176.87 3hfz n ALA 174 N -2.66 0.47 -0.08 1.53 0.00 -0.32 0.19 120.51 119.65 3hfz n ALA 174 Ca -0.15 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.21 3hfz n ALA 174 Cb 0.47 -0.40 -0.11 0.00 0.00 0.00 0.00 19.45 19.41 3hfz n ALA 174 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3hfz n ARG 175 N -1.01 1.35 -0.18 0.00 0.63 -0.83 -3.45 116.66 113.17 3hfz n ARG 175 Ca 0.00 0.02 -0.07 0.00 -0.92 0.00 0.00 57.85 56.88 3hfz n ARG 175 Cb 0.19 -1.38 0.02 0.00 0.45 0.00 0.00 32.46 31.74 3hfz n ARG 175 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 3hfz h ASP 176 N 0.00 0.63 -0.18 6.15 5.19 -0.05 -2.27 116.42 125.88 3hfz h ASP 176 Ca -0.40 -0.06 -0.02 0.00 -0.62 0.00 0.00 57.03 55.94 3hfz h ASP 176 Cb 1.84 -0.16 -0.01 0.00 0.18 0.00 0.00 39.33 41.19 3hfz h ASP 176 CO 0.00 0.50 0.05 -0.07 -3.12 0.00 0.00 179.24 176.60 3hfz h LEU 177 N 0.71 0.27 -1.85 1.55 3.38 -1.63 -2.10 115.31 115.64 3hfz h LEU 177 Ca 0.19 -0.22 0.19 0.00 0.09 0.00 0.00 57.88 58.12 3hfz h LEU 177 Cb -0.02 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.64 3hfz h LEU 177 CO -0.04 0.43 0.63 -0.74 0.09 0.00 0.00 178.44 178.80 3hfz h HIS 178 N 0.11 0.00 0.00 1.13 2.76 -1.47 0.68 115.15 118.36 3hfz h HIS 178 Ca 0.06 0.00 -0.15 0.00 -2.20 0.00 0.00 60.37 58.08 3hfz h HIS 178 Cb 0.26 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.19 3hfz h HIS 178 CO 0.01 0.00 -0.73 0.00 -1.30 0.00 0.00 177.93 175.91 3hfz h ALA 179 N 1.35 0.54 0.00 5.26 0.00 -0.83 -2.62 119.26 122.95 3hfz h ALA 179 Ca 0.30 -0.66 0.00 0.00 0.00 0.00 0.00 54.91 54.56 3hfz h ALA 179 Cb 1.55 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.23 3hfz h ALA 179 CO -0.00 0.90 0.00 -0.07 0.00 0.00 0.00 179.25 180.07 3hfz h LEU 180 N 0.00 0.00 0.00 0.00 4.07 0.54 -3.45 115.31 116.46 3hfz h LEU 180 Ca -0.01 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.95 3hfz h LEU 180 Cb 1.55 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.29 3hfz h LEU 180 CO 0.09 0.00 0.00 0.61 -1.08 0.00 0.00 178.44 178.06 3hfz n GLY 181 N -0.41 1.39 3.56 0.83 0.00 -0.99 -5.12 105.19 104.46 3hfz n GLY 181 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 3hfz n GLY 181 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3hfz s TYR 182 N -1.31 1.64 -0.01 1.61 1.51 -1.18 -4.97 117.35 114.64 3hfz s TYR 182 Ca 0.00 1.14 -0.10 0.00 -1.01 0.00 0.00 57.07 57.10 3hfz s TYR 182 Cb 0.00 -3.16 -0.05 0.00 -0.11 0.00 0.00 41.96 38.64 3hfz s TYR 182 CO 0.00 -3.48 0.32 0.00 -1.11 0.00 0.00 175.55 171.28 3hfz s ALA 183 N -2.65 3.78 -0.12 3.71 0.00 -1.26 -4.43 121.76 120.79 3hfz s ALA 183 Ca 0.67 -0.42 -0.03 0.00 0.00 0.00 0.00 51.96 52.18 3hfz s ALA 183 Cb -0.23 -2.20 -0.03 0.00 0.00 0.00 0.00 23.12 20.66 3hfz s ALA 183 CO 0.62 0.57 -0.00 -1.17 0.00 0.00 0.00 175.76 175.77 3hfz s LEU 184 N -1.41 3.50 -0.38 0.00 0.20 -1.26 -4.29 118.68 115.03 3hfz s LEU 184 Ca 0.25 0.05 0.03 0.00 0.69 0.00 0.00 54.13 55.15 3hfz s LEU 184 Cb -0.14 -1.82 0.11 0.00 -0.43 0.00 0.00 46.19 43.90 3hfz s LEU 184 CO 0.13 0.29 0.11 -0.69 -0.29 0.00 0.00 176.35 175.90 3hfz s VAL 185 N -0.34 2.08 0.01 1.68 1.01 0.39 -5.00 120.40 120.24 3hfz s VAL 185 Ca 0.07 -2.44 -0.23 0.00 0.00 0.00 0.00 61.98 59.38 3hfz s VAL 185 Cb -0.12 -2.52 -0.05 0.00 0.00 0.00 0.00 36.38 33.69 3hfz s VAL 185 CO 0.02 -0.67 0.68 -1.61 0.00 0.00 0.00 175.10 173.51 3hfz s GLU 186 N 0.71 4.40 0.55 2.72 2.02 -1.26 -4.22 118.70 123.62 3hfz s GLU 186 Ca 0.13 0.89 -0.19 0.00 0.02 0.00 0.00 54.97 55.81 3hfz s GLU 186 Cb -0.21 -3.36 -0.05 0.00 0.10 0.00 0.00 34.13 30.61 3hfz s GLU 186 CO -0.08 0.31 1.12 -1.25 0.02 0.00 0.00 175.26 175.38 3hfz s PRO 187 N -0.07 3.33 -0.04 0.39 0.04 -1.26 -5.05 135.00 132.35 3hfz s PRO 187 Ca 0.35 1.56 -0.01 0.00 0.04 0.00 0.00 61.00 62.94 3hfz s PRO 187 Cb -0.19 -2.01 -0.04 0.00 0.04 0.00 0.00 34.50 32.31 3hfz s PRO 187 CO 0.20 -0.86 0.04 -1.83 0.04 0.00 0.00 177.00 174.59 3hfz s GLU 188 N -3.38 3.01 -1.17 4.56 -1.05 -1.26 -5.05 118.70 114.36 3hfz s GLU 188 Ca 0.72 -0.46 -0.18 0.00 -0.15 0.00 0.00 54.97 54.89 3hfz s GLU 188 Cb -0.23 -2.82 0.10 0.00 -0.44 0.00 0.00 34.13 30.74 3hfz s GLU 188 CO 0.28 0.67 1.52 0.00 0.95 0.00 0.00 175.26 178.68 3hfz s ALA 189 N -1.06 3.35 -1.01 -0.84 0.00 -1.26 -4.94 121.76 116.00 3hfz s ALA 189 Ca 0.18 -2.85 -0.23 0.00 0.00 0.00 0.00 51.96 49.06 3hfz s ALA 189 Cb -0.12 -4.42 -0.01 0.00 0.00 0.00 0.00 23.12 18.57 3hfz s ALA 189 CO 0.09 -3.21 1.78 0.00 0.00 0.00 0.00 175.76 174.41 3hfz s ALA 190 N 3.58 2.13 -0.15 0.00 0.00 -1.26 -4.93 121.76 121.13 3hfz s ALA 190 Ca 0.47 -1.93 -0.02 0.00 0.00 0.00 0.00 51.96 50.48 3hfz s ALA 190 Cb 0.00 -4.57 -0.02 0.00 0.00 0.00 0.00 23.12 18.54 3hfz s ALA 190 CO -0.00 -4.39 -0.09 -0.51 0.00 0.00 0.00 175.76 170.77 3hfz s LEU 191 N 8.19 2.89 -0.77 0.00 1.43 -1.26 -4.73 118.68 124.43 3hfz s LEU 191 Ca 0.61 -0.28 -0.03 0.00 -1.03 0.00 0.00 54.13 53.40 3hfz s LEU 191 Cb -0.03 -1.68 0.19 0.00 0.03 0.00 0.00 46.19 44.70 3hfz s LEU 191 CO -0.01 0.14 0.62 -0.75 0.23 0.00 0.00 176.35 176.58 3hfz s LYS 192 N 0.53 2.99 0.04 1.70 2.20 -1.26 -5.06 119.74 120.88 3hfz s LYS 192 Ca -0.06 -2.86 -0.09 0.00 -0.36 0.00 0.00 55.97 52.59 3hfz s LYS 192 Cb -0.15 -3.90 -0.05 0.00 -1.51 0.00 0.00 37.83 32.21 3hfz s LYS 192 CO 0.03 -1.22 0.35 0.00 -0.36 0.00 0.00 175.35 174.15 3hfz s ALA 193 N -0.62 3.77 -0.04 3.13 0.00 -1.26 -4.37 121.76 122.37 3hfz s ALA 193 Ca 0.22 -0.44 0.06 0.00 0.00 0.00 0.00 51.96 51.79 3hfz s ALA 193 Cb -0.14 -2.20 -0.02 0.00 0.00 0.00 0.00 23.12 20.76 3hfz s ALA 193 CO -0.08 0.59 -0.20 -1.83 0.00 0.00 0.00 175.76 174.24 3hfz s GLU 194 N -1.77 2.36 -0.06 0.00 -1.05 -0.51 -4.74 118.70 112.93 3hfz s GLU 194 Ca 0.30 -0.82 -0.30 0.00 -0.15 0.00 0.00 54.97 54.01 3hfz s GLU 194 Cb -0.14 -2.22 -0.04 0.00 -0.44 0.00 0.00 34.13 31.29 3hfz s GLU 194 CO 0.17 0.56 1.46 0.00 0.95 0.00 0.00 175.26 178.40 3hfz s ALA 195 N -0.60 3.62 -0.21 -0.84 0.00 -1.26 -1.82 121.76 120.65 3hfz s ALA 195 Ca 0.09 0.80 -0.34 0.00 0.00 0.00 0.00 51.96 52.51 3hfz s ALA 195 Cb -0.11 -3.66 0.15 0.00 0.00 0.00 0.00 23.12 19.50 3hfz s ALA 195 CO 0.00 -1.17 1.22 -0.48 0.00 0.00 0.00 175.76 175.34 3hfz s LEU 196 N 3.31 -0.14 0.66 0.00 0.05 -1.26 -4.99 118.68 116.32 3hfz s LEU 196 Ca 0.65 0.05 -0.12 0.00 0.05 0.00 0.00 54.13 54.76 3hfz s LEU 196 Cb -0.30 1.36 -0.00 0.00 -2.05 0.00 0.00 46.19 45.20 3hfz s LEU 196 CO 0.25 -0.20 1.06 -2.16 -0.55 0.00 0.00 176.35 174.75 3hfz s PRO 197 N -1.99 3.03 -0.37 1.48 0.04 -1.26 -4.75 135.00 131.18 3hfz s PRO 197 Ca 0.08 1.05 -0.17 0.00 0.04 0.00 0.00 61.00 62.01 3hfz s PRO 197 Cb -0.01 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.53 3hfz s PRO 197 CO -0.05 -1.03 0.45 -0.51 0.04 0.00 0.00 177.00 175.90 3hfz s LEU 198 N -5.20 4.50 0.00 -3.56 1.43 -1.26 -4.95 118.68 109.63 3hfz s LEU 198 Ca 0.60 -0.25 -0.00 0.00 -1.03 0.00 0.00 54.13 53.45 3hfz s LEU 198 Cb -0.15 -2.46 -0.00 0.00 0.03 0.00 0.00 46.19 43.60 3hfz s LEU 198 CO 0.49 -0.47 0.31 -0.81 0.23 0.00 0.00 176.35 176.10 3hfz n PRO 199 N 5.61 0.04 -3.74 1.29 -0.04 -1.26 -4.60 135.00 132.31 3hfz n PRO 199 Ca -0.07 -0.01 0.04 0.00 -0.04 0.00 0.00 63.50 63.42 3hfz n PRO 199 Cb 0.49 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.45 3hfz n PRO 199 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 3hfz s PHE 200 N 2.45 -0.00 0.19 0.54 -0.12 -1.26 -4.92 117.98 114.85 3hfz s PHE 200 Ca 0.01 -0.00 -0.01 0.00 -0.05 0.00 0.00 56.93 56.87 3hfz s PHE 200 Cb 0.00 0.50 -0.04 0.00 -0.63 0.00 0.00 43.02 42.86 3hfz s PHE 200 CO 0.00 -0.01 0.13 0.00 -0.05 0.00 0.00 175.22 175.29 3hfz s ALA 201 N -2.01 1.04 -0.07 1.99 0.00 -0.82 -4.96 121.76 116.94 3hfz s ALA 201 Ca 0.22 -1.61 0.05 0.00 0.00 0.00 0.00 51.96 50.62 3hfz s ALA 201 Cb 0.05 1.26 -0.01 0.00 0.00 0.00 0.00 23.12 24.42 3hfz s ALA 201 CO -0.05 -0.58 -0.24 -1.17 0.00 0.00 0.00 175.76 173.72 3hfz s LEU 202 N -3.13 2.10 -0.17 0.00 2.96 -1.26 0.22 118.68 119.40 3hfz s LEU 202 Ca 0.35 -0.52 -0.03 0.00 -0.22 0.00 0.00 54.13 53.71 3hfz s LEU 202 Cb 0.07 -1.39 0.06 0.00 0.50 0.00 0.00 46.19 45.42 3hfz s LEU 202 CO 0.10 0.22 0.05 -0.75 -1.32 0.00 0.00 176.35 174.65 3hfz s LYS 203 N -0.00 0.42 -0.58 1.98 2.20 -0.27 -4.98 119.74 118.51 3hfz s LYS 203 Ca -0.08 -0.24 -0.15 0.00 -0.36 0.00 0.00 55.97 55.13 3hfz s LYS 203 Cb -0.15 -1.88 0.14 0.00 -1.51 0.00 0.00 37.83 34.43 3hfz s LYS 203 CO 0.05 -0.62 0.53 0.08 -0.36 0.00 0.00 175.35 175.04 3hfz s VAL 204 N 1.98 5.21 -1.21 4.02 1.01 -1.26 -1.04 120.40 129.10 3hfz s VAL 204 Ca 0.01 -1.66 0.27 0.00 0.00 0.00 0.00 61.98 60.60 3hfz s VAL 204 Cb -0.16 -4.33 0.35 0.00 0.00 0.00 0.00 36.38 32.24 3hfz s VAL 204 CO -0.08 -0.89 1.90 -0.62 0.00 0.00 0.00 175.10 175.41 3hfz n GLU 205 N 5.05 0.19 -3.48 2.72 1.02 0.73 -4.27 120.64 122.61 3hfz n GLU 205 Ca -0.10 0.04 -0.27 0.00 -0.02 0.00 0.00 57.16 56.81 3hfz n GLU 205 Cb 0.41 -1.50 -0.10 0.00 -0.02 0.00 0.00 31.44 30.23 3hfz n GLU 205 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 3hfz n ASP 206 N -1.39 0.18 0.00 1.62 -0.08 -1.16 -4.91 116.55 110.81 3hfz n ASP 206 Ca 0.10 -2.54 0.05 0.00 -1.51 0.00 0.00 54.79 50.89 3hfz n ASP 206 Cb 0.27 -0.59 0.25 0.00 2.34 0.00 0.00 41.12 43.38 3hfz n ASP 206 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 3hfz n PRO 207 N 2.63 0.15 -0.01 -0.67 -0.04 -1.26 -2.22 135.00 133.57 3hfz n PRO 207 Ca 0.28 0.18 -0.21 0.00 -0.04 0.00 0.00 63.50 63.71 3hfz n PRO 207 Cb 0.46 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.28 3hfz n PRO 207 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 3hfz h GLU 208 N 0.00 0.21 -0.58 0.54 4.57 -1.96 -3.10 114.58 114.26 3hfz h GLU 208 Ca 0.00 -0.36 0.00 0.00 -1.18 0.00 0.00 59.36 57.82 3hfz h GLU 208 Cb 0.09 0.13 0.00 0.00 -0.16 0.00 0.00 28.75 28.81 3hfz h GLU 208 CO 0.00 1.17 0.00 0.41 -1.18 0.00 0.00 179.01 179.41 3hfz n GLY 209 N 1.73 1.28 2.70 1.92 0.00 -0.94 -4.22 105.19 107.65 3hfz n GLY 209 Ca -0.26 -0.35 -0.06 0.00 0.00 0.00 0.00 46.02 45.36 3hfz n GLY 209 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hfz n ALA 210 N 0.31 -2.35 0.26 4.61 0.00 -1.09 -3.56 120.51 118.69 3hfz n ALA 210 Ca 0.11 -0.82 0.16 0.00 0.00 0.00 0.00 53.44 52.89 3hfz n ALA 210 Cb 0.45 -2.34 0.76 0.00 0.00 0.00 0.00 19.45 18.32 3hfz n ALA 210 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3hfz h PRO 211 N 2.93 0.00 -2.93 0.00 0.11 -1.62 -3.39 132.00 127.11 3hfz h PRO 211 Ca -0.22 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.72 3hfz h PRO 211 Cb 1.15 0.00 -0.29 0.00 0.11 0.00 0.00 31.00 31.97 3hfz h PRO 211 CO 0.04 0.00 -0.44 -1.58 -0.21 0.00 0.00 178.00 175.81 3hfz s HIS 212 N -4.24 -0.40 -0.09 0.65 2.46 -1.24 -4.22 115.29 108.20 3hfz s HIS 212 Ca -0.03 0.92 -0.04 0.00 0.47 0.00 0.00 55.06 56.37 3hfz s HIS 212 Cb 0.10 0.10 0.04 0.00 -0.13 0.00 0.00 32.58 32.70 3hfz s HIS 212 CO 0.34 -0.26 0.21 0.12 -2.47 0.00 0.00 174.74 172.69 3hfz s PHE 213 N 1.30 -0.28 0.16 3.88 2.19 0.62 -2.30 117.98 123.56 3hfz s PHE 213 Ca -0.09 0.70 0.04 0.00 0.33 0.00 0.00 56.93 57.91 3hfz s PHE 213 Cb -0.10 -0.00 -0.05 0.00 -1.31 0.00 0.00 43.02 41.56 3hfz s PHE 213 CO -0.10 -0.22 -0.08 0.95 1.83 0.00 0.00 175.22 177.60 3hfz s THR 214 N 1.31 1.15 0.03 0.12 -4.23 -1.15 0.24 115.64 113.11 3hfz s THR 214 Ca -0.09 -2.06 -0.04 0.00 -1.18 0.00 0.00 61.69 58.33 3hfz s THR 214 Cb -0.11 -1.93 -0.02 0.00 1.34 0.00 0.00 72.50 71.78 3hfz s THR 214 CO -0.08 -0.67 0.05 -0.76 -0.54 0.00 0.00 174.62 172.62 3hfz s LEU 215 N -3.19 1.98 0.03 4.79 1.43 -0.47 -2.86 118.68 120.39 3hfz s LEU 215 Ca 0.19 -0.55 0.01 0.00 -1.03 0.00 0.00 54.13 52.75 3hfz s LEU 215 Cb 0.03 0.42 -0.02 0.00 0.03 0.00 0.00 46.19 46.65 3hfz s LEU 215 CO 0.02 -0.45 -0.06 -0.83 0.23 0.00 0.00 176.35 175.26 3hfz s GLY 216 N -1.98 0.41 -0.24 -3.19 0.00 -1.12 -2.08 107.32 99.11 3hfz s GLY 216 Ca -0.07 -0.70 -0.03 0.00 0.00 0.00 0.00 44.72 43.92 3hfz s GLY 216 CO -0.04 -0.76 -0.04 -0.47 0.00 0.00 0.00 173.10 171.79 3hfz s TYR 217 N -1.42 3.02 -0.07 1.90 5.04 -1.26 -1.37 117.35 123.18 3hfz s TYR 217 Ca -0.12 -1.25 0.03 0.00 -2.44 0.00 0.00 57.07 53.29 3hfz s TYR 217 Cb -0.10 -2.09 0.01 0.00 0.35 0.00 0.00 41.96 40.13 3hfz s TYR 217 CO -0.00 -0.65 -0.16 0.00 -1.34 0.00 0.00 175.55 173.41 3hfz s ALA 218 N 1.40 1.51 0.26 3.97 0.00 -1.21 -1.43 121.76 126.26 3hfz s ALA 218 Ca 0.03 -0.58 0.01 0.00 0.00 0.00 0.00 51.96 51.43 3hfz s ALA 218 Cb -0.16 -0.62 -0.04 0.00 0.00 0.00 0.00 23.12 22.30 3hfz s ALA 218 CO -0.04 0.17 0.14 -0.59 0.00 0.00 0.00 175.76 175.45 3hfz s PHE 219 N 0.53 1.45 0.00 0.00 -0.71 -0.72 -1.25 117.98 117.27 3hfz s PHE 219 Ca -0.15 -1.34 0.00 0.00 -1.04 0.00 0.00 56.93 54.41 3hfz s PHE 219 Cb -0.16 -0.76 0.00 0.00 -1.21 0.00 0.00 43.02 40.89 3hfz s PHE 219 CO 0.05 -0.53 0.00 0.41 -1.34 0.00 0.00 175.22 173.81 3hfz n GLY 220 N -0.45 0.64 3.62 1.99 0.00 0.12 0.04 105.19 111.15 3hfz n GLY 220 Ca 0.01 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.56 3hfz n GLY 220 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3hfz n LEU 221 N 0.00 2.18 -3.49 0.99 4.77 -0.90 -4.42 117.00 116.13 3hfz n LEU 221 Ca 0.00 1.13 -0.31 0.00 -0.03 0.00 0.00 56.01 56.80 3hfz n LEU 221 Cb 0.00 -1.30 -0.05 0.00 -2.33 0.00 0.00 43.42 39.74 3hfz n LEU 221 CO 0.00 -0.90 0.34 -1.14 -1.33 0.00 0.00 177.39 174.36 3hfz n ARG 222 N 2.18 3.10 -1.69 3.23 3.00 -0.11 -4.55 116.66 121.81 3hfz n ARG 222 Ca 0.15 -4.67 -0.53 0.00 -0.00 0.00 0.00 57.85 52.79 3hfz n ARG 222 Cb 0.26 -2.31 -0.06 0.00 0.00 0.00 0.00 32.46 30.34 3hfz n ARG 222 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 3hfz n VAL 223 N 0.79 0.40 -3.54 5.15 0.31 -1.26 -4.82 118.33 115.36 3hfz n VAL 223 Ca 0.30 -0.07 -0.01 0.00 -0.01 0.00 0.00 64.34 64.55 3hfz n VAL 223 Cb 0.39 -1.48 -0.00 0.00 -0.91 0.00 0.00 33.84 31.84 3hfz n VAL 223 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3hfz n ALA 224 N 5.73 -0.03 -1.82 3.52 0.00 -1.26 -4.85 120.51 121.80 3hfz n ALA 224 Ca 0.24 -0.09 -0.33 0.00 0.00 0.00 0.00 53.44 53.27 3hfz n ALA 224 Cb 0.20 0.07 -0.05 0.00 0.00 0.00 0.00 19.45 19.67 3hfz n ALA 224 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 3hfz s PRO 225 N -2.04 4.04 0.51 0.00 0.02 -1.26 0.43 135.00 136.70 3hfz s PRO 225 Ca 0.02 1.07 -0.20 0.00 0.02 0.00 0.00 61.00 61.91 3hfz s PRO 225 Cb -0.00 -2.15 -0.07 0.00 0.02 0.00 0.00 34.50 32.30 3hfz s PRO 225 CO 0.01 -0.19 1.06 -1.12 -0.33 0.00 0.00 177.00 176.43 3hfz s SER 226 N -2.57 6.13 0.58 2.53 0.01 -1.26 -4.45 113.70 114.67 3hfz s SER 226 Ca 0.61 1.99 -0.20 0.00 1.31 0.00 0.00 55.95 59.66 3hfz s SER 226 Cb -0.10 -2.56 -0.03 0.00 0.21 0.00 0.00 66.02 63.53 3hfz s SER 226 CO 0.22 -0.93 1.34 -2.65 0.41 0.00 0.00 173.24 171.63 3hfz n PRO 227 N -1.14 1.50 -0.33 12.44 -0.02 -1.26 -4.49 135.00 141.70 3hfz n PRO 227 Ca 0.10 0.56 0.24 0.00 -2.02 0.00 0.00 63.50 62.38 3hfz n PRO 227 Cb 0.52 -2.57 0.47 0.00 -0.02 0.00 0.00 33.50 31.90 3hfz n PRO 227 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3hfz h LEU 228 N 1.11 0.33 -0.46 2.45 3.38 -1.95 -0.17 115.31 120.00 3hfz h LEU 228 Ca -0.51 0.22 0.03 0.00 0.09 0.00 0.00 57.88 57.70 3hfz h LEU 228 Cb 1.32 0.21 -0.03 0.00 0.09 0.00 0.00 40.66 42.25 3hfz h LEU 228 CO 0.56 -0.23 0.26 4.11 0.09 0.00 0.00 178.44 183.22 3hfz h TRP 229 N 0.20 0.49 -0.29 1.13 5.08 -1.90 -1.73 115.95 118.94 3hfz h TRP 229 Ca 0.73 0.02 -0.05 0.00 1.08 0.00 0.00 58.89 60.67 3hfz h TRP 229 Cb 1.72 -0.15 -0.01 0.00 -3.00 0.00 0.00 29.16 27.72 3hfz h TRP 229 CO -0.08 0.27 -0.00 1.98 -1.28 0.00 0.00 178.44 179.33 3hfz h MET 230 N 0.52 0.51 -0.85 0.12 -1.53 -1.38 -0.56 114.93 111.77 3hfz h MET 230 Ca 0.19 -0.16 0.06 0.00 -3.44 0.00 0.00 59.70 56.35 3hfz h MET 230 Cb 0.05 -0.05 -0.05 0.00 -0.55 0.00 0.00 31.60 31.00 3hfz h MET 230 CO -0.10 0.66 0.55 1.96 0.14 0.00 0.00 176.91 180.12 3hfz h GLN 231 N 0.30 0.94 0.60 0.39 4.20 -1.32 0.19 115.11 120.41 3hfz h GLN 231 Ca 0.08 -0.06 -0.03 0.00 0.06 0.00 0.00 58.65 58.71 3hfz h GLN 231 Cb 0.43 -0.21 0.01 0.00 0.30 0.00 0.00 27.48 28.01 3hfz h GLN 231 CO 0.02 0.62 -0.29 -0.09 -0.67 0.00 0.00 178.83 178.42 3hfz h ARG 232 N 0.97 -0.78 -0.76 1.46 2.43 -1.09 0.14 114.38 116.75 3hfz h ARG 232 Ca 0.36 0.05 0.09 0.00 -0.81 0.00 0.00 59.98 59.67 3hfz h ARG 232 Cb 0.18 0.18 -0.05 0.00 -0.42 0.00 0.00 29.97 29.85 3hfz h ARG 232 CO -0.13 -0.47 0.50 0.00 -1.51 0.00 0.00 179.97 178.36 3hfz h ALA 233 N -0.80 1.76 0.19 2.80 0.00 -0.67 0.15 119.26 122.70 3hfz h ALA 233 Ca -0.08 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 3hfz h ALA 233 Cb 0.67 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.30 3hfz h ALA 233 CO 0.14 0.09 -0.09 -0.07 0.00 0.00 0.00 179.25 179.32 3hfz h LEU 234 N 0.71 -0.21 -0.74 0.00 3.38 -0.58 -2.73 115.31 115.14 3hfz h LEU 234 Ca 0.34 -0.32 0.15 0.00 0.09 0.00 0.00 57.88 58.14 3hfz h LEU 234 Cb 0.40 0.06 -0.10 0.00 0.09 0.00 0.00 40.66 41.10 3hfz h LEU 234 CO -0.12 0.30 0.24 -0.26 0.09 0.00 0.00 178.44 178.69 3hfz h PHE 235 N -0.84 0.40 -0.91 1.13 0.04 -0.22 -1.41 116.94 115.14 3hfz h PHE 235 Ca -0.03 0.04 -0.00 0.00 2.80 0.00 0.00 57.97 60.78 3hfz h PHE 235 Cb 0.52 -0.06 -0.04 0.00 2.20 0.00 0.00 35.95 38.56 3hfz h PHE 235 CO 0.07 -0.01 0.55 0.00 -0.60 0.00 0.00 178.31 178.33 3hfz h ALA 236 N 1.57 1.26 -0.00 2.45 0.00 -0.76 -2.44 119.26 121.34 3hfz h ALA 236 Ca 0.41 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.22 3hfz h ALA 236 Cb 0.66 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 18.09 3hfz h ALA 236 CO -0.45 0.64 0.00 0.00 0.00 0.00 0.00 179.25 179.44 3hfz n ALA 237 N -2.40 2.62 0.00 0.00 0.00 -0.58 -4.84 120.51 115.31 3hfz n ALA 237 Ca 0.10 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.40 3hfz n ALA 237 Cb 0.06 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.17 3hfz n ALA 237 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hfz n GLY 238 N 0.83 0.38 3.74 0.00 0.00 -0.92 -4.64 105.19 104.59 3hfz n GLY 238 Ca 0.16 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.89 3hfz n GLY 238 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3hfz s MET 239 N -0.88 2.71 -0.17 1.61 -1.94 -0.90 -5.00 119.30 114.73 3hfz s MET 239 Ca 0.00 -0.87 -0.14 0.00 -1.71 0.00 0.00 55.69 52.98 3hfz s MET 239 Cb 0.00 -2.58 -0.05 0.00 2.01 0.00 0.00 34.83 34.21 3hfz s MET 239 CO 0.00 0.51 0.28 0.50 -0.01 0.00 0.00 175.02 176.30 3hfz s ARG 240 N -2.71 4.25 0.44 2.03 3.52 -1.26 -2.71 118.95 122.51 3hfz s ARG 240 Ca 0.29 0.07 -0.23 0.00 -0.13 0.00 0.00 55.73 55.73 3hfz s ARG 240 Cb -0.11 -3.44 -0.08 0.00 -1.56 0.00 0.00 34.95 29.76 3hfz s ARG 240 CO 0.21 0.22 1.09 -1.25 -0.81 0.00 0.00 175.30 174.76 3hfz s PRO 241 N 0.53 3.93 -0.06 5.12 0.04 -1.26 -4.97 135.00 138.33 3hfz s PRO 241 Ca 0.16 1.57 -0.03 0.00 0.04 0.00 0.00 61.00 62.74 3hfz s PRO 241 Cb -0.13 -2.39 -0.03 0.00 0.04 0.00 0.00 34.50 31.99 3hfz s PRO 241 CO 0.04 -0.36 -0.08 -0.89 0.04 0.00 0.00 177.00 175.75 3hfz n ILE 242 N -0.42 0.38 0.00 0.56 2.08 -1.26 -5.05 119.36 115.65 3hfz n ILE 242 Ca 0.07 -0.08 0.00 0.00 0.56 0.00 0.00 62.75 63.30 3hfz n ILE 242 Cb 0.50 -1.59 0.00 0.00 -0.75 0.00 0.00 39.64 37.79 3hfz n ILE 242 CO 0.00 0.00 0.00 -0.46 0.56 0.00 0.00 176.55 176.65 3hfz n ASN 243 N -3.30 0.00 0.00 4.38 0.23 -1.26 -4.89 115.26 110.42 3hfz n ASN 243 Ca -0.12 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 53.93 3hfz n ASN 243 Cb 0.58 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.28 3hfz n ASN 243 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 3hfz n ASN 244 N 0.00 0.00 -0.25 0.53 3.02 0.17 -0.87 115.26 117.86 3hfz n ASN 244 Ca 0.00 0.00 -0.03 0.00 -0.03 0.00 0.00 54.58 54.52 3hfz n ASN 244 Cb 0.00 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.16 3hfz n ASN 244 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 3hfz n VAL 245 N 0.00 -0.37 -0.03 2.41 0.31 -1.26 -0.88 118.33 118.51 3hfz n VAL 245 Ca 0.00 1.51 -0.09 0.00 -0.01 0.00 0.00 64.34 65.75 3hfz n VAL 245 Cb 0.00 -1.94 -0.03 0.00 -0.91 0.00 0.00 33.84 30.96 3hfz n VAL 245 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 3hfz h VAL 246 N 0.00 0.81 0.11 2.52 2.07 -1.78 -2.79 116.25 117.19 3hfz h VAL 246 Ca 0.18 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.69 3hfz h VAL 246 Cb 0.34 0.81 -0.00 0.00 -1.52 0.00 0.00 31.29 30.91 3hfz h VAL 246 CO -0.62 0.00 -0.07 0.44 0.02 0.00 0.00 177.57 177.35 3hfz h ASP 247 N -0.01 -0.17 -0.06 0.57 3.32 0.97 -2.44 116.42 118.60 3hfz h ASP 247 Ca 0.09 0.01 0.02 0.00 0.02 0.00 0.00 57.03 57.17 3hfz h ASP 247 Cb 0.14 0.05 -0.00 0.00 0.22 0.00 0.00 39.33 39.74 3hfz h ASP 247 CO -0.19 -0.11 0.53 0.58 -1.72 0.00 0.00 179.24 178.33 3hfz h VAL 248 N -0.17 0.03 0.00 -1.35 2.07 -0.95 0.39 116.25 116.27 3hfz h VAL 248 Ca -0.01 0.00 -0.29 0.00 0.82 0.00 0.00 66.70 67.23 3hfz h VAL 248 Cb 0.14 0.49 -0.05 0.00 -1.52 0.00 0.00 31.29 30.35 3hfz h VAL 248 CO 0.01 0.00 -1.72 0.35 0.02 0.00 0.00 177.57 176.23 3hfz n THR 249 N -2.87 1.57 -0.01 2.57 -2.24 -0.93 -3.11 114.28 109.25 3hfz n THR 249 Ca -0.00 -0.79 -0.13 0.00 -2.27 0.00 0.00 64.05 60.86 3hfz n THR 249 Cb 0.58 -0.99 -0.10 0.00 -2.10 0.00 0.00 70.33 67.72 3hfz n THR 249 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 3hfz h ASN 250 N 0.00 -0.04 -0.17 3.42 2.35 -0.21 -2.73 115.58 118.20 3hfz h ASN 250 Ca -0.29 -0.57 0.05 0.00 -0.55 0.00 0.00 56.30 54.94 3hfz h ASN 250 Cb 1.99 0.01 -0.07 0.00 0.05 0.00 0.00 38.32 40.30 3hfz h ASN 250 CO 0.07 0.57 -0.42 0.22 -1.65 0.00 0.00 177.43 176.22 3hfz h TYR 251 N -0.67 -1.22 0.00 1.19 3.20 -1.18 0.93 116.97 119.22 3hfz h TYR 251 Ca -0.00 0.05 -0.00 0.00 3.14 0.00 0.00 58.73 61.92 3hfz h TYR 251 Cb 0.60 0.56 -0.00 0.00 1.54 0.00 0.00 36.73 39.43 3hfz h TYR 251 CO 0.13 -0.47 -0.00 0.28 -1.64 0.00 0.00 178.16 176.46 3hfz h VAL 252 N -0.47 0.63 0.69 1.81 2.07 -1.64 0.66 116.25 120.00 3hfz h VAL 252 Ca 0.08 -0.01 -0.03 0.00 0.82 0.00 0.00 66.70 67.55 3hfz h VAL 252 Cb 0.62 1.01 0.01 0.00 -1.52 0.00 0.00 31.29 31.41 3hfz h VAL 252 CO -0.42 0.00 -0.33 -0.03 0.02 0.00 0.00 177.57 176.81 3hfz h MET 253 N 0.00 -0.90 -0.93 1.57 1.85 -0.56 -1.40 114.93 114.56 3hfz h MET 253 Ca -0.00 0.06 0.05 0.00 -0.61 0.00 0.00 59.70 59.20 3hfz h MET 253 Cb 0.01 0.20 -0.06 0.00 0.43 0.00 0.00 31.60 32.18 3hfz h MET 253 CO 0.00 -0.60 0.60 -0.07 -0.40 0.00 0.00 176.91 176.44 3hfz h LEU 254 N -1.13 0.97 -1.78 3.39 3.38 -0.44 0.38 115.31 120.08 3hfz h LEU 254 Ca -0.10 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 3hfz h LEU 254 Cb 0.71 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 3hfz h LEU 254 CO 0.16 0.64 0.05 -0.08 0.09 0.00 0.00 178.44 179.29 3hfz h GLU 255 N 1.12 0.18 0.00 1.13 4.81 0.42 0.11 114.58 122.36 3hfz h GLU 255 Ca 0.39 -0.02 -0.15 0.00 -0.13 0.00 0.00 59.36 59.46 3hfz h GLU 255 Cb 0.10 -0.04 -0.29 0.00 0.63 0.00 0.00 28.75 29.15 3hfz h GLU 255 CO -0.15 0.16 -0.82 2.89 -0.73 0.00 0.00 179.01 180.36 3hfz n ARG 256 N -4.47 0.00 -3.79 1.92 1.85 -0.54 -1.90 116.66 109.73 3hfz n ARG 256 Ca -0.01 -1.66 -0.34 0.00 -1.00 0.00 0.00 57.85 54.84 3hfz n ARG 256 Cb 0.11 0.05 0.03 0.00 -1.05 0.00 0.00 32.46 31.61 3hfz n ARG 256 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 3hfz n ALA 257 N 0.34 -2.51 -3.30 2.89 0.00 0.13 -4.79 120.51 113.26 3hfz n ALA 257 Ca -0.01 -0.31 -0.11 0.00 0.00 0.00 0.00 53.44 53.01 3hfz n ALA 257 Cb 1.00 -3.59 -0.05 0.00 0.00 0.00 0.00 19.45 16.81 3hfz n ALA 257 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 3hfz s GLN 258 N -6.33 0.72 0.47 0.00 2.00 -1.14 -4.49 119.66 110.90 3hfz s GLN 258 Ca 0.43 -0.69 -0.24 0.00 -2.00 0.00 0.00 55.36 52.86 3hfz s GLN 258 Cb -0.17 -0.45 -0.07 0.00 0.80 0.00 0.00 33.01 33.12 3hfz s GLN 258 CO 0.89 -1.20 1.37 -2.14 -0.50 0.00 0.00 175.29 173.71 3hfz s PRO 259 N 1.53 3.57 -0.20 1.67 0.02 -1.26 -4.02 135.00 136.30 3hfz s PRO 259 Ca 0.17 2.28 -0.14 0.00 0.02 0.00 0.00 61.00 63.33 3hfz s PRO 259 Cb -0.11 -2.54 0.06 0.00 0.02 0.00 0.00 34.50 31.93 3hfz s PRO 259 CO -0.04 -0.86 0.51 0.00 -0.33 0.00 0.00 177.00 176.28 3hfz s MET 260 N -2.57 0.55 -0.06 5.54 0.23 -1.26 -4.46 119.30 117.27 3hfz s MET 260 Ca 0.64 0.86 0.03 0.00 -1.03 0.00 0.00 55.69 56.19 3hfz s MET 260 Cb -0.41 0.14 -0.02 0.00 -1.53 0.00 0.00 34.83 33.01 3hfz s MET 260 CO 0.51 -0.12 -0.16 -1.58 -2.03 0.00 0.00 175.02 171.64 3hfz s HIS 261 N 1.00 2.67 -0.36 3.16 2.46 -1.06 -4.73 115.29 118.42 3hfz s HIS 261 Ca -0.06 -0.33 -0.12 0.00 0.47 0.00 0.00 55.06 55.02 3hfz s HIS 261 Cb -0.06 -1.66 0.01 0.00 -0.13 0.00 0.00 32.58 30.74 3hfz s HIS 261 CO -0.09 0.05 0.23 0.00 -2.47 0.00 0.00 174.74 172.46 3hfz s ALA 262 N -0.45 3.40 -0.17 1.58 0.00 -1.26 -0.35 121.76 124.50 3hfz s ALA 262 Ca 0.05 -1.55 -0.16 0.00 0.00 0.00 0.00 51.96 50.30 3hfz s ALA 262 Cb -0.12 -2.65 -0.04 0.00 0.00 0.00 0.00 23.12 20.31 3hfz s ALA 262 CO 0.02 -1.18 0.41 -0.06 0.00 0.00 0.00 175.76 174.95 3hfz s PHE 263 N 1.65 3.43 0.08 0.00 0.08 -0.08 -4.02 117.98 119.12 3hfz s PHE 263 Ca 0.05 0.70 -0.31 0.00 0.12 0.00 0.00 56.93 57.49 3hfz s PHE 263 Cb -0.18 -2.51 -0.08 0.00 -0.57 0.00 0.00 43.02 39.69 3hfz s PHE 263 CO 0.09 0.08 1.46 0.34 -0.10 0.00 0.00 175.22 177.09 3hfz s ASP 264 N 0.82 6.76 0.37 1.36 -1.08 0.15 -0.39 116.67 124.65 3hfz s ASP 264 Ca 0.21 2.33 0.06 0.00 -0.52 0.00 0.00 52.55 54.63 3hfz s ASP 264 Cb -0.14 -2.58 0.74 0.00 -1.46 0.00 0.00 42.92 39.48 3hfz s ASP 264 CO 0.08 -0.73 1.98 -0.07 0.52 0.00 0.00 175.17 176.95 3hfz h LEU 265 N 7.50 0.65 -1.80 -1.34 3.38 -1.81 -2.72 115.31 119.17 3hfz h LEU 265 Ca -0.41 -0.00 0.54 0.00 0.09 0.00 0.00 57.88 58.09 3hfz h LEU 265 Cb 1.20 -0.14 -0.09 0.00 0.09 0.00 0.00 40.66 41.72 3hfz h LEU 265 CO 0.89 0.44 1.27 0.54 0.09 0.00 0.00 178.44 181.67 3hfz n ARG 266 N -4.47 -0.01 -0.06 1.13 1.74 -1.26 0.15 116.66 113.88 3hfz n ARG 266 Ca 0.09 1.08 0.06 0.00 -0.77 0.00 0.00 57.85 58.31 3hfz n ARG 266 Cb 0.18 -2.41 0.08 0.00 -1.02 0.00 0.00 32.46 29.29 3hfz n ARG 266 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 3hfz n PHE 267 N -4.02 0.16 0.01 -1.55 3.72 -1.03 -4.59 117.46 110.17 3hfz n PHE 267 Ca 0.42 -0.17 -0.18 0.00 -0.05 0.00 0.00 57.45 57.47 3hfz n PHE 267 Cb 1.87 -0.01 -0.11 0.00 -0.94 0.00 0.00 39.48 40.29 3hfz n PHE 267 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 3hfz h VAL 268 N 2.17 1.40 0.00 -4.37 2.07 0.14 -3.45 116.25 114.21 3hfz h VAL 268 Ca 0.00 -2.13 0.00 0.00 0.82 0.00 0.00 66.70 65.39 3hfz h VAL 268 Cb 0.56 2.56 0.00 0.00 -1.52 0.00 0.00 31.29 32.89 3hfz h VAL 268 CO 0.00 0.63 0.00 0.61 0.02 0.00 0.00 177.57 178.83 3hfz n GLY 269 N 1.09 0.53 0.12 2.17 0.00 -1.23 -2.96 105.19 104.91 3hfz n GLY 269 Ca -0.11 -1.08 -0.01 0.00 0.00 0.00 0.00 46.02 44.83 3hfz n GLY 269 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3hfz h GLU 270 N 0.00 0.00 -2.02 1.61 5.08 -1.45 -3.46 114.58 114.34 3hfz h GLU 270 Ca 0.00 0.00 0.27 0.00 -1.00 0.00 0.00 59.36 58.63 3hfz h GLU 270 Cb 0.00 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.17 3hfz h GLU 270 CO 0.00 0.66 0.73 0.20 -1.00 0.00 0.00 179.01 179.61 3hfz s GLY 271 N -4.54 -0.19 -0.12 -3.84 0.00 -1.24 -1.94 107.32 95.45 3hfz s GLY 271 Ca 0.02 0.19 -0.05 0.00 0.00 0.00 0.00 44.72 44.89 3hfz s GLY 271 CO 0.77 2.01 0.06 -0.42 0.00 0.00 0.00 173.10 175.51 3hfz s ILE 272 N -2.41 4.77 -0.09 0.90 -1.09 0.13 -2.61 121.20 120.80 3hfz s ILE 272 Ca 0.19 -0.06 0.00 0.00 -2.23 0.00 0.00 60.65 58.56 3hfz s ILE 272 Cb 0.01 -3.07 0.02 0.00 -1.58 0.00 0.00 42.46 37.84 3hfz s ILE 272 CO 0.00 0.57 -0.08 0.00 -1.23 0.00 0.00 174.94 174.20 3hfz s ALA 273 N -0.58 1.24 -0.33 9.38 0.00 0.71 -1.11 121.76 131.07 3hfz s ALA 273 Ca 0.11 -0.46 -0.14 0.00 0.00 0.00 0.00 51.96 51.47 3hfz s ALA 273 Cb -0.12 -0.78 -0.02 0.00 0.00 0.00 0.00 23.12 22.20 3hfz s ALA 273 CO 0.02 -0.25 0.31 0.08 0.00 0.00 0.00 175.76 175.93 3hfz s VAL 274 N 1.38 5.21 0.11 0.00 1.01 -0.21 0.53 120.40 128.44 3hfz s VAL 274 Ca -0.01 0.06 -0.25 0.00 0.00 0.00 0.00 61.98 61.78 3hfz s VAL 274 Cb -0.14 -3.75 0.08 0.00 0.00 0.00 0.00 36.38 32.57 3hfz s VAL 274 CO -0.04 -0.00 0.65 0.00 0.00 0.00 0.00 175.10 175.71 3hfz s ARG 275 N 1.92 1.19 0.74 2.72 1.70 -0.78 -0.19 118.95 126.24 3hfz s ARG 275 Ca 0.10 -0.37 -0.15 0.00 -0.47 0.00 0.00 55.73 54.84 3hfz s ARG 275 Cb -0.17 0.55 0.04 0.00 -0.57 0.00 0.00 34.95 34.80 3hfz s ARG 275 CO 0.11 -0.50 1.21 0.54 -1.08 0.00 0.00 175.30 175.58 3hfz n ARG 276 N -0.22 0.57 -2.93 3.89 3.00 -1.26 -0.78 116.66 118.93 3hfz n ARG 276 Ca -0.16 0.26 -0.40 0.00 -0.01 0.00 0.00 57.85 57.55 3hfz n ARG 276 Cb 0.64 -2.45 -0.06 0.00 0.00 0.00 0.00 32.46 30.59 3hfz n ARG 276 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 3hfz s ALA 277 N -1.81 3.41 0.18 7.54 0.00 -1.17 -4.74 121.76 125.18 3hfz s ALA 277 Ca 0.77 0.41 -0.30 0.00 0.00 0.00 0.00 51.96 52.84 3hfz s ALA 277 Cb -0.33 -3.02 -0.08 0.00 0.00 0.00 0.00 23.12 19.69 3hfz s ALA 277 CO 0.47 0.24 1.02 1.03 0.00 0.00 0.00 175.76 178.52 3hfz s ARG 278 N -0.97 4.69 -0.28 0.00 1.81 -1.26 -3.54 118.95 119.41 3hfz s ARG 278 Ca 0.38 1.60 -0.36 0.00 -1.72 0.00 0.00 55.73 55.62 3hfz s ARG 278 Cb -0.23 -3.30 -0.16 0.00 -0.45 0.00 0.00 34.95 30.81 3hfz s ARG 278 CO 0.27 0.23 1.15 0.39 -0.68 0.00 0.00 175.30 176.66 3hfz n GLU 279 N 2.16 0.00 0.00 3.54 1.02 -1.26 0.03 120.64 126.13 3hfz n GLU 279 Ca 0.01 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 3hfz n GLU 279 Cb 0.47 -1.20 0.00 0.00 -0.02 0.00 0.00 31.44 30.69 3hfz n GLU 279 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3hfz n GLY 280 N 2.58 2.99 3.50 0.62 0.00 -1.25 -4.98 105.19 108.64 3hfz n GLY 280 Ca 0.22 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.78 3hfz n GLY 280 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3hfz n GLU 281 N -2.00 0.73 -3.99 1.61 1.02 0.10 -4.54 120.64 113.58 3hfz n GLU 281 Ca 0.00 0.26 -0.21 0.00 -0.02 0.00 0.00 57.16 57.18 3hfz n GLU 281 Cb 0.00 -1.47 -0.04 0.00 -0.02 0.00 0.00 31.44 29.92 3hfz n GLU 281 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 3hfz s ARG 282 N -1.33 2.94 -0.27 3.49 0.52 -1.26 -0.30 118.95 122.74 3hfz s ARG 282 Ca 0.61 -1.08 -0.25 0.00 -0.52 0.00 0.00 55.73 54.49 3hfz s ARG 282 Cb -0.79 -2.59 0.07 0.00 0.52 0.00 0.00 34.95 32.16 3hfz s ARG 282 CO 0.58 0.31 0.72 -1.17 0.02 0.00 0.00 175.30 175.76 3hfz s LEU 283 N -3.92 -0.76 -0.59 2.53 0.20 -0.97 -4.69 118.68 110.49 3hfz s LEU 283 Ca 0.36 1.45 -0.07 0.00 0.69 0.00 0.00 54.13 56.55 3hfz s LEU 283 Cb -0.08 2.47 0.15 0.00 -0.43 0.00 0.00 46.19 48.30 3hfz s LEU 283 CO 0.26 -0.25 0.45 -0.75 -0.29 0.00 0.00 176.35 175.77 3hfz s LYS 284 N 0.42 2.69 0.77 1.98 2.20 -1.26 -0.63 119.74 125.90 3hfz s LYS 284 Ca -0.00 -2.18 -0.13 0.00 -0.36 0.00 0.00 55.97 53.30 3hfz s LYS 284 Cb -0.05 -3.93 0.06 0.00 -1.51 0.00 0.00 37.83 32.40 3hfz s LYS 284 CO 0.00 -1.20 1.17 0.95 -0.36 0.00 0.00 175.35 175.91 3hfz s THR 285 N 0.61 2.51 0.53 3.43 -4.23 -0.59 -0.09 115.64 117.80 3hfz s THR 285 Ca 0.12 0.22 0.37 0.00 -1.18 0.00 0.00 61.69 61.23 3hfz s THR 285 Cb -0.21 -2.65 0.57 0.00 1.34 0.00 0.00 72.50 71.55 3hfz s THR 285 CO -0.04 -0.17 1.74 -0.07 -0.54 0.00 0.00 174.62 175.55 3hfz h LEU 286 N -0.69 0.06 0.00 4.79 3.38 -1.54 0.36 115.31 121.66 3hfz h LEU 286 Ca -0.46 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.53 3hfz h LEU 286 Cb 1.27 0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.03 3hfz h LEU 286 CO 0.49 -0.00 0.00 -0.90 0.09 0.00 0.00 178.44 178.11 3hfz n ASP 287 N -4.21 0.00 -0.22 -0.43 5.68 -1.26 -4.77 116.55 111.34 3hfz n ASP 287 Ca 0.30 -1.27 -0.03 0.00 -0.50 0.00 0.00 54.79 53.29 3hfz n ASP 287 Cb 1.38 0.00 -0.01 0.00 -1.14 0.00 0.00 41.12 41.35 3hfz n ASP 287 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3hfz n GLY 288 N 0.15 0.52 3.75 6.12 0.00 0.13 -4.99 105.19 110.87 3hfz n GLY 288 Ca 0.01 -0.17 -0.37 0.00 0.00 0.00 0.00 46.02 45.49 3hfz n GLY 288 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hfz s VAL 289 N -1.77 5.24 -0.29 1.61 1.01 -1.18 -4.91 120.40 120.10 3hfz s VAL 289 Ca 0.00 0.68 -0.22 0.00 0.00 0.00 0.00 61.98 62.44 3hfz s VAL 289 Cb 0.00 -3.68 -0.01 0.00 0.00 0.00 0.00 36.38 32.69 3hfz s VAL 289 CO 0.00 0.41 0.72 -0.70 0.00 0.00 0.00 175.10 175.54 3hfz s GLU 290 N 0.19 3.98 0.39 2.72 2.56 -1.26 -1.55 118.70 125.73 3hfz s GLU 290 Ca 0.20 0.52 0.08 0.00 0.00 0.00 0.00 54.97 55.77 3hfz s GLU 290 Cb -0.14 -3.71 -0.06 0.00 2.00 0.00 0.00 34.13 32.22 3hfz s GLU 290 CO 0.07 -0.60 0.10 1.03 -0.56 0.00 0.00 175.26 175.30 3hfz s ARG 291 N 2.79 2.13 -0.37 4.30 0.52 0.20 -5.00 118.95 123.51 3hfz s ARG 291 Ca 0.30 -1.88 0.02 0.00 -0.52 0.00 0.00 55.73 53.65 3hfz s ARG 291 Cb -0.15 -1.90 0.11 0.00 0.52 0.00 0.00 34.95 33.54 3hfz s ARG 291 CO 0.11 -0.04 0.14 0.99 0.02 0.00 0.00 175.30 176.52 3hfz s THR 292 N -2.60 1.58 1.00 0.02 2.01 -1.26 -2.29 115.64 114.08 3hfz s THR 292 Ca 0.38 -2.16 -0.17 0.00 0.31 0.00 0.00 61.69 60.05 3hfz s THR 292 Cb 0.04 -2.15 0.05 0.00 0.01 0.00 0.00 72.50 70.45 3hfz s THR 292 CO 0.21 -0.72 -0.25 0.18 -0.69 0.00 0.00 174.62 173.34 3hfz n LEU 293 N 4.17 -2.13 -4.10 4.42 4.77 0.59 -4.86 117.00 119.86 3hfz n LEU 293 Ca 0.03 -0.18 -0.15 0.00 -0.03 0.00 0.00 56.01 55.68 3hfz n LEU 293 Cb 0.39 -0.74 -0.12 0.00 -2.33 0.00 0.00 43.42 40.62 3hfz n LEU 293 CO 0.20 -2.90 -0.42 -2.28 -1.33 0.00 0.00 177.39 170.66 3hfz s HIS 294 N -2.10 0.86 0.56 -1.77 5.65 -1.26 -3.85 115.29 113.38 3hfz s HIS 294 Ca 0.39 -0.48 0.34 0.00 0.25 0.00 0.00 55.06 55.56 3hfz s HIS 294 Cb -0.03 -0.50 1.47 0.00 -1.18 0.00 0.00 32.58 32.34 3hfz s HIS 294 CO 0.49 -0.03 1.76 -1.00 -0.65 0.00 0.00 174.74 175.30 3hfz h PRO 295 N 4.45 0.00 0.00 2.88 0.13 -1.86 -0.57 132.00 137.03 3hfz h PRO 295 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 3hfz h PRO 295 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 3hfz h PRO 295 CO 0.41 0.00 -0.48 0.39 -0.23 0.00 0.00 178.00 178.08 3hfz n GLU 296 N -3.95 0.18 -2.23 0.86 1.02 -1.26 -3.78 120.64 111.48 3hfz n GLU 296 Ca 0.22 0.07 -0.32 0.00 -0.02 0.00 0.00 57.16 57.10 3hfz n GLU 296 Cb 1.18 -1.63 -0.04 0.00 -0.02 0.00 0.00 31.44 30.92 3hfz n GLU 296 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3hfz s ASP 297 N -3.80 5.62 0.15 1.62 1.01 -0.22 -4.86 116.67 116.18 3hfz s ASP 297 Ca 0.09 -1.25 -0.32 0.00 0.71 0.00 0.00 52.55 51.78 3hfz s ASP 297 Cb 0.15 -2.57 -0.17 0.00 1.01 0.00 0.00 42.92 41.34 3hfz s ASP 297 CO 0.69 -2.36 0.84 -0.11 0.21 0.00 0.00 175.17 174.44 3hfz n LEU 298 N 12.28 -0.08 -4.27 1.23 -0.00 -1.26 -3.02 117.00 121.87 3hfz n LEU 298 Ca 0.40 1.14 -0.15 0.00 -0.00 0.00 0.00 56.01 57.41 3hfz n LEU 298 Cb 0.48 -1.03 -0.10 0.00 -0.00 0.00 0.00 43.42 42.77 3hfz n LEU 298 CO 0.65 -2.22 -0.37 -0.69 -0.00 0.00 0.00 177.39 174.76 3hfz s VAL 299 N -0.58 1.02 -0.30 1.96 1.01 0.04 -2.68 120.40 120.88 3hfz s VAL 299 Ca 0.72 -2.03 -0.05 0.00 0.00 0.00 0.00 61.98 60.62 3hfz s VAL 299 Cb -0.98 -2.03 0.02 0.00 0.00 0.00 0.00 36.38 33.39 3hfz s VAL 299 CO 0.56 -0.59 0.05 -0.63 0.00 0.00 0.00 175.10 174.49 3hfz s ILE 300 N -3.42 3.64 0.08 2.22 -1.09 -0.22 -1.87 121.20 120.53 3hfz s ILE 300 Ca 0.21 -0.90 0.08 0.00 -2.23 0.00 0.00 60.65 57.81 3hfz s ILE 300 Cb 0.04 -2.93 -0.03 0.00 -1.58 0.00 0.00 42.46 37.96 3hfz s ILE 300 CO 0.03 0.03 -0.22 0.00 -1.23 0.00 0.00 174.94 173.56 3hfz s ALA 301 N 1.43 1.88 0.14 9.38 0.00 0.19 0.19 121.76 134.96 3hfz s ALA 301 Ca 0.01 -1.19 0.05 0.00 0.00 0.00 0.00 51.96 50.83 3hfz s ALA 301 Cb -0.18 -0.32 -0.04 0.00 0.00 0.00 0.00 23.12 22.58 3hfz s ALA 301 CO 0.01 0.41 0.06 0.20 0.00 0.00 0.00 175.76 176.44 3hfz s GLY 302 N -1.55 1.81 -0.03 0.00 0.00 0.22 0.25 107.32 108.03 3hfz s GLY 302 Ca 0.08 -1.21 0.02 0.00 0.00 0.00 0.00 44.72 43.61 3hfz s GLY 302 CO 0.03 -1.21 -0.07 0.66 0.00 0.00 0.00 173.10 172.52 3hfz s TRP 303 N -1.59 0.80 -0.21 1.90 -2.14 -1.07 -0.64 118.94 115.98 3hfz s TRP 303 Ca 0.28 -0.20 0.01 0.00 2.66 0.00 0.00 56.10 58.86 3hfz s TRP 303 Cb -0.11 -0.61 0.04 0.00 -3.10 0.00 0.00 33.47 29.70 3hfz s TRP 303 CO 0.21 -0.12 -0.12 0.50 -2.66 0.00 0.00 176.95 174.77 3hfz s ARG 304 N 0.38 2.20 6.25 3.25 3.52 -0.46 -1.05 118.95 133.04 3hfz s ARG 304 Ca -0.05 -0.96 0.00 0.00 -0.13 0.00 0.00 55.73 54.59 3hfz s ARG 304 Cb -0.10 -2.55 0.00 0.00 -1.56 0.00 0.00 34.95 30.74 3hfz s ARG 304 CO 0.00 -0.44 0.00 0.41 -0.81 0.00 0.00 175.30 174.47 3hfz n GLY 305 N 4.62 1.73 0.76 8.12 0.00 -1.26 -1.90 105.19 117.26 3hfz n GLY 305 Ca -0.15 -0.04 0.03 0.00 0.00 0.00 0.00 46.02 45.85 3hfz n GLY 305 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3hfz n GLU 306 N 1.63 1.73 -5.05 1.61 -0.58 -1.26 -5.00 120.64 113.72 3hfz n GLU 306 Ca 0.00 -3.35 -0.32 0.00 -0.42 0.00 0.00 57.16 53.07 3hfz n GLU 306 Cb 0.00 -1.63 -0.15 0.00 -0.57 0.00 0.00 31.44 29.09 3hfz n GLU 306 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 3hfz s GLU 307 N -3.18 2.61 -0.16 3.49 2.02 -0.80 -5.11 118.70 117.58 3hfz s GLU 307 Ca 0.39 -0.79 0.00 0.00 0.02 0.00 0.00 54.97 54.59 3hfz s GLU 307 Cb 0.37 -2.31 0.03 0.00 0.10 0.00 0.00 34.13 32.32 3hfz s GLU 307 CO -0.06 0.47 -0.14 0.45 0.02 0.00 0.00 175.26 176.00 3hfz s SER 308 N -0.35 2.84 0.04 -0.19 0.15 -1.26 -1.36 113.70 113.57 3hfz s SER 308 Ca 0.03 -0.56 0.06 0.00 0.70 0.00 0.00 55.95 56.18 3hfz s SER 308 Cb -0.12 -1.22 -0.02 0.00 -1.71 0.00 0.00 66.02 62.95 3hfz s SER 308 CO 0.02 -0.06 -0.18 0.72 1.20 0.00 0.00 173.24 174.93 3hfz s PHE 309 N 1.45 1.60 -0.01 3.44 -0.71 0.18 -4.99 117.98 118.95 3hfz s PHE 309 Ca 0.04 -0.37 -0.30 0.00 -1.04 0.00 0.00 56.93 55.26 3hfz s PHE 309 Cb -0.13 -0.95 -0.06 0.00 -1.21 0.00 0.00 43.02 40.66 3hfz s PHE 309 CO -0.11 0.07 1.65 -2.14 -1.34 0.00 0.00 175.22 173.36 3hfz s PRO 310 N -1.17 4.19 -0.03 1.99 0.02 -1.26 -0.61 135.00 138.13 3hfz s PRO 310 Ca 0.05 2.23 0.19 0.00 0.02 0.00 0.00 61.00 63.50 3hfz s PRO 310 Cb -0.08 -3.86 -0.23 0.00 0.02 0.00 0.00 34.50 30.35 3hfz s PRO 310 CO 0.02 -0.80 0.51 1.28 -0.33 0.00 0.00 177.00 177.67 3hfz n LEU 311 N 6.60 0.32 0.00 -5.54 4.77 0.49 -4.87 117.00 118.77 3hfz n LEU 311 Ca 0.17 0.14 0.00 0.00 -0.03 0.00 0.00 56.01 56.28 3hfz n LEU 311 Cb 0.42 0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.67 3hfz n LEU 311 CO 0.63 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 177.47 3hfz n GLY 312 N 1.43 1.43 3.63 -0.72 0.00 -0.86 -0.68 105.19 109.42 3hfz n GLY 312 Ca -0.14 -0.51 -0.43 0.00 0.00 0.00 0.00 46.02 44.94 3hfz n GLY 312 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3hfz s LEU 313 N 0.00 3.85 0.02 0.99 0.20 0.11 -1.05 118.68 122.80 3hfz s LEU 313 Ca 0.00 1.29 -0.36 0.00 0.69 0.00 0.00 54.13 55.75 3hfz s LEU 313 Cb 0.00 -3.54 -0.15 0.00 -0.43 0.00 0.00 46.19 42.07 3hfz s LEU 313 CO 0.00 -1.17 1.56 0.00 -0.29 0.00 0.00 176.35 176.45 3hfz n ALA 314 N 8.01 0.14 -3.85 5.97 0.00 -1.09 -2.01 120.51 127.68 3hfz n ALA 314 Ca 0.16 0.44 -0.25 0.00 0.00 0.00 0.00 53.44 53.79 3hfz n ALA 314 Cb 0.46 -2.25 0.01 0.00 0.00 0.00 0.00 19.45 17.68 3hfz n ALA 314 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hfz n GLY 315 N 3.37 -0.33 1.88 0.00 0.00 -1.26 -4.68 105.19 104.16 3hfz n GLY 315 Ca 0.20 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.37 3hfz n GLY 315 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3hfz n VAL 316 N -4.41 0.00 -3.62 1.61 0.31 -1.17 -3.52 118.33 107.53 3hfz n VAL 316 Ca -0.20 0.00 -0.08 0.00 -0.01 0.00 0.00 64.34 64.05 3hfz n VAL 316 Cb 0.63 0.00 -0.06 0.00 -0.91 0.00 0.00 33.84 33.50 3hfz n VAL 316 CO 0.00 0.00 0.00 -0.32 -1.32 0.00 0.00 176.83 175.19 3hfz s MET 317 N -1.97 0.43 0.67 5.55 0.00 -0.85 -4.45 119.30 118.68 3hfz s MET 317 Ca 0.00 0.32 -0.01 0.00 0.00 0.00 0.00 55.69 56.00 3hfz s MET 317 Cb 0.00 0.21 0.09 0.00 0.00 0.00 0.00 34.83 35.13 3hfz s MET 317 CO 0.00 -0.09 0.93 0.20 0.00 0.00 0.00 175.02 176.05 3hfz s GLY 318 N -0.37 1.78 0.27 2.11 0.00 -1.26 0.05 107.32 109.90 3hfz s GLY 318 Ca 0.03 -1.51 -0.22 0.00 0.00 0.00 0.00 44.72 43.01 3hfz s GLY 318 CO -0.05 -1.05 0.83 -0.32 0.00 0.00 0.00 173.10 172.51 3hfz s GLY 319 N -4.61 2.68 0.56 0.20 0.00 0.14 -1.60 107.32 104.69 3hfz s GLY 319 Ca 0.63 0.33 0.36 0.00 0.00 0.00 0.00 44.72 46.04 3hfz s GLY 319 CO 0.42 0.71 2.09 0.00 0.00 0.00 0.00 173.10 176.33 3hfz h ALA 320 N 3.24 1.00 0.12 3.20 0.00 -0.67 -3.08 119.26 123.08 3hfz h ALA 320 Ca -0.47 0.00 -0.36 0.00 0.00 0.00 0.00 54.91 54.08 3hfz h ALA 320 Cb 1.19 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.97 3hfz h ALA 320 CO 0.65 0.00 -1.93 1.49 0.00 0.00 0.00 179.25 179.46 3hfz h GLU 321 N 0.00 0.26 0.00 0.00 4.81 -1.89 -3.35 114.58 114.41 3hfz h GLU 321 Ca 0.00 -0.45 0.00 0.00 -0.13 0.00 0.00 59.36 58.78 3hfz h GLU 321 Cb 0.29 0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.83 3hfz h GLU 321 CO 0.00 1.21 0.00 0.66 -0.73 0.00 0.00 179.01 180.15 3hfz h SER 322 N 0.01 0.00 -1.09 1.04 4.64 -1.82 -3.46 113.55 112.86 3hfz h SER 322 Ca -0.41 0.00 -0.81 0.00 -0.47 0.00 0.00 61.79 60.10 3hfz h SER 322 Cb 2.00 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 64.12 3hfz h SER 322 CO 0.08 0.00 0.34 1.21 -0.87 0.00 0.00 176.83 177.59 3hfz n GLU 323 N -2.93 0.17 -1.98 4.77 0.00 -1.17 -0.68 120.64 118.83 3hfz n GLU 323 Ca 0.02 0.06 -0.40 0.00 0.00 0.00 0.00 57.16 56.84 3hfz n GLU 323 Cb 0.35 -1.59 -0.00 0.00 0.00 0.00 0.00 31.44 30.20 3hfz n GLU 323 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 3hfz s VAL 324 N 1.19 2.46 0.00 6.31 1.01 -1.26 -4.79 120.40 125.33 3hfz s VAL 324 Ca 0.95 0.42 0.00 0.00 0.00 0.00 0.00 61.98 63.36 3hfz s VAL 324 Cb -1.30 -3.25 0.00 0.00 0.00 0.00 0.00 36.38 31.83 3hfz s VAL 324 CO 0.64 0.07 0.00 0.54 0.00 0.00 0.00 175.10 176.35 3hfz n ARG 325 N 0.14 0.00 -0.13 2.72 1.74 -1.26 -4.94 116.66 114.93 3hfz n ARG 325 Ca 0.03 0.00 -0.05 0.00 -0.77 0.00 0.00 57.85 57.06 3hfz n ARG 325 Cb 0.43 0.00 0.01 0.00 -1.02 0.00 0.00 32.46 31.88 3hfz n ARG 325 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 3hfz h GLU 326 N 0.00 -0.14 0.00 5.56 3.07 -1.95 -2.81 114.58 118.31 3hfz h GLU 326 Ca 0.00 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 3hfz h GLU 326 Cb 0.00 0.03 0.00 0.00 -0.84 0.00 0.00 28.75 27.94 3hfz h GLU 326 CO 0.00 -0.10 0.00 -0.25 -1.40 0.00 0.00 179.01 177.26 3hfz n ASP 327 N -5.40 0.00 -4.67 1.42 8.00 -1.26 -4.39 116.55 110.25 3hfz n ASP 327 Ca 0.03 -0.17 -0.38 0.00 0.71 0.00 0.00 54.79 54.97 3hfz n ASP 327 Cb 0.31 -0.27 0.05 0.00 -0.02 0.00 0.00 41.12 41.19 3hfz n ASP 327 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 3hfz n THR 328 N -1.27 3.97 -0.02 -3.53 -1.04 -1.06 -4.92 114.28 106.41 3hfz n THR 328 Ca 0.14 -0.50 0.00 0.00 -2.04 0.00 0.00 64.05 61.65 3hfz n THR 328 Cb 0.23 -1.35 0.00 0.00 -1.82 0.00 0.00 70.33 67.39 3hfz n THR 328 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3hfz n GLU 329 N -1.16 1.58 -3.47 -2.82 1.02 -1.26 -4.58 120.64 109.96 3hfz n GLU 329 Ca 0.13 -0.00 -0.15 0.00 -0.02 0.00 0.00 57.16 57.12 3hfz n GLU 329 Cb 0.46 -0.13 -0.04 0.00 -0.02 0.00 0.00 31.44 31.72 3hfz n GLU 329 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3hfz s ALA 330 N -0.23 -1.66 0.20 0.62 0.00 -1.26 0.12 121.76 119.55 3hfz s ALA 330 Ca 0.00 0.83 -0.08 0.00 0.00 0.00 0.00 51.96 52.71 3hfz s ALA 330 Cb 0.00 0.51 -0.02 0.00 0.00 0.00 0.00 23.12 23.61 3hfz s ALA 330 CO 0.00 -0.60 0.30 0.96 0.00 0.00 0.00 175.76 176.42 3hfz s ILE 331 N -2.66 0.03 -0.17 0.00 -4.36 -0.38 -2.56 121.20 111.10 3hfz s ILE 331 Ca -0.04 -1.56 0.02 0.00 -0.26 0.00 0.00 60.65 58.80 3hfz s ILE 331 Cb -0.01 -2.12 0.02 0.00 1.25 0.00 0.00 42.46 41.60 3hfz s ILE 331 CO -0.03 -0.14 -0.21 0.00 0.24 0.00 0.00 174.94 174.80 3hfz s ALA 332 N -4.03 2.30 -0.37 2.27 0.00 0.47 -3.35 121.76 119.05 3hfz s ALA 332 Ca 0.24 -1.17 -0.15 0.00 0.00 0.00 0.00 51.96 50.88 3hfz s ALA 332 Cb 0.03 -1.11 -0.00 0.00 0.00 0.00 0.00 23.12 22.04 3hfz s ALA 332 CO 0.06 -0.23 0.35 -1.17 0.00 0.00 0.00 175.76 174.76 3hfz s LEU 333 N 1.11 4.65 -0.02 0.00 0.20 -0.47 -0.90 118.68 123.25 3hfz s LEU 333 Ca 0.01 -0.46 -0.30 0.00 0.69 0.00 0.00 54.13 54.06 3hfz s LEU 333 Cb -0.14 -2.28 -0.03 0.00 -0.43 0.00 0.00 46.19 43.31 3hfz s LEU 333 CO -0.09 -0.39 1.03 -0.70 -0.29 0.00 0.00 176.35 175.91 3hfz s GLU 334 N 1.94 4.50 -0.35 1.98 2.12 0.53 -2.80 118.70 126.61 3hfz s GLU 334 Ca 0.10 1.48 0.03 0.00 0.36 0.00 0.00 54.97 56.93 3hfz s GLU 334 Cb -0.17 -3.47 0.16 0.00 0.26 0.00 0.00 34.13 30.91 3hfz s GLU 334 CO 0.12 -0.16 0.40 0.08 -0.54 0.00 0.00 175.26 175.16 3hfz s VAL 335 N 1.30 -0.47 0.22 3.70 1.01 -1.13 -2.57 120.40 122.46 3hfz s VAL 335 Ca 0.52 -0.68 -0.08 0.00 0.00 0.00 0.00 61.98 61.75 3hfz s VAL 335 Cb -0.22 -0.71 -0.02 0.00 0.00 0.00 0.00 36.38 35.43 3hfz s VAL 335 CO 0.26 -0.45 0.33 0.00 0.00 0.00 0.00 175.10 175.25 3hfz s ALA 336 N 1.83 0.29 -0.36 5.51 0.00 -1.26 -2.92 121.76 124.86 3hfz s ALA 336 Ca 0.14 -1.18 -0.11 0.00 0.00 0.00 0.00 51.96 50.81 3hfz s ALA 336 Cb -0.13 1.17 0.01 0.00 0.00 0.00 0.00 23.12 24.17 3hfz s ALA 336 CO -0.13 -0.74 0.20 0.00 0.00 0.00 0.00 175.76 175.09 3hfz s PHE 338 N 1.59 1.80 -0.24 0.00 0.08 -1.26 -3.67 117.98 116.29 3hfz s PHE 338 Ca 0.03 -0.20 -0.21 0.00 0.12 0.00 0.00 56.93 56.68 3hfz s PHE 338 Cb -0.18 -3.00 -0.02 0.00 -0.57 0.00 0.00 43.02 39.25 3hfz s PHE 338 CO 0.07 -1.62 0.65 0.34 -0.10 0.00 0.00 175.22 174.56 3hfz s ASP 339 N -4.69 6.63 0.15 1.36 2.15 -1.23 -4.87 116.67 116.16 3hfz s ASP 339 Ca 0.65 0.77 -0.30 0.00 0.43 0.00 0.00 52.55 54.10 3hfz s ASP 339 Cb -0.06 -2.35 -0.08 0.00 -0.30 0.00 0.00 42.92 40.13 3hfz s ASP 339 CO 0.44 -0.36 1.52 -0.65 -0.17 0.00 0.00 175.17 175.95 3hfz h PRO 340 N 7.76 -0.11 -0.24 4.34 0.11 -1.89 -2.18 132.00 139.81 3hfz h PRO 340 Ca -0.28 0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.80 3hfz h PRO 340 Cb 1.13 0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 3hfz h PRO 340 CO 0.78 -0.07 -0.04 0.28 -0.21 0.00 0.00 178.00 178.74 3hfz h VAL 341 N -0.11 1.17 0.43 3.15 2.07 -1.89 0.78 116.25 121.84 3hfz h VAL 341 Ca 0.13 -0.69 -0.02 0.00 0.82 0.00 0.00 66.70 66.94 3hfz h VAL 341 Cb 0.45 1.04 0.00 0.00 -1.52 0.00 0.00 31.29 31.26 3hfz h VAL 341 CO -0.80 0.23 -0.21 -1.28 0.02 0.00 0.00 177.57 175.53 3hfz h SER 342 N 0.35 -0.49 -0.83 0.57 0.87 -1.84 -0.37 113.55 111.81 3hfz h SER 342 Ca 0.08 0.02 0.19 0.00 -1.23 0.00 0.00 61.79 60.84 3hfz h SER 342 Cb 0.30 0.13 -0.12 0.00 -0.44 0.00 0.00 62.40 62.27 3hfz h SER 342 CO 0.01 -0.29 0.31 0.40 -0.53 0.00 0.00 176.83 176.74 3hfz h ILE 343 N -0.71 0.51 0.10 2.23 1.08 -1.37 0.52 117.51 119.87 3hfz h ILE 343 Ca -0.06 -0.13 0.01 0.00 -0.39 0.00 0.00 64.86 64.29 3hfz h ILE 343 Cb 0.44 0.11 -0.03 0.00 -3.07 0.00 0.00 36.82 34.28 3hfz h ILE 343 CO 0.10 0.07 -0.31 -0.09 -0.69 0.00 0.00 178.15 177.23 3hfz h ARG 344 N 0.37 -0.44 -0.82 2.37 2.43 -0.75 0.95 114.38 118.49 3hfz h ARG 344 Ca 0.50 0.03 0.02 0.00 -0.81 0.00 0.00 59.98 59.71 3hfz h ARG 344 Cb 0.89 0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 30.49 3hfz h ARG 344 CO -0.51 -0.29 0.54 0.87 -1.51 0.00 0.00 179.97 179.07 3hfz h LYS 345 N -0.46 1.05 0.90 0.20 1.57 0.13 -1.46 116.57 118.51 3hfz h LYS 345 Ca -0.01 -0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 58.67 3hfz h LYS 345 Cb 0.45 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 32.53 3hfz h LYS 345 CO -0.15 0.70 -0.47 1.15 -0.57 0.00 0.00 179.45 180.11 3hfz h THR 346 N 1.09 0.00 -0.41 -0.16 2.02 0.18 0.18 112.91 115.80 3hfz h THR 346 Ca 0.31 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.56 3hfz h THR 346 Cb -0.08 0.00 -0.09 0.00 -1.74 0.00 0.00 68.15 66.24 3hfz h THR 346 CO -0.08 0.00 -0.47 0.00 0.37 0.00 0.00 175.52 175.34 3hfz h ALA 347 N -1.33 -0.52 -0.50 6.16 0.00 -0.67 0.19 119.26 122.59 3hfz h ALA 347 Ca -0.12 0.05 0.10 0.00 0.00 0.00 0.00 54.91 54.94 3hfz h ALA 347 Cb 0.98 0.96 -0.10 0.00 0.00 0.00 0.00 17.79 19.63 3hfz h ALA 347 CO 0.18 -0.92 -0.22 0.00 0.00 0.00 0.00 179.25 178.29 3hfz h ARG 348 N -0.35 -0.10 -0.69 0.00 -0.00 -1.18 -0.58 114.38 111.48 3hfz h ARG 348 Ca 0.12 0.01 0.14 0.00 -0.50 0.00 0.00 59.98 59.74 3hfz h ARG 348 Cb 0.59 0.02 -0.13 0.00 0.00 0.00 0.00 29.97 30.45 3hfz h ARG 348 CO -0.58 -0.07 -0.20 -0.09 0.00 0.00 0.00 179.97 179.03 3hfz h ARG 349 N -0.10 -0.02 -0.54 0.04 2.43 0.24 -1.38 114.38 115.04 3hfz h ARG 349 Ca 0.23 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.41 3hfz h ARG 349 Cb 0.47 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.02 3hfz h ARG 349 CO -0.57 -0.02 0.00 0.72 -1.51 0.00 0.00 179.97 178.60 3hfz n HIS 350 N -5.47 0.72 -3.44 2.20 8.25 -0.58 -4.94 115.22 111.96 3hfz n HIS 350 Ca 0.09 -0.36 -0.20 0.00 -0.26 0.00 0.00 57.72 56.99 3hfz n HIS 350 Cb 0.36 0.00 0.08 0.00 1.12 0.00 0.00 29.99 31.55 3hfz n HIS 350 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3hfz n GLY 351 N 1.42 -0.38 3.35 -1.41 0.00 -0.30 -5.00 105.19 102.86 3hfz n GLY 351 Ca 0.19 0.14 -0.31 0.00 0.00 0.00 0.00 46.02 46.03 3hfz n GLY 351 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hfz s LEU 352 N -6.52 2.21 -0.05 0.99 1.43 -0.72 -5.04 118.68 110.99 3hfz s LEU 352 Ca 0.33 -0.41 -0.02 0.00 -1.03 0.00 0.00 54.13 53.00 3hfz s LEU 352 Cb -0.15 -1.39 0.03 0.00 0.03 0.00 0.00 46.19 44.72 3hfz s LEU 352 CO 0.67 0.32 0.09 -0.60 0.23 0.00 0.00 176.35 177.07 3hfz s ARG 353 N -0.63 -0.04 0.22 1.70 3.00 -1.26 -4.36 118.95 117.58 3hfz s ARG 353 Ca 0.10 0.41 0.00 0.00 -1.00 0.00 0.00 55.73 55.25 3hfz s ARG 353 Cb -0.10 -0.42 -0.04 0.00 0.00 0.00 0.00 34.95 34.39 3hfz s ARG 353 CO -0.01 -0.31 0.14 0.95 0.00 0.00 0.00 175.30 176.08 3hfz s THR 354 N 2.09 0.06 0.25 4.11 -4.23 -1.26 -5.00 115.64 111.66 3hfz s THR 354 Ca 0.03 -2.00 -0.05 0.00 -1.18 0.00 0.00 61.69 58.49 3hfz s THR 354 Cb -0.12 -2.51 0.24 0.00 1.34 0.00 0.00 72.50 71.45 3hfz s THR 354 CO -0.04 0.00 1.90 -0.33 -0.54 0.00 0.00 174.62 175.61 3hfz h GLU 355 N 2.54 1.18 0.17 3.99 4.39 -1.99 -0.92 114.58 123.93 3hfz h GLU 355 Ca -0.35 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.27 3hfz h GLU 355 Cb 1.25 -0.27 0.00 0.00 -0.10 0.00 0.00 28.75 29.63 3hfz h GLU 355 CO 0.52 0.78 -0.08 0.00 -1.16 0.00 0.00 179.01 179.07 3hfz h ALA 356 N 1.39 -0.23 -0.13 3.43 0.00 -1.91 -2.68 119.26 119.13 3hfz h ALA 356 Ca 0.38 -0.20 0.03 0.00 0.00 0.00 0.00 54.91 55.12 3hfz h ALA 356 Cb -0.01 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 3hfz h ALA 356 CO -0.12 -0.42 -0.04 0.66 0.00 0.00 0.00 179.25 179.33 3hfz h SER 357 N -0.63 -0.14 -0.57 0.00 4.64 -1.56 -1.96 113.55 113.32 3hfz h SER 357 Ca -0.02 0.04 0.11 0.00 -0.47 0.00 0.00 61.79 61.45 3hfz h SER 357 Cb 0.47 0.09 -0.11 0.00 -0.31 0.00 0.00 62.40 62.54 3hfz h SER 357 CO 0.04 -0.05 -0.26 -0.74 -0.87 0.00 0.00 176.83 174.94 3hfz h HIS 358 N -0.01 -0.68 -0.16 4.77 6.17 -1.22 0.45 115.15 124.47 3hfz h HIS 358 Ca 0.07 0.06 -0.11 0.00 0.71 0.00 0.00 60.37 61.10 3hfz h HIS 358 Cb 0.11 0.38 -0.01 0.00 2.52 0.00 0.00 27.41 30.41 3hfz h HIS 358 CO -0.18 -0.34 -0.39 0.00 0.71 0.00 0.00 177.93 177.73 3hfz h ARG 359 N -0.11 0.37 -0.00 5.26 3.08 -1.29 -2.40 114.38 119.27 3hfz h ARG 359 Ca 0.25 -0.17 -0.14 0.00 0.07 0.00 0.00 59.98 59.99 3hfz h ARG 359 Cb 0.52 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.54 3hfz h ARG 359 CO -0.64 0.70 -0.68 0.74 -1.07 0.00 0.00 179.97 179.02 3hfz h PHE 360 N 0.31 0.02 -0.13 3.04 0.04 -0.28 0.44 116.94 120.38 3hfz h PHE 360 Ca 0.03 -0.01 -0.12 0.00 2.80 0.00 0.00 57.97 60.67 3hfz h PHE 360 Cb 0.83 -0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.96 3hfz h PHE 360 CO 0.02 0.69 -0.45 0.93 -0.60 0.00 0.00 178.31 178.90 3hfz h GLU 361 N 0.01 0.31 0.00 1.51 5.08 -0.04 -3.15 114.58 118.30 3hfz h GLU 361 Ca -0.01 -0.16 -0.22 0.00 -1.00 0.00 0.00 59.36 57.97 3hfz h GLU 361 Cb 1.20 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.42 3hfz h GLU 361 CO 0.09 0.70 -1.32 0.00 -1.00 0.00 0.00 179.01 177.48 3hfz h ARG 362 N 0.25 0.00 0.00 2.33 -0.00 -1.14 -3.46 114.38 112.36 3hfz h ARG 362 Ca 0.02 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.50 3hfz h ARG 362 Cb 0.90 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.87 3hfz h ARG 362 CO 0.07 0.58 0.00 0.41 0.00 0.00 0.00 179.97 181.03 3hfz n GLY 363 N 1.43 3.82 3.10 0.04 0.00 0.15 -4.80 105.19 108.92 3hfz n GLY 363 Ca -0.09 -1.67 -0.07 0.00 0.00 0.00 0.00 46.02 44.19 3hfz n GLY 363 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hfz s VAL 364 N -2.31 0.24 -0.60 1.61 1.01 -1.26 -4.59 120.40 114.50 3hfz s VAL 364 Ca 0.00 -1.82 -0.26 0.00 0.00 0.00 0.00 61.98 59.89 3hfz s VAL 364 Cb 0.00 -1.56 -0.06 0.00 0.00 0.00 0.00 36.38 34.76 3hfz s VAL 364 CO 0.00 -0.96 2.17 -0.62 0.00 0.00 0.00 175.10 175.69 3hfz s ASP 365 N -2.94 4.75 0.53 3.32 2.15 -1.26 -4.82 116.67 118.40 3hfz s ASP 365 Ca 0.08 0.57 0.46 0.00 0.43 0.00 0.00 52.55 54.09 3hfz s ASP 365 Cb 0.08 -2.52 1.56 0.00 -0.30 0.00 0.00 42.92 41.74 3hfz s ASP 365 CO -0.09 -2.78 1.44 -0.81 -0.17 0.00 0.00 175.17 172.77 3hfz n PRO 366 N 9.05 0.00 -0.68 4.34 -0.04 -1.26 0.20 135.00 146.61 3hfz n PRO 366 Ca 0.32 1.01 0.06 0.00 -0.04 0.00 0.00 63.50 64.85 3hfz n PRO 366 Cb 0.52 -2.36 0.19 0.00 -0.04 0.00 0.00 33.50 31.81 3hfz n PRO 366 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3hfz n LEU 367 N -3.74 2.53 0.04 1.53 4.77 -1.26 -4.71 117.00 116.16 3hfz n LEU 367 Ca 0.40 -3.71 0.11 0.00 -0.03 0.00 0.00 56.01 52.79 3hfz n LEU 367 Cb 1.86 -0.48 -0.09 0.00 -2.33 0.00 0.00 43.42 42.39 3hfz n LEU 367 CO 0.40 1.31 -0.37 0.61 -1.33 0.00 0.00 177.39 178.01 3hfz n GLY 368 N -0.96 -1.22 0.22 -0.72 0.00 0.55 -4.52 105.19 98.53 3hfz n GLY 368 Ca 0.18 -0.38 -0.00 0.00 0.00 0.00 0.00 46.02 45.81 3hfz n GLY 368 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3hfz h GLN 369 N 0.00 0.16 0.31 1.61 7.50 -1.85 0.11 115.11 122.95 3hfz h GLN 369 Ca 0.00 -0.01 -0.02 0.00 0.50 0.00 0.00 58.65 59.13 3hfz h GLN 369 Cb 0.99 -0.04 0.00 0.00 0.05 0.00 0.00 27.48 28.49 3hfz h GLN 369 CO 0.00 0.10 -0.15 0.28 -1.50 0.00 0.00 178.83 177.57 3hfz h VAL 370 N 0.16 0.71 -0.67 -0.54 2.07 -1.88 -2.10 116.25 114.00 3hfz h VAL 370 Ca 0.29 -0.17 0.01 0.00 0.82 0.00 0.00 66.70 67.65 3hfz h VAL 370 Cb 0.45 0.81 -0.03 0.00 -1.52 0.00 0.00 31.29 30.99 3hfz h VAL 370 CO -0.44 0.04 0.44 -0.65 0.02 0.00 0.00 177.57 176.98 3hfz h PRO 371 N -0.51 0.89 0.00 1.57 0.11 -1.75 -0.21 132.00 132.09 3hfz h PRO 371 Ca -0.04 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 65.99 3hfz h PRO 371 Cb 0.38 -0.20 -0.00 0.00 0.11 0.00 0.00 31.00 31.29 3hfz h PRO 371 CO 0.07 0.59 -0.09 0.00 -0.21 0.00 0.00 178.00 178.36 3hfz h ALA 372 N 1.58 1.64 0.27 -0.75 0.00 -0.60 -1.83 119.26 119.58 3hfz h ALA 372 Ca 0.25 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 3hfz h ALA 372 Cb -0.10 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.68 3hfz h ALA 372 CO -0.05 0.11 -0.13 1.96 0.00 0.00 0.00 179.25 181.13 3hfz h GLN 373 N 0.00 -0.35 -0.52 0.00 1.08 -0.33 -1.97 115.11 113.01 3hfz h GLN 373 Ca -0.00 0.02 0.08 0.00 -1.45 0.00 0.00 58.65 57.30 3hfz h GLN 373 Cb 0.18 0.08 -0.06 0.00 -0.05 0.00 0.00 27.48 27.62 3hfz h GLN 373 CO 0.01 -0.03 0.15 0.00 -0.95 0.00 0.00 178.83 178.01 3hfz h ARG 374 N -0.72 0.31 0.27 1.46 3.08 -1.19 0.97 114.38 118.57 3hfz h ARG 374 Ca -0.04 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 59.99 3hfz h ARG 374 Cb 0.49 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.45 3hfz h ARG 374 CO 0.06 0.20 -0.33 -0.09 -1.07 0.00 0.00 179.97 178.74 3hfz h ARG 375 N 0.31 -0.59 -0.54 0.04 1.12 -1.34 0.14 114.38 113.53 3hfz h ARG 375 Ca 0.25 0.04 0.07 0.00 -1.11 0.00 0.00 59.98 59.24 3hfz h ARG 375 Cb 0.31 0.13 -0.06 0.00 -0.01 0.00 0.00 29.97 30.34 3hfz h ARG 375 CO -0.29 -0.40 0.21 0.00 -3.11 0.00 0.00 179.97 176.39 3hfz h ALA 376 N -1.14 0.68 -0.33 2.80 0.00 -0.78 -1.84 119.26 118.64 3hfz h ALA 376 Ca -0.03 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 3hfz h ALA 376 Cb 0.55 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 3hfz h ALA 376 CO -0.07 -0.19 0.17 -0.07 0.00 0.00 0.00 179.25 179.10 3hfz h LEU 377 N 0.40 0.41 -0.90 0.00 3.38 0.12 -1.11 115.31 117.61 3hfz h LEU 377 Ca 0.26 -0.10 0.10 0.00 0.09 0.00 0.00 57.88 58.23 3hfz h LEU 377 Cb 0.28 -0.11 -0.08 0.00 0.09 0.00 0.00 40.66 40.84 3hfz h LEU 377 CO -0.25 0.39 0.54 -1.28 0.09 0.00 0.00 178.44 177.93 3hfz h SER 378 N 0.40 0.78 0.18 -0.43 0.87 -0.36 0.14 113.55 115.14 3hfz h SER 378 Ca 0.11 0.04 -0.01 0.00 -1.23 0.00 0.00 61.79 60.71 3hfz h SER 378 Cb 0.08 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 61.93 3hfz h SER 378 CO -0.02 0.44 -0.09 -0.07 -0.53 0.00 0.00 176.83 176.57 3hfz h LEU 379 N 0.89 -0.21 -1.44 2.23 3.38 -0.99 -1.98 115.31 117.20 3hfz h LEU 379 Ca 0.43 -0.19 0.16 0.00 0.09 0.00 0.00 57.88 58.38 3hfz h LEU 379 Cb 0.38 0.05 -0.06 0.00 0.09 0.00 0.00 40.66 41.12 3hfz h LEU 379 CO -0.25 0.08 0.56 -0.07 0.09 0.00 0.00 178.44 178.85 3hfz h LEU 380 N -0.51 0.50 -0.62 1.67 3.38 -0.45 0.75 115.31 120.05 3hfz h LEU 380 Ca -0.03 0.04 -0.11 0.00 0.09 0.00 0.00 57.88 57.87 3hfz h LEU 380 Cb 0.39 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 3hfz h LEU 380 CO 0.04 0.24 -0.14 -0.61 0.09 0.00 0.00 178.44 178.06 3hfz h GLN 381 N 0.52 0.94 0.16 1.13 4.15 -0.49 0.13 115.11 121.66 3hfz h GLN 381 Ca 0.43 -0.36 -0.22 0.00 0.77 0.00 0.00 58.65 59.28 3hfz h GLN 381 Cb 0.90 -0.06 0.02 0.00 0.21 0.00 0.00 27.48 28.55 3hfz h GLN 381 CO -0.18 1.02 -0.97 0.00 -1.93 0.00 0.00 178.83 176.77 3hfz h ALA 382 N 0.99 -0.08 0.00 3.38 0.00 -0.07 -2.83 119.26 120.65 3hfz h ALA 382 Ca 0.13 -0.76 -0.15 0.00 0.00 0.00 0.00 54.91 54.13 3hfz h ALA 382 Cb 0.69 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 3hfz h ALA 382 CO 0.05 0.47 -1.18 -0.07 0.00 0.00 0.00 179.25 178.52 3hfz h LEU 383 N -0.29 0.00 -0.88 0.00 4.07 0.32 -3.40 115.31 115.14 3hfz h LEU 383 Ca -0.18 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.78 3hfz h LEU 383 Cb 1.74 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.48 3hfz h LEU 383 CO 0.16 0.54 -0.00 0.00 -1.08 0.00 0.00 178.44 178.06 3hfz n ALA 384 N -2.35 2.44 0.00 1.53 0.00 0.44 -4.93 120.51 117.64 3hfz n ALA 384 Ca -0.06 -0.43 0.00 0.00 0.00 0.00 0.00 53.44 52.94 3hfz n ALA 384 Cb 0.80 -0.02 0.00 0.00 0.00 0.00 0.00 19.45 20.24 3hfz n ALA 384 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hfz n GLY 385 N 0.17 2.86 1.06 0.00 0.00 -1.01 -0.94 105.19 107.34 3hfz n GLY 385 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.84 3hfz n GLY 385 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hfz n ALA 386 N -0.90 -1.30 -2.79 4.61 0.00 -1.07 -4.85 120.51 114.20 3hfz n ALA 386 Ca 0.00 0.18 -0.32 0.00 0.00 0.00 0.00 53.44 53.30 3hfz n ALA 386 Cb 0.00 -0.54 -0.04 0.00 0.00 0.00 0.00 19.45 18.87 3hfz n ALA 386 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3hfz s ARG 387 N 0.13 3.53 0.01 0.00 0.52 0.11 -4.40 118.95 118.84 3hfz s ARG 387 Ca 0.28 -0.24 0.02 0.00 -0.52 0.00 0.00 55.73 55.26 3hfz s ARG 387 Cb -0.39 -2.96 -0.01 0.00 0.52 0.00 0.00 34.95 32.11 3hfz s ARG 387 CO 0.18 0.55 -0.05 0.08 0.02 0.00 0.00 175.30 176.08 3hfz s VAL 388 N -1.55 0.39 -0.44 3.52 1.01 -1.26 -1.75 120.40 120.32 3hfz s VAL 388 Ca 0.37 -0.44 -0.29 0.00 0.00 0.00 0.00 61.98 61.62 3hfz s VAL 388 Cb -0.13 -0.38 0.02 0.00 0.00 0.00 0.00 36.38 35.90 3hfz s VAL 388 CO 0.25 -0.04 1.20 0.00 0.00 0.00 0.00 175.10 176.52 3hfz s ALA 389 N -0.47 3.17 -0.82 5.51 0.00 -0.52 -1.42 121.76 127.22 3hfz s ALA 389 Ca -0.02 -0.33 0.00 0.00 0.00 0.00 0.00 51.96 51.61 3hfz s ALA 389 Cb -0.04 -3.88 0.00 0.00 0.00 0.00 0.00 23.12 19.20 3hfz s ALA 389 CO -0.00 -2.19 0.14 -1.91 0.00 0.00 0.00 175.76 171.79 3hfz n GLU 390 N 7.78 0.00 -4.28 0.00 2.13 -0.76 -4.58 120.64 120.94 3hfz n GLU 390 Ca 0.13 0.00 -0.15 0.00 0.66 0.00 0.00 57.16 57.80 3hfz n GLU 390 Cb 0.48 -1.33 -0.10 0.00 0.27 0.00 0.00 31.44 30.76 3hfz n GLU 390 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3hfz s ALA 391 N -1.21 1.52 0.11 4.31 0.00 -1.26 -4.99 121.76 120.24 3hfz s ALA 391 Ca 0.00 -1.75 0.01 0.00 0.00 0.00 0.00 51.96 50.23 3hfz s ALA 391 Cb 0.00 0.90 -0.04 0.00 0.00 0.00 0.00 23.12 23.97 3hfz s ALA 391 CO 0.00 -0.42 -0.04 -0.51 0.00 0.00 0.00 175.76 174.78 3hfz s LEU 392 N -3.24 2.40 -0.45 0.00 1.43 -1.26 -4.50 118.68 113.05 3hfz s LEU 392 Ca 0.33 -1.05 -0.13 0.00 -1.03 0.00 0.00 54.13 52.25 3hfz s LEU 392 Cb 0.07 -0.03 0.08 0.00 0.03 0.00 0.00 46.19 46.34 3hfz s LEU 392 CO 0.10 -0.51 0.34 -0.76 0.23 0.00 0.00 176.35 175.75 3hfz s LEU 393 N -3.06 5.45 -0.21 1.79 1.02 -0.88 -4.95 118.68 117.84 3hfz s LEU 393 Ca 0.14 -1.40 -0.02 0.00 0.02 0.00 0.00 54.13 52.87 3hfz s LEU 393 Cb 0.06 -2.11 0.00 0.00 0.02 0.00 0.00 46.19 44.16 3hfz s LEU 393 CO -0.03 -0.61 -0.09 -0.70 0.02 0.00 0.00 176.35 174.94 3hfz s GLU 394 N 1.56 3.20 -0.23 1.70 2.12 -1.26 -1.37 118.70 124.42 3hfz s GLU 394 Ca 0.04 -0.73 -0.02 0.00 0.36 0.00 0.00 54.97 54.62 3hfz s GLU 394 Cb -0.24 -2.88 0.01 0.00 0.26 0.00 0.00 34.13 31.28 3hfz s GLU 394 CO 0.05 -0.23 -0.07 0.00 -0.54 0.00 0.00 175.26 174.47 3hfz s ALA 395 N 1.41 2.69 0.00 6.30 0.00 0.14 -4.98 121.76 127.31 3hfz s ALA 395 Ca 0.05 -1.31 0.00 0.00 0.00 0.00 0.00 51.96 50.70 3hfz s ALA 395 Cb -0.14 -1.62 0.00 0.00 0.00 0.00 0.00 23.12 21.36 3hfz s ALA 395 CO -0.06 -0.59 0.00 0.41 0.00 0.00 0.00 175.76 175.52 3hfz n GLY 396 N 4.71 2.89 2.62 0.00 0.00 -1.26 -0.27 105.19 113.88 3hfz n GLY 396 Ca -0.18 -1.73 -0.18 0.00 0.00 0.00 0.00 46.02 43.94 3hfz n GLY 396 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3hfz s SER 397 N 0.00 0.63 0.61 1.61 0.15 -1.26 -4.82 113.70 110.62 3hfz s SER 397 Ca 0.00 -2.20 -0.18 0.00 0.70 0.00 0.00 55.95 54.27 3hfz s SER 397 Cb 0.00 0.50 -0.03 0.00 -1.71 0.00 0.00 66.02 64.79 3hfz s SER 397 CO 0.00 -0.17 1.18 -2.84 1.20 0.00 0.00 173.24 172.61 3hfz s PRO 398 N 0.76 2.91 0.11 5.44 0.02 -1.26 -5.00 135.00 137.98 3hfz s PRO 398 Ca 0.26 1.73 -0.25 0.00 0.02 0.00 0.00 61.00 62.77 3hfz s PRO 398 Cb -0.04 -1.93 -0.07 0.00 0.02 0.00 0.00 34.50 32.48 3hfz s PRO 398 CO -0.10 -1.23 0.76 0.15 -0.33 0.00 0.00 177.00 176.26 3hfz s LYS 399 N -3.48 4.52 1.04 5.54 -0.14 -1.26 -5.03 119.74 120.93 3hfz s LYS 399 Ca 0.75 1.11 -0.13 0.00 -1.36 0.00 0.00 55.97 56.34 3hfz s LYS 399 Cb -0.28 -3.30 0.16 0.00 -1.68 0.00 0.00 37.83 32.73 3hfz s LYS 399 CO 0.34 0.46 0.75 -2.30 -0.76 0.00 0.00 175.35 173.85 3hfz n PRO 400 N 2.09 -1.23 -1.38 -1.68 -0.02 -1.26 -4.93 135.00 126.59 3hfz n PRO 400 Ca -0.05 -0.32 -0.32 0.00 -2.02 0.00 0.00 63.50 60.80 3hfz n PRO 400 Cb 0.49 -2.09 0.08 0.00 -0.02 0.00 0.00 33.50 31.97 3hfz n PRO 400 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3hfz s PRO 401 N -4.15 2.31 0.28 0.52 0.04 -1.26 -5.03 135.00 127.71 3hfz s PRO 401 Ca 0.63 1.32 -0.07 0.00 0.04 0.00 0.00 61.00 62.92 3hfz s PRO 401 Cb -0.21 -1.89 -0.06 0.00 0.04 0.00 0.00 34.50 32.37 3hfz s PRO 401 CO 0.64 -1.62 0.57 -2.00 0.04 0.00 0.00 177.00 174.63 3hfz s GLU 402 N -4.54 3.71 0.11 4.56 2.12 -1.26 -4.88 118.70 118.52 3hfz s GLU 402 Ca 0.64 0.15 -0.31 0.00 0.36 0.00 0.00 54.97 55.82 3hfz s GLU 402 Cb -0.20 -2.62 -0.07 0.00 0.26 0.00 0.00 34.13 31.50 3hfz s GLU 402 CO 0.51 0.23 1.28 0.00 -0.54 0.00 0.00 175.26 176.73 3hfz s ALA 403 N -2.01 3.48 -0.16 6.30 0.00 -1.26 -4.38 121.76 123.73 3hfz s ALA 403 Ca 0.46 0.99 -0.07 0.00 0.00 0.00 0.00 51.96 53.34 3hfz s ALA 403 Cb -0.11 -3.48 -0.04 0.00 0.00 0.00 0.00 23.12 19.49 3hfz s ALA 403 CO 0.27 -0.50 0.07 0.42 0.00 0.00 0.00 175.76 176.02 3hfz s ILE 404 N 0.81 4.88 0.01 0.00 -1.09 1.16 -4.83 121.20 122.14 3hfz s ILE 404 Ca 0.60 -0.01 -0.30 0.00 -2.23 0.00 0.00 60.65 58.70 3hfz s ILE 404 Cb -0.33 -3.17 -0.05 0.00 -1.58 0.00 0.00 42.46 37.33 3hfz s ILE 404 CO 0.32 0.51 1.24 -2.16 -1.23 0.00 0.00 174.94 173.61 3hfz s PRO 405 N -0.05 4.37 -0.13 2.79 0.04 -1.26 0.21 135.00 140.97 3hfz s PRO 405 Ca 0.07 1.77 -0.01 0.00 0.04 0.00 0.00 61.00 62.87 3hfz s PRO 405 Cb -0.12 -3.47 0.03 0.00 0.04 0.00 0.00 34.50 30.99 3hfz s PRO 405 CO 0.01 -0.39 -0.06 0.12 0.04 0.00 0.00 177.00 176.72 3hfz s PHE 406 N 1.75 1.50 -0.31 0.56 5.36 0.11 -4.54 117.98 122.40 3hfz s PHE 406 Ca 0.59 -0.84 -0.07 0.00 -0.96 0.00 0.00 56.93 55.64 3hfz s PHE 406 Cb -0.28 -1.23 0.02 0.00 -0.34 0.00 0.00 43.02 41.19 3hfz s PHE 406 CO 0.26 -0.55 0.09 1.03 -1.46 0.00 0.00 175.22 174.60 3hfz s ARG 407 N 1.70 2.92 0.26 10.12 3.00 -1.26 0.77 118.95 136.47 3hfz s ARG 407 Ca 0.03 -0.97 -0.01 0.00 0.00 0.00 0.00 55.73 54.77 3hfz s ARG 407 Cb -0.14 -3.42 0.48 0.00 0.00 0.00 0.00 34.95 31.87 3hfz s ARG 407 CO -0.08 -0.53 1.83 -1.35 0.00 0.00 0.00 175.30 175.17 3hfz h PRO 408 N 8.24 0.89 -0.56 3.54 0.11 -1.99 0.13 132.00 142.35 3hfz h PRO 408 Ca -0.28 -0.05 0.16 0.00 0.11 0.00 0.00 66.00 65.93 3hfz h PRO 408 Cb 1.11 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 32.00 3hfz h PRO 408 CO 0.61 0.59 0.49 1.49 -0.21 0.00 0.00 178.00 180.96 3hfz h GLU 409 N 0.91 0.00 0.13 1.05 4.22 -1.94 0.25 114.58 119.20 3hfz h GLU 409 Ca 0.45 0.00 -0.32 0.00 0.08 0.00 0.00 59.36 59.57 3hfz h GLU 409 Cb 0.42 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 3hfz h GLU 409 CO -0.25 0.00 -1.60 -0.92 -2.18 0.00 0.00 179.01 174.06 3hfz h TYR 410 N 0.00 0.49 -0.25 0.92 3.20 -1.18 -1.40 116.97 118.75 3hfz h TYR 410 Ca 0.26 -0.36 0.03 0.00 3.14 0.00 0.00 58.73 61.81 3hfz h TYR 410 Cb 1.24 -0.02 -0.06 0.00 1.54 0.00 0.00 36.73 39.43 3hfz h TYR 410 CO 0.00 1.44 -0.47 0.00 -1.64 0.00 0.00 178.16 177.49 3hfz h ALA 411 N 0.42 -0.76 0.32 1.82 0.00 0.03 -0.46 119.26 120.64 3hfz h ALA 411 Ca -0.27 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.60 3hfz h ALA 411 Cb 2.03 1.02 0.00 0.00 0.00 0.00 0.00 17.79 20.84 3hfz h ALA 411 CO 0.16 -0.96 -0.15 -0.91 0.00 0.00 0.00 179.25 177.39 3hfz h ASN 412 N -0.40 -0.36 0.00 0.00 2.35 -1.43 -1.49 115.58 114.24 3hfz h ASN 412 Ca 0.05 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.81 3hfz h ASN 412 Cb 0.53 0.09 0.00 0.00 0.05 0.00 0.00 38.32 38.99 3hfz h ASN 412 CO -0.45 -0.26 0.87 -0.09 -1.65 0.00 0.00 177.43 175.85 3hfz h ARG 413 N -0.43 0.00 0.03 0.81 2.43 -1.11 0.65 114.38 116.75 3hfz h ARG 413 Ca -0.04 0.00 -0.38 0.00 -0.81 0.00 0.00 59.98 58.75 3hfz h ARG 413 Cb 0.33 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 29.83 3hfz h ARG 413 CO 0.07 0.00 -2.20 -0.11 -1.51 0.00 0.00 179.97 176.23 3hfz n LEU 414 N -2.31 2.43 0.16 3.80 7.94 -0.19 -4.36 117.00 124.47 3hfz n LEU 414 Ca -0.00 0.16 0.03 0.00 -1.11 0.00 0.00 56.01 55.09 3hfz n LEU 414 Cb 0.87 -0.94 0.22 0.00 0.53 0.00 0.00 43.42 44.10 3hfz n LEU 414 CO 0.01 0.71 0.57 -0.07 -1.11 0.00 0.00 177.39 177.50 3hfz h LEU 415 N -0.43 0.00 0.00 -1.96 3.38 0.11 -3.47 115.31 112.94 3hfz h LEU 415 Ca -0.54 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.43 3hfz h LEU 415 Cb 1.75 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.50 3hfz h LEU 415 CO -0.17 0.49 0.00 0.61 0.09 0.00 0.00 178.44 179.46 3hfz n GLY 416 N 0.50 0.59 0.00 0.83 0.00 0.17 -4.87 105.19 102.41 3hfz n GLY 416 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.81 3hfz n GLY 416 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3hfz n THR 417 N -2.77 0.00 -2.69 2.61 -2.24 -1.23 -4.71 114.28 103.25 3hfz n THR 417 Ca 0.00 0.00 -0.06 0.00 -2.27 0.00 0.00 64.05 61.72 3hfz n THR 417 Cb 0.00 -1.14 0.08 0.00 -2.10 0.00 0.00 70.33 67.17 3hfz n THR 417 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3hfz n SER 418 N -0.54 -1.72 -4.77 3.42 3.41 -1.26 -4.63 113.62 107.53 3hfz n SER 418 Ca 0.00 -2.32 -0.39 0.00 -0.26 0.00 0.00 58.87 55.90 3hfz n SER 418 Cb 0.00 1.08 -0.02 0.00 -0.26 0.00 0.00 64.21 65.01 3hfz n SER 418 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 3hfz s TYR 419 N 0.16 3.09 0.38 7.33 2.02 -1.26 -4.98 117.35 124.09 3hfz s TYR 419 Ca 0.17 1.52 -0.25 0.00 -0.37 0.00 0.00 57.07 58.14 3hfz s TYR 419 Cb 0.30 -3.48 -0.09 0.00 -0.40 0.00 0.00 41.96 38.29 3hfz s TYR 419 CO -0.07 -1.45 1.05 -1.25 -1.57 0.00 0.00 175.55 172.26 3hfz s PRO 420 N -2.07 4.27 0.00 -1.71 0.04 -1.26 -4.91 135.00 129.36 3hfz s PRO 420 Ca 0.54 1.54 0.00 0.00 0.04 0.00 0.00 61.00 63.11 3hfz s PRO 420 Cb -0.34 -2.65 0.00 0.00 0.04 0.00 0.00 34.50 31.55 3hfz s PRO 420 CO 0.44 -0.06 0.73 0.39 0.04 0.00 0.00 177.00 178.54 3hfz n GLU 421 N 0.16 0.00 -0.47 4.56 1.02 -1.26 -0.84 120.64 123.82 3hfz n GLU 421 Ca 0.04 0.73 0.39 0.00 -0.02 0.00 0.00 57.16 58.30 3hfz n GLU 421 Cb 0.49 -1.13 0.67 0.00 -0.02 0.00 0.00 31.44 31.45 3hfz n GLU 421 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3hfz h ALA 422 N -0.94 2.82 -0.01 0.62 0.00 -2.00 1.59 119.26 121.34 3hfz h ALA 422 Ca 0.00 0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.92 3hfz h ALA 422 Cb 0.00 0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 3hfz h ALA 422 CO 0.00 -1.49 -0.51 1.49 0.00 0.00 0.00 179.25 178.74 3hfz h GLU 423 N 0.04 0.02 0.16 0.00 4.81 -1.37 -2.78 114.58 115.45 3hfz h GLU 423 Ca 0.86 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 60.07 3hfz h GLU 423 Cb 2.75 0.00 0.00 0.00 0.63 0.00 0.00 28.75 32.14 3hfz h GLU 423 CO -0.44 0.53 -0.07 1.96 -0.73 0.00 0.00 179.01 180.26 3hfz h GLN 424 N 0.01 -0.20 -0.37 1.92 4.20 0.26 -3.18 115.11 117.74 3hfz h GLN 424 Ca -0.00 0.01 0.06 0.00 0.06 0.00 0.00 58.65 58.78 3hfz h GLN 424 Cb 0.91 0.05 -0.08 0.00 0.30 0.00 0.00 27.48 28.65 3hfz h GLN 424 CO 0.07 0.16 -0.49 0.82 -0.67 0.00 0.00 178.83 178.72 3hfz h ILE 425 N -0.96 0.06 -0.74 2.54 1.08 -1.44 -0.59 117.51 117.46 3hfz h ILE 425 Ca -0.02 0.00 0.17 0.00 -0.39 0.00 0.00 64.86 64.62 3hfz h ILE 425 Cb 0.45 0.06 -0.04 0.00 -3.07 0.00 0.00 36.82 34.22 3hfz h ILE 425 CO 0.04 0.00 0.51 0.00 -0.69 0.00 0.00 178.15 178.00 3hfz h ALA 426 N 0.18 2.32 -0.18 1.87 0.00 -1.64 -0.26 119.26 121.54 3hfz h ALA 426 Ca 0.10 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 3hfz h ALA 426 Cb 0.60 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 3hfz h ALA 426 CO -0.57 -0.53 0.08 0.82 0.00 0.00 0.00 179.25 179.06 3hfz h ILE 427 N 0.26 1.15 0.11 0.00 1.08 -1.09 -0.21 117.51 118.79 3hfz h ILE 427 Ca 0.36 -0.43 -0.01 0.00 -0.39 0.00 0.00 64.86 64.40 3hfz h ILE 427 Cb 1.05 1.09 0.00 0.00 -3.07 0.00 0.00 36.82 35.89 3hfz h ILE 427 CO -0.08 0.14 -0.05 -0.07 -0.69 0.00 0.00 178.15 177.39 3hfz h LEU 428 N 0.16 -0.12 -1.16 1.44 3.38 -0.76 -2.18 115.31 116.07 3hfz h LEU 428 Ca 0.06 -0.01 0.09 0.00 0.09 0.00 0.00 57.88 58.11 3hfz h LEU 428 Cb 0.15 0.03 -0.07 0.00 0.09 0.00 0.00 40.66 40.86 3hfz h LEU 428 CO -0.01 -0.07 0.59 0.11 0.09 0.00 0.00 178.44 179.15 3hfz h LYS 429 N -0.16 0.92 -0.52 1.13 1.57 -1.02 0.80 116.57 119.29 3hfz h LYS 429 Ca -0.01 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.69 3hfz h LYS 429 Cb 0.13 -0.21 -0.03 0.00 0.08 0.00 0.00 32.23 32.20 3hfz h LYS 429 CO 0.02 0.61 0.24 0.00 -0.57 0.00 0.00 179.45 179.76 3hfz h ARG 430 N 0.95 0.73 0.00 3.15 3.08 -0.62 -0.89 114.38 120.77 3hfz h ARG 430 Ca 0.42 -0.09 0.00 0.00 0.07 0.00 0.00 59.98 60.38 3hfz h ARG 430 Cb 0.35 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.26 3hfz h ARG 430 CO -0.18 0.57 0.00 1.28 -1.07 0.00 0.00 179.97 180.58 3hfz n LEU 431 N -4.37 0.00 0.00 3.04 4.77 0.23 -4.62 117.00 116.04 3hfz n LEU 431 Ca 0.04 0.08 0.00 0.00 -0.03 0.00 0.00 56.01 56.10 3hfz n LEU 431 Cb 0.13 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 3hfz n LEU 431 CO 0.37 -0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.04 3hfz n GLY 432 N 0.86 2.51 3.16 -0.72 0.00 -0.34 -4.82 105.19 105.83 3hfz n GLY 432 Ca 0.19 -0.53 -0.35 0.00 0.00 0.00 0.00 46.02 45.34 3hfz n GLY 432 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hfz s ARG 434 N -2.62 2.87 -0.16 0.00 3.52 -0.99 -4.27 118.95 117.29 3hfz s ARG 434 Ca 0.46 -0.83 0.01 0.00 -0.13 0.00 0.00 55.73 55.24 3hfz s ARG 434 Cb -0.18 -2.33 0.01 0.00 -1.56 0.00 0.00 34.95 30.89 3hfz s ARG 434 CO 0.77 0.31 -0.17 0.08 -0.81 0.00 0.00 175.30 175.48 3hfz s VAL 435 N 0.03 2.44 0.20 7.11 1.01 -1.26 -1.78 120.40 128.15 3hfz s VAL 435 Ca -0.08 -0.84 0.11 0.00 0.00 0.00 0.00 61.98 61.17 3hfz s VAL 435 Cb -0.15 -2.03 -0.04 0.00 0.00 0.00 0.00 36.38 34.16 3hfz s VAL 435 CO 0.05 0.52 -0.18 -1.61 0.00 0.00 0.00 175.10 173.88 3hfz s GLU 436 N 1.00 1.75 0.00 2.72 2.02 0.55 -4.96 118.70 121.78 3hfz s GLU 436 Ca -0.02 -1.46 0.00 0.00 0.02 0.00 0.00 54.97 53.51 3hfz s GLU 436 Cb -0.15 -1.95 0.00 0.00 0.10 0.00 0.00 34.13 32.13 3hfz s GLU 436 CO -0.04 0.40 0.00 0.41 0.02 0.00 0.00 175.26 176.05 3hfz n GLY 437 N 0.05 0.62 0.11 -1.39 0.00 -1.26 -0.96 105.19 102.36 3hfz n GLY 437 Ca -0.11 -2.06 0.05 0.00 0.00 0.00 0.00 46.02 43.90 3hfz n GLY 437 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3hfz n GLU 438 N 0.55 1.44 0.00 1.61 0.28 -1.26 -4.97 120.64 118.29 3hfz n GLU 438 Ca 0.00 -1.81 0.00 0.00 -0.16 0.00 0.00 57.16 55.19 3hfz n GLU 438 Cb 0.00 -1.10 0.00 0.00 1.43 0.00 0.00 31.44 31.77 3hfz n GLU 438 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3hfz n GLY 439 N -0.80 0.34 0.24 -1.84 0.00 -1.26 -5.01 105.19 96.86 3hfz n GLY 439 Ca 0.07 -1.74 -0.09 0.00 0.00 0.00 0.00 46.02 44.26 3hfz n GLY 439 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3hfz h PRO 440 N 0.00 -0.57 -6.18 1.61 0.13 -1.99 -3.48 132.00 121.51 3hfz h PRO 440 Ca 0.00 0.04 -0.57 0.00 -0.87 0.00 0.00 66.00 64.60 3hfz h PRO 440 Cb 0.00 0.13 -0.04 0.00 0.13 0.00 0.00 31.00 31.22 3hfz h PRO 440 CO 0.00 -0.38 0.71 -0.08 -0.23 0.00 0.00 178.00 178.02 3hfz s THR 441 N -3.80 4.62 0.44 1.56 -1.32 -1.26 -4.45 115.64 111.43 3hfz s THR 441 Ca -0.09 1.92 0.06 0.00 -1.21 0.00 0.00 61.69 62.37 3hfz s THR 441 Cb 0.01 -4.24 0.01 0.00 -1.51 0.00 0.00 72.50 66.77 3hfz s THR 441 CO 0.26 -0.08 0.61 -0.31 -2.21 0.00 0.00 174.62 172.89 3hfz s TYR 442 N 2.67 2.90 -0.40 9.09 1.51 0.23 -4.84 117.35 128.52 3hfz s TYR 442 Ca 0.48 -0.23 -0.04 0.00 -1.01 0.00 0.00 57.07 56.27 3hfz s TYR 442 Cb -0.18 -2.40 0.09 0.00 -0.11 0.00 0.00 41.96 39.36 3hfz s TYR 442 CO 0.13 -0.46 0.19 1.03 -1.11 0.00 0.00 175.55 175.34 3hfz s ARG 443 N -4.44 2.21 -0.19 -0.62 1.81 -0.13 0.06 118.95 117.65 3hfz s ARG 443 Ca 0.53 -1.66 -0.04 0.00 -1.72 0.00 0.00 55.73 52.85 3hfz s ARG 443 Cb -0.10 -3.57 -0.02 0.00 -0.45 0.00 0.00 34.95 30.81 3hfz s ARG 443 CO 0.34 -0.98 -0.04 0.08 -0.68 0.00 0.00 175.30 174.02 3hfz s VAL 444 N 1.22 3.63 -0.29 3.52 1.01 0.13 -0.33 120.40 129.30 3hfz s VAL 444 Ca 0.05 -0.43 -0.01 0.00 0.00 0.00 0.00 61.98 61.59 3hfz s VAL 444 Cb -0.22 -2.62 0.05 0.00 0.00 0.00 0.00 36.38 33.59 3hfz s VAL 444 CO -0.02 0.45 -0.02 0.42 0.00 0.00 0.00 175.10 175.92 3hfz s THR 445 N 0.96 2.82 1.08 3.92 -4.23 -0.73 0.37 115.64 119.83 3hfz s THR 445 Ca 0.00 -1.43 -0.13 0.00 -1.18 0.00 0.00 61.69 58.95 3hfz s THR 445 Cb -0.15 -2.63 0.21 0.00 1.34 0.00 0.00 72.50 71.27 3hfz s THR 445 CO 0.01 -0.09 0.85 -0.81 -0.54 0.00 0.00 174.62 174.04 3hfz n PRO 446 N 4.58 -1.65 -1.84 3.99 -0.04 -1.26 -2.36 135.00 136.43 3hfz n PRO 446 Ca -0.13 -0.44 -0.31 0.00 -0.04 0.00 0.00 63.50 62.57 3hfz n PRO 446 Cb 0.43 -2.13 0.02 0.00 -0.04 0.00 0.00 33.50 31.78 3hfz n PRO 446 CO 0.00 0.00 0.00 -2.14 -0.04 0.00 0.00 175.50 173.32 3hfz s PRO 447 N -4.25 3.35 0.52 0.54 0.02 -1.26 -4.75 135.00 129.18 3hfz s PRO 447 Ca 0.65 0.91 0.20 0.00 0.02 0.00 0.00 61.00 62.78 3hfz s PRO 447 Cb -0.23 -2.05 1.32 0.00 0.02 0.00 0.00 34.50 33.57 3hfz s PRO 447 CO 0.64 -0.77 2.09 0.66 -0.33 0.00 0.00 177.00 179.29 3hfz h SER 448 N -0.23 0.00 0.45 2.53 4.64 -1.97 -2.43 113.55 116.54 3hfz h SER 448 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 3hfz h SER 448 Cb 1.20 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 3hfz h SER 448 CO 0.59 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.55 3hfz n HIS 449 N -4.47 0.00 -3.36 4.77 1.44 -1.26 -4.47 115.22 107.87 3hfz n HIS 449 Ca 0.02 0.00 -0.46 0.00 -2.01 0.00 0.00 57.72 55.28 3hfz n HIS 449 Cb 0.31 -0.30 -0.04 0.00 0.12 0.00 0.00 29.99 30.08 3hfz n HIS 449 CO 0.00 0.00 0.00 1.03 -2.81 0.00 0.00 176.34 174.56 3hfz s ARG 450 N -2.60 3.31 0.43 -1.40 1.81 -0.92 -4.45 118.95 115.14 3hfz s ARG 450 Ca 0.21 -2.22 0.23 0.00 -1.72 0.00 0.00 55.73 52.23 3hfz s ARG 450 Cb 0.15 -4.32 0.38 0.00 -0.45 0.00 0.00 34.95 30.71 3hfz s ARG 450 CO 0.35 -1.29 1.62 -0.07 -0.68 0.00 0.00 175.30 175.24 3hfz h LEU 451 N 8.07 0.00 -0.24 2.53 3.38 -1.86 -3.15 115.31 124.04 3hfz h LEU 451 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3hfz h LEU 451 Cb 1.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.80 3hfz h LEU 451 CO 0.83 0.00 0.00 -2.24 0.09 0.00 0.00 178.44 177.12 3hfz h ASP 452 N 0.00 0.00 -2.47 -0.43 2.03 -1.88 -3.42 116.42 110.24 3hfz h ASP 452 Ca 0.00 0.00 -0.70 0.00 -0.73 0.00 0.00 57.03 55.60 3hfz h ASP 452 Cb 0.98 0.00 -0.18 0.00 -0.83 0.00 0.00 39.33 39.30 3hfz h ASP 452 CO 0.00 0.00 0.86 -0.76 -1.03 0.00 0.00 179.24 178.31 3hfz s LEU 453 N -5.20 5.17 -0.06 0.15 1.43 -1.19 -4.77 118.68 114.22 3hfz s LEU 453 Ca 0.08 -2.23 -0.03 0.00 -1.03 0.00 0.00 54.13 50.92 3hfz s LEU 453 Cb 0.09 -2.39 -0.03 0.00 0.03 0.00 0.00 46.19 43.90 3hfz s LEU 453 CO 0.59 -0.98 -0.07 0.54 0.23 0.00 0.00 176.35 176.65 3hfz n ARG 454 N 6.22 0.13 -2.51 1.70 5.12 -1.26 -4.80 116.66 121.26 3hfz n ARG 454 Ca 0.25 0.05 -0.24 0.00 -1.93 0.00 0.00 57.85 55.98 3hfz n ARG 454 Cb 0.48 -0.73 0.11 0.00 -1.16 0.00 0.00 32.46 31.16 3hfz n ARG 454 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 3hfz s LEU 455 N -6.27 2.95 0.08 0.55 1.43 -1.26 -4.80 118.68 111.37 3hfz s LEU 455 Ca -0.08 -0.28 -0.16 0.00 -1.03 0.00 0.00 54.13 52.58 3hfz s LEU 455 Cb 0.03 -2.05 -0.10 0.00 0.03 0.00 0.00 46.19 44.10 3hfz s LEU 455 CO 0.10 -1.93 1.41 -0.08 0.23 0.00 0.00 176.35 176.08 3hfz h GLU 456 N -0.63 0.61 -0.21 1.70 4.81 -1.96 -3.17 114.58 115.72 3hfz h GLU 456 Ca -0.37 -0.31 0.04 0.00 -0.13 0.00 0.00 59.36 58.59 3hfz h GLU 456 Cb 1.27 0.01 -0.07 0.00 0.63 0.00 0.00 28.75 30.58 3hfz h GLU 456 CO 0.41 0.91 -0.48 0.93 -0.73 0.00 0.00 179.01 180.05 3hfz h GLU 457 N 0.32 -0.47 -0.97 1.92 3.07 -1.95 0.30 114.58 116.81 3hfz h GLU 457 Ca 0.04 0.03 0.27 0.00 -0.50 0.00 0.00 59.36 59.21 3hfz h GLU 457 Cb 0.79 0.11 -0.05 0.00 -0.84 0.00 0.00 28.75 28.76 3hfz h GLU 457 CO 0.06 -0.31 0.68 -0.44 -1.40 0.00 0.00 179.01 177.60 3hfz h ASP 458 N -0.49 0.08 0.45 1.42 3.32 -1.90 0.86 116.42 120.16 3hfz h ASP 458 Ca 0.07 0.01 -0.20 0.00 0.02 0.00 0.00 57.03 56.94 3hfz h ASP 458 Cb 0.64 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.18 3hfz h ASP 458 CO -0.46 0.02 -0.84 0.25 -1.72 0.00 0.00 179.24 176.49 3hfz h LEU 459 N 0.07 0.36 -0.44 1.55 5.85 -0.48 -2.97 115.31 119.25 3hfz h LEU 459 Ca 0.47 -0.27 -0.17 0.00 0.84 0.00 0.00 57.88 58.75 3hfz h LEU 459 Cb 1.75 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 42.67 3hfz h LEU 459 CO -0.05 1.05 -0.55 -0.37 -0.34 0.00 0.00 178.44 178.19 3hfz h VAL 460 N 0.17 1.30 0.00 1.05 -1.51 0.26 -1.62 116.25 115.90 3hfz h VAL 460 Ca -0.05 -1.77 0.00 0.00 -1.23 0.00 0.00 66.70 63.66 3hfz h VAL 460 Cb 1.45 1.71 0.00 0.00 -2.13 0.00 0.00 31.29 32.32 3hfz h VAL 460 CO 0.14 0.56 0.00 1.21 -1.23 0.00 0.00 177.57 178.25 3hfz n GLU 461 N -3.98 0.03 0.09 5.19 2.13 -0.25 -0.89 120.64 122.96 3hfz n GLU 461 Ca -0.04 0.36 -0.15 0.00 0.66 0.00 0.00 57.16 58.00 3hfz n GLU 461 Cb 0.61 -1.57 -0.14 0.00 0.27 0.00 0.00 31.44 30.61 3hfz n GLU 461 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 3hfz h GLU 462 N 0.00 0.23 0.04 5.31 4.39 -1.13 -2.66 114.58 120.77 3hfz h GLU 462 Ca 0.00 -0.40 -0.00 0.00 0.34 0.00 0.00 59.36 59.30 3hfz h GLU 462 Cb 0.18 0.15 0.00 0.00 -0.10 0.00 0.00 28.75 28.98 3hfz h GLU 462 CO 0.00 1.16 -0.02 0.28 -1.16 0.00 0.00 179.01 179.27 3hfz h VAL 463 N 0.06 1.36 -0.58 3.13 2.07 -1.28 -3.20 116.25 117.80 3hfz h VAL 463 Ca -0.15 -1.45 0.06 0.00 0.82 0.00 0.00 66.70 65.98 3hfz h VAL 463 Cb 1.97 2.29 -0.09 0.00 -1.52 0.00 0.00 31.29 33.94 3hfz h VAL 463 CO 0.18 0.36 -0.50 0.00 0.02 0.00 0.00 177.57 177.63 3hfz h ALA 464 N 0.18 -0.62 0.00 1.67 0.00 -1.07 -0.87 119.26 118.55 3hfz h ALA 464 Ca -0.01 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3hfz h ALA 464 Cb 0.63 1.19 -0.00 0.00 0.00 0.00 0.00 17.79 19.60 3hfz h ALA 464 CO 0.01 -0.91 -0.06 0.07 0.00 0.00 0.00 179.25 178.35 3hfz h ARG 465 N -0.20 0.00 0.00 0.00 0.11 -1.60 0.13 114.38 112.82 3hfz h ARG 465 Ca 0.10 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.18 3hfz h ARG 465 Cb 0.45 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.53 3hfz h ARG 465 CO -0.65 0.06 -1.25 -0.89 0.10 0.00 0.00 179.97 177.34 3hfz n ILE 466 N -3.30 0.44 0.05 0.08 5.41 -0.75 -3.84 119.36 117.44 3hfz n ILE 466 Ca -0.01 -0.51 -0.22 0.00 1.00 0.00 0.00 62.75 63.00 3hfz n ILE 466 Cb 0.25 -0.22 -0.15 0.00 -0.71 0.00 0.00 39.64 38.81 3hfz n ILE 466 CO 0.00 0.00 0.00 1.56 0.00 0.00 0.00 176.55 178.11 3hfz h GLN 467 N 0.00 0.35 0.00 0.38 1.08 -1.00 -3.46 115.11 112.45 3hfz h GLN 467 Ca 0.00 -0.59 0.00 0.00 -1.45 0.00 0.00 58.65 56.61 3hfz h GLN 467 Cb 0.98 0.22 0.00 0.00 -0.05 0.00 0.00 27.48 28.63 3hfz h GLN 467 CO 0.00 1.28 0.00 0.41 -0.95 0.00 0.00 178.83 179.57 3hfz n GLY 468 N 1.84 3.68 0.25 3.46 0.00 0.43 -4.65 105.19 110.21 3hfz n GLY 468 Ca -0.25 -0.98 0.08 0.00 0.00 0.00 0.00 46.02 44.87 3hfz n GLY 468 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3hfz h TYR 469 N 0.00 0.00 0.00 1.61 -1.99 -1.83 0.19 116.97 114.95 3hfz h TYR 469 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 3hfz h TYR 469 Cb 0.00 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.73 3hfz h TYR 469 CO 0.00 0.07 0.00 1.05 -0.00 0.00 0.00 178.16 179.28 3hfz h GLU 470 N 0.00 0.00 -0.71 4.88 -0.00 -1.90 -2.59 114.58 114.26 3hfz h GLU 470 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.36 3hfz h GLU 470 Cb 0.14 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 28.89 3hfz h GLU 470 CO 0.01 0.00 0.00 0.25 -0.00 0.00 0.00 179.01 179.27 3hfz n THR 471 N -2.86 1.05 -3.53 -1.06 -2.24 0.65 -4.75 114.28 101.53 3hfz n THR 471 Ca 0.01 -0.58 -0.41 0.00 -2.27 0.00 0.00 64.05 60.80 3hfz n THR 471 Cb 0.26 -0.27 -0.11 0.00 -2.10 0.00 0.00 70.33 68.12 3hfz n THR 471 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3hfz s ILE 472 N -1.73 4.98 1.08 2.28 1.01 -0.98 -4.97 121.20 122.87 3hfz s ILE 472 Ca 0.24 -0.65 -0.16 0.00 0.00 0.00 0.00 60.65 60.08 3hfz s ILE 472 Cb 0.17 -3.73 0.13 0.00 0.01 0.00 0.00 42.46 39.04 3hfz s ILE 472 CO 0.09 -0.21 0.33 -0.81 0.00 0.00 0.00 174.94 174.33 3hfz n PRO 473 N 5.08 -1.42 -3.98 2.79 -0.04 -1.26 -5.02 135.00 131.15 3hfz n PRO 473 Ca -0.12 -0.39 -0.28 0.00 -0.04 0.00 0.00 63.50 62.68 3hfz n PRO 473 Cb 0.47 -1.85 -0.04 0.00 -0.04 0.00 0.00 33.50 32.04 3hfz n PRO 473 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3hfz s LEU 474 N -2.54 4.16 0.29 1.53 1.02 -1.26 -5.02 118.68 116.85 3hfz s LEU 474 Ca 0.59 0.10 -0.19 0.00 0.02 0.00 0.00 54.13 54.65 3hfz s LEU 474 Cb -0.17 -2.76 0.06 0.00 0.02 0.00 0.00 46.19 43.34 3hfz s LEU 474 CO 0.66 0.09 0.87 0.00 0.02 0.00 0.00 176.35 177.99 3hfz s ALA 475 N -1.66 -1.14 -0.10 4.21 0.00 -1.26 -5.16 121.76 116.65 3hfz s ALA 475 Ca 0.33 -0.48 -0.08 0.00 0.00 0.00 0.00 51.96 51.73 3hfz s ALA 475 Cb -0.11 0.72 0.03 0.00 0.00 0.00 0.00 23.12 23.75 3hfz s ALA 475 CO 0.26 -1.02 0.25 -0.51 0.00 0.00 0.00 175.76 174.75 3hfz s LEU 476 N -3.13 0.90 0.48 0.00 1.43 -1.26 -5.16 118.68 111.94 3hfz s LEU 476 Ca 0.16 0.52 -0.17 0.00 -1.03 0.00 0.00 54.13 53.61 3hfz s LEU 476 Cb -0.04 0.84 -0.08 0.00 0.03 0.00 0.00 46.19 46.94 3hfz s LEU 476 CO 0.08 -0.10 0.95 -2.16 0.23 0.00 0.00 176.35 175.34 3hfz s PRO 477 N 0.38 3.99 -0.06 1.29 0.04 -1.26 -5.08 135.00 134.29 3hfz s PRO 477 Ca -0.02 0.93 -0.01 0.00 0.04 0.00 0.00 61.00 61.93 3hfz s PRO 477 Cb -0.04 -2.18 0.03 0.00 0.04 0.00 0.00 34.50 32.35 3hfz s PRO 477 CO -0.02 -0.18 0.02 0.00 0.04 0.00 0.00 177.00 176.86 3hfz s ALA 478 N -2.49 0.55 -0.14 8.56 0.00 -1.26 -5.13 121.76 121.85 3hfz s ALA 478 Ca 0.59 -0.02 -0.30 0.00 0.00 0.00 0.00 51.96 52.22 3hfz s ALA 478 Cb -0.10 -0.70 0.12 0.00 0.00 0.00 0.00 23.12 22.45 3hfz s ALA 478 CO 0.27 -0.46 0.96 -0.59 0.00 0.00 0.00 175.76 175.95 3hfz s PHE 479 N 2.00 -0.40 -0.38 0.00 -0.12 -1.26 -5.11 117.98 112.72 3hfz s PHE 479 Ca 0.05 0.66 -0.27 0.00 -0.05 0.00 0.00 56.93 57.31 3hfz s PHE 479 Cb -0.12 0.45 0.02 0.00 -0.63 0.00 0.00 43.02 42.74 3hfz s PHE 479 CO -0.04 -0.38 1.02 -0.06 -0.05 0.00 0.00 175.22 175.71 3hfz s PHE 480 N -1.20 3.03 0.73 3.49 0.08 -1.26 -5.00 117.98 117.86 3hfz s PHE 480 Ca -0.02 0.86 -0.16 0.00 0.12 0.00 0.00 56.93 57.73 3hfz s PHE 480 Cb -0.00 -3.85 -0.01 0.00 -0.57 0.00 0.00 43.02 38.58 3hfz s PHE 480 CO 0.02 -0.92 0.76 -0.35 -0.10 0.00 0.00 175.22 174.63 3hfz n PRO 481 N 7.06 0.37 -2.45 0.24 -0.04 -1.26 -4.91 135.00 134.01 3hfz n PRO 481 Ca 0.10 0.17 -0.40 0.00 -0.04 0.00 0.00 63.50 63.33 3hfz n PRO 481 Cb 0.48 -2.04 -0.04 0.00 -0.04 0.00 0.00 33.50 31.86 3hfz n PRO 481 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3hfz s ALA 482 N -1.90 3.41 0.22 0.55 0.00 -1.26 -4.96 121.76 117.83 3hfz s ALA 482 Ca 0.69 0.92 -0.07 0.00 0.00 0.00 0.00 51.96 53.50 3hfz s ALA 482 Cb -0.34 -3.35 0.35 0.00 0.00 0.00 0.00 23.12 19.78 3hfz s ALA 482 CO 0.54 -0.21 1.25 -2.30 0.00 0.00 0.00 175.76 175.05 3hfz n PRO 483 N 1.37 -0.09 0.22 0.00 -0.02 -1.26 -1.21 135.00 134.02 3hfz n PRO 483 Ca -0.00 1.25 0.16 0.00 -2.02 0.00 0.00 63.50 62.88 3hfz n PRO 483 Cb 0.45 -1.87 0.74 0.00 -0.02 0.00 0.00 33.50 32.80 3hfz n PRO 483 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 3hfz h ASP 484 N 0.00 0.00 1.33 2.55 3.04 -2.04 -0.13 116.42 121.18 3hfz h ASP 484 Ca 0.37 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.16 3hfz h ASP 484 Cb 0.57 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.86 3hfz h ASP 484 CO -0.82 0.00 -0.01 0.59 -2.04 0.00 0.00 179.24 176.95 3hfz n ASN 485 N -2.64 0.59 -4.64 4.15 3.02 -0.35 -4.71 115.26 110.68 3hfz n ASN 485 Ca -0.00 0.54 -0.43 0.00 -0.03 0.00 0.00 54.58 54.66 3hfz n ASN 485 Cb 0.16 -0.69 -0.03 0.00 -0.61 0.00 0.00 39.78 38.61 3hfz n ASN 485 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 3hfz s ARG 486 N -3.07 3.90 0.00 3.52 3.52 -0.06 -2.48 118.95 124.28 3hfz s ARG 486 Ca 0.12 1.73 0.00 0.00 -0.13 0.00 0.00 55.73 57.45 3hfz s ARG 486 Cb 0.14 -4.00 0.00 0.00 -1.56 0.00 0.00 34.95 29.53 3hfz s ARG 486 CO 0.58 -1.17 0.00 0.41 -0.81 0.00 0.00 175.30 174.32 3hfz n GLY 487 N 4.47 0.38 0.10 8.12 0.00 -1.26 -4.92 105.19 112.08 3hfz n GLY 487 Ca 0.18 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.22 3hfz n GLY 487 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3hfz n VAL 488 N -2.00 0.32 0.53 1.61 0.31 -1.03 -0.92 118.33 117.15 3hfz n VAL 488 Ca 0.00 0.66 0.06 0.00 -0.01 0.00 0.00 64.34 65.05 3hfz n VAL 488 Cb 0.00 -1.66 0.04 0.00 -0.91 0.00 0.00 33.84 31.32 3hfz n VAL 488 CO 0.00 0.00 0.00 -1.84 -1.32 0.00 0.00 176.83 173.67 3hfz n GLU 489 N -1.59 0.97 -0.32 5.55 0.28 -1.26 -4.65 120.64 119.61 3hfz n GLU 489 Ca -0.00 -1.17 -0.05 0.00 -0.16 0.00 0.00 57.16 55.78 3hfz n GLU 489 Cb 0.51 -1.23 -0.00 0.00 1.43 0.00 0.00 31.44 32.15 3hfz n GLU 489 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3hfz h ALA 490 N 2.45 -0.09 -0.40 -1.84 0.00 -1.45 -1.56 119.26 116.37 3hfz h ALA 490 Ca 0.00 0.20 0.08 0.00 0.00 0.00 0.00 54.91 55.19 3hfz h ALA 490 Cb 0.51 1.03 -0.08 0.00 0.00 0.00 0.00 17.79 19.25 3hfz h ALA 490 CO 0.00 -0.73 -0.15 -1.35 0.00 0.00 0.00 179.25 177.02 3hfz h PRO 491 N -0.07 -0.07 -0.49 0.00 0.11 -1.83 0.27 132.00 129.91 3hfz h PRO 491 Ca 0.26 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.32 3hfz h PRO 491 Cb 0.56 0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.66 3hfz h PRO 491 CO -0.87 -0.05 0.05 -0.92 -0.21 0.00 0.00 178.00 176.00 3hfz h TYR 492 N -0.07 0.82 0.47 0.65 5.03 -1.63 -2.42 116.97 119.81 3hfz h TYR 492 Ca 0.19 -0.10 -0.02 0.00 2.58 0.00 0.00 58.73 61.39 3hfz h TYR 492 Cb 0.37 -0.23 0.00 0.00 1.55 0.00 0.00 36.73 38.42 3hfz h TYR 492 CO -0.40 0.73 -0.23 0.00 -1.32 0.00 0.00 178.16 176.95 3hfz h ARG 493 N 0.74 -0.61 -1.23 1.82 3.08 -0.88 -2.84 114.38 114.47 3hfz h ARG 493 Ca 0.15 0.04 0.41 0.00 0.07 0.00 0.00 59.98 60.66 3hfz h ARG 493 Cb 0.38 0.14 -0.11 0.00 0.08 0.00 0.00 29.97 30.45 3hfz h ARG 493 CO 0.01 -0.41 0.80 1.17 -1.07 0.00 0.00 179.97 180.47 3hfz n LYS 494 N -4.24 -0.03 0.05 0.04 4.81 0.91 0.70 118.16 120.40 3hfz n LYS 494 Ca -0.08 1.05 -0.11 0.00 -0.87 0.00 0.00 58.31 58.30 3hfz n LYS 494 Cb 0.25 -2.10 -0.08 0.00 0.02 0.00 0.00 35.03 33.13 3hfz n LYS 494 CO 0.00 0.00 0.00 1.49 1.17 0.00 0.00 177.40 180.06 3hfz h GLU 495 N 0.00 -0.19 -0.37 1.64 4.81 -1.34 -3.21 114.58 115.91 3hfz h GLU 495 Ca 0.75 0.01 0.07 0.00 -0.13 0.00 0.00 59.36 60.06 3hfz h GLU 495 Cb 2.49 0.04 -0.09 0.00 0.63 0.00 0.00 28.75 31.83 3hfz h GLU 495 CO -0.35 0.24 -0.42 1.96 -0.73 0.00 0.00 179.01 179.71 3hfz h GLN 496 N -0.86 -0.33 -1.03 1.92 7.50 0.52 0.11 115.11 122.93 3hfz h GLN 496 Ca -0.02 0.02 0.33 0.00 0.50 0.00 0.00 58.65 59.48 3hfz h GLN 496 Cb 0.53 0.07 -0.14 0.00 0.05 0.00 0.00 27.48 27.99 3hfz h GLN 496 CO 0.03 -0.22 0.60 0.00 -1.50 0.00 0.00 178.83 177.75 3hfz h ARG 497 N -0.34 0.29 -0.34 1.46 2.47 -1.54 0.82 114.38 117.20 3hfz h ARG 497 Ca 0.13 -0.02 -0.14 0.00 -1.26 0.00 0.00 59.98 58.69 3hfz h ARG 497 Cb 0.59 -0.07 -0.01 0.00 -1.65 0.00 0.00 29.97 28.83 3hfz h ARG 497 CO -0.55 0.19 -0.34 1.25 0.56 0.00 0.00 179.97 181.08 3hfz h LEU 498 N 0.30 0.90 -0.77 3.04 5.85 -0.87 0.40 115.31 124.16 3hfz h LEU 498 Ca 0.74 -0.47 -0.08 0.00 0.84 0.00 0.00 57.88 58.91 3hfz h LEU 498 Cb 1.76 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 42.51 3hfz h LEU 498 CO -0.57 1.18 0.07 0.03 -0.34 0.00 0.00 178.44 178.81 3hfz h ARG 499 N 0.63 1.01 0.56 1.25 3.08 0.21 -1.97 114.38 119.15 3hfz h ARG 499 Ca 0.05 -0.27 -0.03 0.00 0.07 0.00 0.00 59.98 59.81 3hfz h ARG 499 Cb 0.93 -0.12 0.01 0.00 0.08 0.00 0.00 29.97 30.87 3hfz h ARG 499 CO 0.09 0.95 -0.27 0.93 -1.07 0.00 0.00 179.97 180.59 3hfz h GLU 500 N 0.94 -0.73 -1.18 0.04 5.08 -0.04 0.20 114.58 118.90 3hfz h GLU 500 Ca 0.18 0.05 0.38 0.00 -1.00 0.00 0.00 59.36 58.97 3hfz h GLU 500 Cb 0.45 0.16 -0.13 0.00 0.50 0.00 0.00 28.75 29.74 3hfz h GLU 500 CO 0.02 -0.48 0.74 0.28 -1.00 0.00 0.00 179.01 178.56 3hfz h VAL 501 N -1.20 0.23 -0.23 3.13 2.07 -0.23 1.10 116.25 121.14 3hfz h VAL 501 Ca -0.08 -0.07 -0.21 0.00 0.82 0.00 0.00 66.70 67.17 3hfz h VAL 501 Cb 0.58 0.03 0.01 0.00 -1.52 0.00 0.00 31.29 30.38 3hfz h VAL 501 CO 0.13 0.03 -0.66 -0.07 0.02 0.00 0.00 177.57 177.02 3hfz h LEU 502 N 0.19 0.97 -1.27 2.57 3.38 -1.18 -1.26 115.31 118.71 3hfz h LEU 502 Ca 0.76 -0.58 -0.06 0.00 0.09 0.00 0.00 57.88 58.09 3hfz h LEU 502 Cb 2.15 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 42.61 3hfz h LEU 502 CO -0.45 1.38 -0.29 0.77 0.09 0.00 0.00 178.44 179.94 3hfz h SER 503 N 0.62 0.00 0.00 -0.43 4.64 0.43 -1.65 113.55 117.16 3hfz h SER 503 Ca -0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 3hfz h SER 503 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 3hfz h SER 503 CO 0.14 0.29 0.00 0.61 -0.87 0.00 0.00 176.83 177.00 3hfz n GLY 504 N -0.14 -0.54 0.18 -0.77 0.00 0.13 -4.07 105.19 99.97 3hfz n GLY 504 Ca -0.01 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.17 3hfz n GLY 504 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3hfz n LEU 505 N -1.91 0.13 0.00 0.99 0.00 -0.49 -4.58 117.00 111.14 3hfz n LEU 505 Ca 0.00 0.69 0.00 0.00 0.00 0.00 0.00 56.01 56.70 3hfz n LEU 505 Cb 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 43.42 43.08 3hfz n LEU 505 CO 0.00 -0.77 0.00 0.61 0.00 0.00 0.00 177.39 177.23 3hfz n GLY 506 N -1.17 -0.63 3.78 -3.96 0.00 -1.18 -5.11 105.19 96.92 3hfz n GLY 506 Ca 0.18 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 3hfz n GLY 506 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hfz s PHE 507 N 0.00 3.48 -0.15 1.61 0.40 -0.63 -4.82 117.98 117.87 3hfz s PHE 507 Ca 0.00 0.40 -0.23 0.00 -0.60 0.00 0.00 56.93 56.49 3hfz s PHE 507 Cb 0.00 -2.07 -0.02 0.00 0.51 0.00 0.00 43.02 41.44 3hfz s PHE 507 CO 0.00 0.46 0.73 -1.14 0.70 0.00 0.00 175.22 175.98 3hfz s GLN 508 N -0.19 4.31 0.41 0.44 2.00 0.35 -4.25 119.66 122.74 3hfz s GLN 508 Ca 0.11 0.86 -0.24 0.00 -2.00 0.00 0.00 55.36 54.08 3hfz s GLN 508 Cb -0.11 -3.54 -0.09 0.00 0.80 0.00 0.00 33.01 30.07 3hfz s GLN 508 CO 0.00 -0.19 1.09 -2.00 -0.50 0.00 0.00 175.29 173.69 3hfz s GLU 509 N 1.70 4.08 0.12 1.67 2.12 -1.26 -1.34 118.70 125.79 3hfz s GLU 509 Ca 0.35 1.62 0.04 0.00 0.36 0.00 0.00 54.97 57.34 3hfz s GLU 509 Cb -0.17 -2.56 -0.04 0.00 0.26 0.00 0.00 34.13 31.63 3hfz s GLU 509 CO 0.13 -0.23 -0.10 0.08 -0.54 0.00 0.00 175.26 174.60 3hfz s VAL 510 N -1.58 0.99 -0.21 3.70 1.01 -0.41 -4.88 120.40 119.01 3hfz s VAL 510 Ca 0.58 -1.86 -0.02 0.00 0.00 0.00 0.00 61.98 60.69 3hfz s VAL 510 Cb -0.25 -1.61 0.06 0.00 0.00 0.00 0.00 36.38 34.58 3hfz s VAL 510 CO 0.31 -0.69 0.01 -0.31 0.00 0.00 0.00 175.10 174.42 3hfz s TYR 511 N -2.99 1.52 0.10 5.22 1.51 -1.26 -4.49 117.35 116.96 3hfz s TYR 511 Ca 0.11 -1.19 0.04 0.00 -1.01 0.00 0.00 57.07 55.02 3hfz s TYR 511 Cb 0.01 -1.23 -0.04 0.00 -0.11 0.00 0.00 41.96 40.59 3hfz s TYR 511 CO -0.01 -0.67 0.09 0.99 -1.11 0.00 0.00 175.55 174.84 3hfz s THR 512 N 1.69 4.49 0.36 -0.71 2.01 -1.26 -5.09 115.64 117.13 3hfz s THR 512 Ca -0.03 -0.86 -0.27 0.00 0.31 0.00 0.00 61.69 60.84 3hfz s THR 512 Cb -0.18 -3.20 -0.09 0.00 0.01 0.00 0.00 72.50 69.04 3hfz s THR 512 CO -0.08 0.06 1.27 -0.31 -0.69 0.00 0.00 174.62 174.88 3hfz s TYR 513 N -1.48 3.01 0.44 4.92 2.02 -1.26 -4.92 117.35 120.09 3hfz s TYR 513 Ca 0.29 1.45 0.19 0.00 -0.37 0.00 0.00 57.07 58.63 3hfz s TYR 513 Cb -0.12 -3.61 1.17 0.00 -0.40 0.00 0.00 41.96 39.00 3hfz s TYR 513 CO 0.22 -1.78 2.03 0.77 -1.57 0.00 0.00 175.55 175.21 3hfz h SER 514 N 3.07 0.00 -4.07 2.29 0.02 -1.97 -3.45 113.55 109.44 3hfz h SER 514 Ca -0.49 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 59.93 3hfz h SER 514 Cb 1.23 0.00 0.11 0.00 0.14 0.00 0.00 62.40 63.89 3hfz h SER 514 CO 0.64 0.16 0.50 -0.36 -1.14 0.00 0.00 176.83 176.64 3hfz s PHE 515 N -4.50 2.42 0.29 3.45 0.08 -1.26 -1.74 117.98 116.72 3hfz s PHE 515 Ca -0.04 1.49 0.08 0.00 0.12 0.00 0.00 56.93 58.58 3hfz s PHE 515 Cb 0.15 -3.54 -0.06 0.00 -0.57 0.00 0.00 43.02 39.00 3hfz s PHE 515 CO 0.66 -2.29 -0.08 1.41 -0.10 0.00 0.00 175.22 174.81 3hfz s MET 516 N -3.15 1.60 -0.31 0.44 -2.45 0.90 -4.60 119.30 111.73 3hfz s MET 516 Ca 0.75 -1.80 -0.06 0.00 -1.25 0.00 0.00 55.69 53.33 3hfz s MET 516 Cb -0.33 -1.31 0.03 0.00 1.25 0.00 0.00 34.83 34.47 3hfz s MET 516 CO 0.37 0.09 0.07 0.34 1.05 0.00 0.00 175.02 176.94 3hfz s ASP 517 N -3.47 5.12 0.49 1.11 2.15 -0.77 -2.33 116.67 118.98 3hfz s ASP 517 Ca 0.30 -0.99 0.38 0.00 0.43 0.00 0.00 52.55 52.67 3hfz s ASP 517 Cb 0.02 -1.84 1.55 0.00 -0.30 0.00 0.00 42.92 42.35 3hfz s ASP 517 CO 0.13 -0.26 1.63 -0.65 -0.17 0.00 0.00 175.17 175.85 3hfz h PRO 518 N 8.18 0.05 0.00 4.34 0.11 -1.78 1.08 132.00 143.98 3hfz h PRO 518 Ca -0.27 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 3hfz h PRO 518 Cb 1.10 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.20 3hfz h PRO 518 CO 0.59 0.03 0.00 -1.91 -0.21 0.00 0.00 178.00 176.51 3hfz n GLU 519 N -4.37 0.10 0.07 1.05 4.07 -1.26 -2.81 120.64 117.48 3hfz n GLU 519 Ca 0.38 0.34 -0.08 0.00 -0.06 0.00 0.00 57.16 57.74 3hfz n GLU 519 Cb 1.60 -1.69 -0.12 0.00 -0.06 0.00 0.00 31.44 31.17 3hfz n GLU 519 CO 0.00 0.00 0.00 -0.44 -0.06 0.00 0.00 177.13 176.63 3hfz h ASP 520 N 0.00 0.05 -0.49 4.31 3.32 0.82 -2.61 116.42 121.82 3hfz h ASP 520 Ca 0.00 -0.05 0.14 0.00 0.02 0.00 0.00 57.03 57.14 3hfz h ASP 520 Cb 0.30 -0.02 -0.02 0.00 0.22 0.00 0.00 39.33 39.82 3hfz h ASP 520 CO 0.00 1.04 0.38 0.00 -1.72 0.00 0.00 179.24 178.94 3hfz h ALA 521 N 0.95 2.39 0.00 3.45 0.00 -1.64 0.31 119.26 124.72 3hfz h ALA 521 Ca -0.02 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 3hfz h ALA 521 Cb 1.79 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.62 3hfz h ALA 521 CO 0.14 -0.63 -0.04 -0.09 0.00 0.00 0.00 179.25 178.63 3hfz h ARG 522 N 0.00 0.00 0.35 0.00 2.43 -1.70 1.86 114.38 117.32 3hfz h ARG 522 Ca 0.23 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.40 3hfz h ARG 522 Cb 0.98 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.50 3hfz h ARG 522 CO -0.00 0.31 -0.51 0.00 -1.51 0.00 0.00 179.97 178.26 3hfz h ARG 523 N -1.00 -0.87 0.00 0.20 3.08 -0.88 -1.83 114.38 113.08 3hfz h ARG 523 Ca -0.01 0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.10 3hfz h ARG 523 Cb 0.34 0.20 0.00 0.00 0.08 0.00 0.00 29.97 30.59 3hfz h ARG 523 CO -0.00 -0.58 0.00 1.19 -1.07 0.00 0.00 179.97 179.51 3hfz n PHE 524 N -5.53 0.00 -2.85 3.04 3.72 0.98 -4.90 117.46 111.92 3hfz n PHE 524 Ca -0.11 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.22 3hfz n PHE 524 Cb 0.44 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 38.99 3hfz n PHE 524 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 3hfz n ARG 525 N -0.79 -2.66 -3.78 -1.08 1.74 -0.69 -4.23 116.66 105.18 3hfz n ARG 525 Ca 0.14 2.27 -0.13 0.00 -0.77 0.00 0.00 57.85 59.36 3hfz n ARG 525 Cb 0.06 -5.35 -0.10 0.00 -1.02 0.00 0.00 32.46 26.05 3hfz n ARG 525 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3hfz s LEU 526 N -2.29 0.97 0.24 0.55 1.43 0.63 -4.19 118.68 116.01 3hfz s LEU 526 Ca 0.18 0.23 -0.31 0.00 -1.03 0.00 0.00 54.13 53.19 3hfz s LEU 526 Cb -0.05 1.08 -0.12 0.00 0.03 0.00 0.00 46.19 47.13 3hfz s LEU 526 CO 0.77 -0.31 1.59 0.47 0.23 0.00 0.00 176.35 179.09 3hfz n ASP 527 N 1.90 3.53 -4.28 2.29 9.92 -1.26 -4.49 116.55 124.15 3hfz n ASP 527 Ca -0.19 1.11 -0.34 0.00 -0.53 0.00 0.00 54.79 54.85 3hfz n ASP 527 Cb 0.57 -1.52 0.10 0.00 -0.64 0.00 0.00 41.12 39.63 3hfz n ASP 527 CO 0.00 0.00 0.00 -0.81 0.13 0.00 0.00 177.20 176.52 3hfz n PRO 528 N 2.82 -0.36 -1.90 -0.24 -0.04 -1.26 -4.91 135.00 129.10 3hfz n PRO 528 Ca 0.13 -0.08 -0.42 0.00 -0.04 0.00 0.00 63.50 63.09 3hfz n PRO 528 Cb 0.34 -1.60 -0.03 0.00 -0.04 0.00 0.00 33.50 32.17 3hfz n PRO 528 CO 0.00 0.00 0.00 -2.14 -0.04 0.00 0.00 175.50 173.32 3hfz s PRO 529 N -3.16 4.20 0.00 0.54 0.02 -1.26 -4.92 135.00 130.42 3hfz s PRO 529 Ca 0.52 2.39 0.29 0.00 0.02 0.00 0.00 61.00 64.22 3hfz s PRO 529 Cb -0.18 -3.20 1.29 0.00 0.02 0.00 0.00 34.50 32.44 3hfz s PRO 529 CO 0.71 -0.64 1.93 0.54 -0.33 0.00 0.00 177.00 179.21 3hfz n ARG 530 N 4.16 0.23 -4.22 5.54 1.74 -1.26 -4.78 116.66 118.07 3hfz n ARG 530 Ca 0.14 -0.02 -0.17 0.00 -0.77 0.00 0.00 57.85 57.03 3hfz n ARG 530 Cb 0.38 -1.50 -0.14 0.00 -1.02 0.00 0.00 32.46 30.18 3hfz n ARG 530 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3hfz s LEU 531 N -2.79 2.05 0.34 0.55 1.43 -1.26 -5.00 118.68 114.00 3hfz s LEU 531 Ca 0.21 -0.19 0.06 0.00 -1.03 0.00 0.00 54.13 53.18 3hfz s LEU 531 Cb 0.19 -0.33 -0.03 0.00 0.03 0.00 0.00 46.19 46.05 3hfz s LEU 531 CO 0.51 0.05 0.22 -0.76 0.23 0.00 0.00 176.35 176.60 3hfz s LEU 532 N -0.37 1.77 -0.10 1.79 1.43 -1.26 -2.70 118.68 119.24 3hfz s LEU 532 Ca 0.01 -1.71 0.02 0.00 -1.03 0.00 0.00 54.13 51.42 3hfz s LEU 532 Cb -0.04 0.36 -0.01 0.00 0.03 0.00 0.00 46.19 46.53 3hfz s LEU 532 CO -0.00 -1.01 -0.17 -0.76 0.23 0.00 0.00 176.35 174.64 3hfz s LEU 533 N -3.42 2.53 0.00 1.79 1.02 -0.53 -4.94 118.68 115.13 3hfz s LEU 533 Ca 0.36 -0.37 0.27 0.00 0.02 0.00 0.00 54.13 54.40 3hfz s LEU 533 Cb 0.03 -1.54 1.55 0.00 0.02 0.00 0.00 46.19 46.25 3hfz s LEU 533 CO 0.23 0.20 1.95 0.18 0.02 0.00 0.00 176.35 178.93 3hfz n LEU 534 N 3.29 0.00 -2.72 1.79 4.77 -1.26 -3.98 117.00 118.89 3hfz n LEU 534 Ca -0.18 0.07 -0.08 0.00 -0.03 0.00 0.00 56.01 55.79 3hfz n LEU 534 Cb 0.53 -0.07 0.09 0.00 -2.33 0.00 0.00 43.42 41.64 3hfz n LEU 534 CO 0.29 -0.01 0.41 -0.46 -1.33 0.00 0.00 177.39 176.29 3hfz n ASN 535 N -1.07 -2.13 -4.48 -1.43 6.94 -1.26 -5.15 115.26 106.67 3hfz n ASN 535 Ca 0.19 -3.27 -0.29 0.00 -0.02 0.00 0.00 54.58 51.18 3hfz n ASN 535 Cb 0.12 1.69 0.24 0.00 -2.36 0.00 0.00 39.78 39.48 3hfz n ASN 535 CO 0.00 0.00 0.00 -0.81 -1.03 0.00 0.00 177.26 175.42 3hfz n PRO 536 N 0.21 -2.15 0.06 -0.53 -0.04 -1.26 -4.92 135.00 126.38 3hfz n PRO 536 Ca 0.03 -0.59 -0.08 0.00 -0.04 0.00 0.00 63.50 62.82 3hfz n PRO 536 Cb 0.73 -2.16 -0.12 0.00 -0.04 0.00 0.00 33.50 31.91 3hfz n PRO 536 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 3hfz h LEU 537 N -2.55 0.04 -7.31 1.53 3.38 -1.99 -3.47 115.31 104.94 3hfz h LEU 537 Ca -0.59 -0.04 0.04 0.00 0.09 0.00 0.00 57.88 57.39 3hfz h LEU 537 Cb 1.33 -0.01 -0.10 0.00 0.09 0.00 0.00 40.66 41.96 3hfz h LEU 537 CO 0.47 1.03 0.29 0.00 0.09 0.00 0.00 178.44 180.32 3hfz s ALA 538 N -2.71 -1.55 0.37 1.53 0.00 -1.26 -5.01 121.76 113.13 3hfz s ALA 538 Ca 0.01 0.34 0.04 0.00 0.00 0.00 0.00 51.96 52.35 3hfz s ALA 538 Cb 0.10 0.78 0.71 0.00 0.00 0.00 0.00 23.12 24.71 3hfz s ALA 538 CO 0.83 -0.85 2.00 -1.00 0.00 0.00 0.00 175.76 176.74 3hfz h PRO 539 N 2.00 0.75 0.00 0.00 0.13 -1.98 -0.80 132.00 132.10 3hfz h PRO 539 Ca -0.27 -0.05 -0.04 0.00 -0.87 0.00 0.00 66.00 64.77 3hfz h PRO 539 Cb 1.28 -0.17 -0.01 0.00 0.13 0.00 0.00 31.00 32.23 3hfz h PRO 539 CO 0.32 0.50 -0.18 0.93 -0.23 0.00 0.00 178.00 179.34 3hfz h GLU 540 N 0.77 0.00 -0.58 0.86 3.07 -1.96 -2.27 114.58 114.47 3hfz h GLU 540 Ca 0.24 0.00 -0.32 0.00 -0.50 0.00 0.00 59.36 58.78 3hfz h GLU 540 Cb 0.02 0.00 -0.19 0.00 -0.84 0.00 0.00 28.75 27.74 3hfz h GLU 540 CO -0.06 0.18 0.11 1.63 -1.40 0.00 0.00 179.01 179.46 3hfz n LYS 541 N -3.73 2.10 0.10 2.33 5.02 -0.35 -1.84 118.16 121.80 3hfz n LYS 541 Ca -0.02 -3.23 0.13 0.00 -2.02 0.00 0.00 58.31 53.18 3hfz n LYS 541 Cb 0.29 -1.97 0.35 0.00 -0.02 0.00 0.00 35.03 33.68 3hfz n LYS 541 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3hfz h ALA 542 N 1.15 0.92 -1.21 7.82 0.00 -0.92 -3.39 119.26 123.62 3hfz h ALA 542 Ca 0.36 0.00 -0.63 0.00 0.00 0.00 0.00 54.91 54.65 3hfz h ALA 542 Cb 1.88 0.00 -0.13 0.00 0.00 0.00 0.00 17.79 19.54 3hfz h ALA 542 CO 0.67 0.00 -0.56 0.00 0.00 0.00 0.00 179.25 179.36 3hfz s ALA 543 N -3.12 3.41 -0.22 0.00 0.00 -0.98 -1.45 121.76 119.41 3hfz s ALA 543 Ca 0.10 -1.48 -0.05 0.00 0.00 0.00 0.00 51.96 50.53 3hfz s ALA 543 Cb 0.12 0.22 -0.02 0.00 0.00 0.00 0.00 23.12 23.44 3hfz s ALA 543 CO 0.62 -0.12 0.00 -0.51 0.00 0.00 0.00 175.76 175.76 3hfz s LEU 544 N -3.74 3.21 0.30 0.00 1.43 -1.10 -0.07 118.68 118.71 3hfz s LEU 544 Ca 0.23 -0.25 -0.25 0.00 -1.03 0.00 0.00 54.13 52.83 3hfz s LEU 544 Cb 0.06 -1.83 -0.16 0.00 0.03 0.00 0.00 46.19 44.30 3hfz s LEU 544 CO 0.12 0.02 0.45 -2.11 0.23 0.00 0.00 176.35 175.06 3hfz n ARG 545 N 4.52 0.22 -0.02 1.70 1.85 -0.71 -4.67 116.66 119.55 3hfz n ARG 545 Ca -0.17 0.08 0.01 0.00 -1.00 0.00 0.00 57.85 56.76 3hfz n ARG 545 Cb 0.51 -1.16 -0.06 0.00 -1.05 0.00 0.00 32.46 30.70 3hfz n ARG 545 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 3hfz n THR 546 N -0.40 0.24 -4.29 8.89 -2.24 -1.26 -0.48 114.28 114.74 3hfz n THR 546 Ca 0.14 -0.25 -0.18 0.00 -2.27 0.00 0.00 64.05 61.49 3hfz n THR 546 Cb 0.32 -0.19 -0.14 0.00 -2.10 0.00 0.00 70.33 68.22 3hfz n THR 546 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 3hfz s HIS 547 N -2.40 0.80 0.09 4.78 3.76 -1.26 -4.64 115.29 116.41 3hfz s HIS 547 Ca -0.03 -0.22 -0.01 0.00 -0.15 0.00 0.00 55.06 54.65 3hfz s HIS 547 Cb 0.04 -0.50 -0.26 0.00 1.11 0.00 0.00 32.58 32.97 3hfz s HIS 547 CO 0.33 -0.01 1.17 1.25 -0.85 0.00 0.00 174.74 176.63 3hfz h LEU 548 N 5.59 0.28 -2.13 0.89 5.85 -1.96 -3.36 115.31 120.48 3hfz h LEU 548 Ca -0.32 -0.31 0.07 0.00 0.84 0.00 0.00 57.88 58.16 3hfz h LEU 548 Cb 1.18 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 42.11 3hfz h LEU 548 CO 0.48 1.24 0.21 2.19 -0.34 0.00 0.00 178.44 182.22 3hfz h PHE 549 N 0.05 0.00 -0.11 1.25 -5.15 -1.94 -2.75 116.94 108.29 3hfz h PHE 549 Ca -0.10 0.00 -0.16 0.00 -0.20 0.00 0.00 57.97 57.51 3hfz h PHE 549 Cb 1.91 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 38.07 3hfz h PHE 549 CO 0.04 0.00 -0.63 -1.35 -2.00 0.00 0.00 178.31 174.37 3hfz h PRO 550 N 0.00 0.40 -0.67 6.09 0.11 -2.01 -2.38 132.00 133.55 3hfz h PRO 550 Ca 0.11 -0.28 0.03 0.00 0.11 0.00 0.00 66.00 65.96 3hfz h PRO 550 Cb 0.53 0.05 -0.04 0.00 0.11 0.00 0.00 31.00 31.65 3hfz h PRO 550 CO -0.00 0.90 0.44 0.78 -0.21 0.00 0.00 178.00 179.91 3hfz h GLY 551 N 1.27 0.92 0.77 -0.55 0.00 -1.74 -0.41 103.07 103.32 3hfz h GLY 551 Ca -0.01 -0.32 -0.03 0.00 0.00 0.00 0.00 47.33 46.97 3hfz h GLY 551 CO 0.11 0.29 -0.25 1.41 0.00 0.00 0.00 176.54 178.10 3hfz h LEU 552 N 0.83 -0.59 -0.89 3.11 3.38 -1.55 -1.38 115.31 118.22 3hfz h LEU 552 Ca 0.26 -0.06 0.15 0.00 0.09 0.00 0.00 57.88 58.32 3hfz h LEU 552 Cb 0.02 0.15 -0.10 0.00 0.09 0.00 0.00 40.66 40.83 3hfz h LEU 552 CO -0.07 -0.27 0.48 0.58 0.09 0.00 0.00 178.44 179.26 3hfz h VAL 553 N -0.94 0.74 -0.70 1.22 2.07 -1.07 -1.05 116.25 116.53 3hfz h VAL 553 Ca -0.07 -0.23 -0.07 0.00 0.82 0.00 0.00 66.70 67.14 3hfz h VAL 553 Cb 0.61 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.36 3hfz h VAL 553 CO 0.12 0.12 0.15 0.03 0.02 0.00 0.00 177.57 178.01 3hfz h ARG 554 N 0.68 1.13 -0.31 1.57 3.08 -0.94 -2.56 114.38 117.03 3hfz h ARG 554 Ca 0.49 -0.28 -0.01 0.00 0.07 0.00 0.00 59.98 60.24 3hfz h ARG 554 Cb 0.68 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.58 3hfz h ARG 554 CO -0.36 1.00 0.15 -0.39 -1.07 0.00 0.00 179.97 179.31 3hfz h VAL 555 N 1.06 1.15 -0.76 2.04 -1.51 -0.06 -0.17 116.25 118.01 3hfz h VAL 555 Ca 0.22 -0.44 0.16 0.00 -1.23 0.00 0.00 66.70 65.41 3hfz h VAL 555 Cb 0.40 0.88 -0.14 0.00 -2.13 0.00 0.00 31.29 30.30 3hfz h VAL 555 CO 0.01 0.16 -0.11 0.25 -1.23 0.00 0.00 177.57 176.64 3hfz h LEU 556 N 0.37 -0.57 0.43 4.19 5.85 -1.10 0.68 115.31 125.16 3hfz h LEU 556 Ca 0.11 0.22 -0.02 0.00 0.84 0.00 0.00 57.88 59.02 3hfz h LEU 556 Cb 0.12 0.43 0.00 0.00 0.37 0.00 0.00 40.66 41.58 3hfz h LEU 556 CO -0.01 -0.23 -0.21 0.50 -0.34 0.00 0.00 178.44 178.15 3hfz h LYS 557 N 0.03 -0.56 -0.51 1.25 3.11 -1.03 -0.85 116.57 118.01 3hfz h LYS 557 Ca 0.39 0.04 0.15 0.00 -2.81 0.00 0.00 60.65 58.41 3hfz h LYS 557 Cb 0.63 0.13 -0.02 0.00 -1.00 0.00 0.00 32.23 31.97 3hfz h LYS 557 CO -0.74 -0.31 0.40 0.93 -2.81 0.00 0.00 179.45 176.92 3hfz h GLU 558 N -0.71 0.00 0.10 1.90 5.08 0.92 -1.90 114.58 119.96 3hfz h GLU 558 Ca -0.06 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.30 3hfz h GLU 558 Cb 0.51 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.76 3hfz h GLU 558 CO 0.10 0.00 -0.05 -0.91 -1.00 0.00 0.00 179.01 177.15 3hfz h ASN 559 N 0.00 -0.11 -0.05 1.42 2.35 0.51 -3.19 115.58 116.51 3hfz h ASN 559 Ca 0.24 0.00 0.01 0.00 -0.55 0.00 0.00 56.30 56.01 3hfz h ASN 559 Cb 1.04 0.03 -0.00 0.00 0.05 0.00 0.00 38.32 39.44 3hfz h ASN 559 CO -0.00 0.35 0.97 -0.07 -1.65 0.00 0.00 177.43 177.02 3hfz h LEU 560 N -0.99 0.00 0.00 1.61 3.38 -0.38 0.51 115.31 119.44 3hfz h LEU 560 Ca -0.01 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.72 3hfz h LEU 560 Cb 0.10 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.81 3hfz h LEU 560 CO 0.02 0.00 -1.90 0.47 0.09 0.00 0.00 178.44 177.13 3hfz n ASP 561 N -2.56 0.44 -0.06 -0.43 8.00 -0.93 -4.49 116.55 116.52 3hfz n ASP 561 Ca 0.01 0.20 -0.22 0.00 0.71 0.00 0.00 54.79 55.49 3hfz n ASP 561 Cb 0.99 0.66 -0.12 0.00 -0.02 0.00 0.00 41.12 42.63 3hfz n ASP 561 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 3hfz n LEU 562 N -2.78 2.31 -4.21 0.64 0.00 0.17 -4.96 117.00 108.16 3hfz n LEU 562 Ca -0.19 0.27 -0.15 0.00 0.00 0.00 0.00 56.01 55.94 3hfz n LEU 562 Cb 0.96 -1.01 -0.11 0.00 0.00 0.00 0.00 43.42 43.26 3hfz n LEU 562 CO 0.44 0.62 -0.42 -1.81 0.00 0.00 0.00 177.39 176.21 3hfz s ASP 563 N -6.97 1.68 -0.83 1.96 1.01 -0.49 -5.09 116.67 107.93 3hfz s ASP 563 Ca -0.28 -0.87 0.01 0.00 0.71 0.00 0.00 52.55 52.12 3hfz s ASP 563 Cb 0.07 -0.01 0.34 0.00 1.01 0.00 0.00 42.92 44.33 3hfz s ASP 563 CO 0.66 -0.26 1.64 0.54 0.21 0.00 0.00 175.17 177.96 3hfz n ARG 564 N 0.33 4.11 -1.59 8.23 3.00 -1.26 -3.33 116.66 126.16 3hfz n ARG 564 Ca -0.14 -4.39 -0.60 0.00 -0.01 0.00 0.00 57.85 52.71 3hfz n ARG 564 Cb 0.58 -2.35 -0.08 0.00 0.00 0.00 0.00 32.46 30.61 3hfz n ARG 564 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.63 175.33 3hfz n PRO 565 N -0.27 0.28 0.00 5.56 -0.02 -1.26 -4.78 135.00 134.51 3hfz n PRO 565 Ca 0.45 0.10 0.14 0.00 -2.02 0.00 0.00 63.50 62.17 3hfz n PRO 565 Cb 0.32 -1.64 0.64 0.00 -0.02 0.00 0.00 33.50 32.80 3hfz n PRO 565 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3hfz n GLU 566 N 2.50 0.56 -3.76 -0.52 1.02 -1.26 -4.91 120.64 114.28 3hfz n GLU 566 Ca 0.23 -0.15 -0.02 0.00 -0.02 0.00 0.00 57.16 57.20 3hfz n GLU 566 Cb 0.07 -1.50 -0.00 0.00 -0.02 0.00 0.00 31.44 29.99 3hfz n GLU 566 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 3hfz s ARG 567 N -2.54 0.97 -0.29 3.49 1.70 -1.26 -0.56 118.95 120.45 3hfz s ARG 567 Ca 0.28 -0.56 -0.27 0.00 -0.47 0.00 0.00 55.73 54.71 3hfz s ARG 567 Cb 0.20 0.31 0.19 0.00 -0.57 0.00 0.00 34.95 35.08 3hfz s ARG 567 CO 0.48 -0.45 1.40 0.00 -1.08 0.00 0.00 175.30 175.66 3hfz s ALA 568 N -2.76 -2.17 -0.41 7.88 0.00 -1.04 -4.87 121.76 118.38 3hfz s ALA 568 Ca 0.16 1.77 0.02 0.00 0.00 0.00 0.00 51.96 53.91 3hfz s ALA 568 Cb 0.00 -1.66 0.15 0.00 0.00 0.00 0.00 23.12 21.62 3hfz s ALA 568 CO 0.01 -0.16 0.28 -1.17 0.00 0.00 0.00 175.76 174.72 3hfz s LEU 569 N -0.43 1.71 0.79 0.00 2.96 -1.26 -3.27 118.68 119.18 3hfz s LEU 569 Ca 0.08 -2.71 -0.04 0.00 -0.22 0.00 0.00 54.13 51.24 3hfz s LEU 569 Cb -0.03 -0.61 0.16 0.00 0.50 0.00 0.00 46.19 46.20 3hfz s LEU 569 CO -0.12 -0.23 1.09 -0.76 -1.32 0.00 0.00 176.35 175.00 3hfz s LEU 570 N 0.39 2.90 -0.30 -0.68 1.43 -1.00 -0.49 118.68 120.93 3hfz s LEU 570 Ca 0.24 -0.32 -0.24 0.00 -1.03 0.00 0.00 54.13 52.78 3hfz s LEU 570 Cb -0.12 -1.88 0.18 0.00 0.03 0.00 0.00 46.19 44.40 3hfz s LEU 570 CO -0.08 -2.15 1.35 0.72 0.23 0.00 0.00 176.35 176.42 3hfz s PHE 571 N -3.34 -0.14 0.11 0.29 -0.71 -0.45 -3.54 117.98 110.20 3hfz s PHE 571 Ca 0.69 0.33 0.04 0.00 -1.04 0.00 0.00 56.93 56.95 3hfz s PHE 571 Cb -0.04 0.41 -0.04 0.00 -1.21 0.00 0.00 43.02 42.14 3hfz s PHE 571 CO 0.47 -0.07 -0.11 -2.00 -1.34 0.00 0.00 175.22 172.17 3hfz s GLU 572 N 0.21 0.91 -0.08 1.99 2.12 0.31 -1.29 118.70 122.87 3hfz s GLU 572 Ca 0.05 -1.20 -0.02 0.00 0.36 0.00 0.00 54.97 54.16 3hfz s GLU 572 Cb -0.05 -0.65 0.03 0.00 0.26 0.00 0.00 34.13 33.72 3hfz s GLU 572 CO -0.14 0.11 0.02 0.08 -0.54 0.00 0.00 175.26 174.79 3hfz s VAL 573 N -2.40 0.31 0.32 3.70 1.01 -1.26 -1.56 120.40 120.53 3hfz s VAL 573 Ca 0.07 0.08 -0.18 0.00 0.00 0.00 0.00 61.98 61.95 3hfz s VAL 573 Cb -0.03 -0.54 0.03 0.00 0.00 0.00 0.00 36.38 35.84 3hfz s VAL 573 CO 0.01 0.18 0.73 -0.83 0.00 0.00 0.00 175.10 175.19 3hfz s GLY 574 N 1.99 0.13 -0.07 4.51 0.00 -0.21 -4.98 107.32 108.69 3hfz s GLY 574 Ca 0.04 -0.51 -0.30 0.00 0.00 0.00 0.00 44.72 43.95 3hfz s GLY 574 CO -0.05 -0.21 1.03 0.50 0.00 0.00 0.00 173.10 174.37 3hfz s ARG 575 N -3.33 4.44 -0.05 2.90 3.00 -1.26 0.13 118.95 124.78 3hfz s ARG 575 Ca 0.13 1.45 0.04 0.00 0.00 0.00 0.00 55.73 57.35 3hfz s ARG 575 Cb -0.05 -3.52 -0.03 0.00 0.00 0.00 0.00 34.95 31.35 3hfz s ARG 575 CO 0.09 -0.28 -0.14 0.54 0.00 0.00 0.00 175.30 175.51 3hfz s VAL 576 N 1.82 3.08 -0.15 3.52 0.11 0.11 -4.93 120.40 123.95 3hfz s VAL 576 Ca 0.50 -0.73 -0.04 0.00 -2.93 0.00 0.00 61.98 58.78 3hfz s VAL 576 Cb -0.20 -2.21 -0.03 0.00 -1.53 0.00 0.00 36.38 32.41 3hfz s VAL 576 CO 0.21 0.58 -0.01 -0.36 -3.33 0.00 0.00 175.10 172.19 3hfz s PHE 577 N -0.74 3.10 0.00 1.54 0.40 0.37 -1.06 117.98 121.59 3hfz s PHE 577 Ca 0.12 -0.12 0.00 0.00 -0.60 0.00 0.00 56.93 56.33 3hfz s PHE 577 Cb -0.11 -1.95 0.00 0.00 0.51 0.00 0.00 43.02 41.47 3hfz s PHE 577 CO 0.01 0.11 0.00 2.89 0.70 0.00 0.00 175.22 178.92 3hfz n ARG 578 N 3.26 0.00 0.00 0.44 1.85 -1.26 -4.17 116.66 116.78 3hfz n ARG 578 Ca -0.17 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.68 3hfz n ARG 578 Cb 0.53 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.94 3hfz n ARG 578 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 3hfz n GLU 579 N 0.00 0.00 -3.85 2.89 1.02 -1.26 -4.72 120.64 114.72 3hfz n GLU 579 Ca 0.00 0.00 -0.09 0.00 -0.02 0.00 0.00 57.16 57.05 3hfz n GLU 579 Cb 0.00 0.00 -0.07 0.00 -0.02 0.00 0.00 31.44 31.35 3hfz n GLU 579 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 3hfz s ARG 580 N 0.00 0.84 -0.19 3.49 0.52 -1.26 -5.13 118.95 117.22 3hfz s ARG 580 Ca 0.00 -0.93 -0.20 0.00 -0.52 0.00 0.00 55.73 54.07 3hfz s ARG 580 Cb 0.00 0.34 -0.03 0.00 0.52 0.00 0.00 34.95 35.78 3hfz s ARG 580 CO 0.00 -0.27 0.61 -2.00 0.02 0.00 0.00 175.30 173.66 3hfz s GLU 581 N -3.78 4.23 0.06 3.54 2.12 -1.26 -4.61 118.70 118.99 3hfz s GLU 581 Ca 0.04 0.59 0.03 0.00 0.36 0.00 0.00 54.97 56.00 3hfz s GLU 581 Cb 0.04 -3.56 -0.03 0.00 0.26 0.00 0.00 34.13 30.85 3hfz s GLU 581 CO -0.11 -0.19 -0.10 -1.83 -0.54 0.00 0.00 175.26 172.50 3hfz s GLU 582 N 1.73 0.66 -0.07 4.30 -1.05 -0.22 -4.96 118.70 119.09 3hfz s GLU 582 Ca 0.28 -0.87 -0.26 0.00 -0.15 0.00 0.00 54.97 53.97 3hfz s GLU 582 Cb -0.16 -0.48 -0.03 0.00 -0.44 0.00 0.00 34.13 33.02 3hfz s GLU 582 CO 0.11 0.09 0.83 0.99 0.95 0.00 0.00 175.26 178.23 3hfz s THR 583 N -1.51 4.94 0.03 1.83 2.01 -1.26 0.07 115.64 121.75 3hfz s THR 583 Ca -0.05 1.71 0.09 0.00 0.31 0.00 0.00 61.69 63.74 3hfz s THR 583 Cb -0.09 -4.16 -0.03 0.00 0.01 0.00 0.00 72.50 68.23 3hfz s THR 583 CO 0.01 0.16 -0.25 -1.00 -0.69 0.00 0.00 174.62 172.85 3hfz s HIS 584 N 1.20 2.35 -0.05 4.92 3.76 0.12 -1.62 115.29 125.98 3hfz s HIS 584 Ca 0.43 -0.40 0.06 0.00 -0.15 0.00 0.00 55.06 55.00 3hfz s HIS 584 Cb -0.19 -1.43 -0.01 0.00 1.11 0.00 0.00 32.58 32.07 3hfz s HIS 584 CO 0.20 0.10 -0.24 -1.17 -0.85 0.00 0.00 174.74 172.78 3hfz s LEU 585 N -1.11 2.05 -0.11 0.89 2.96 -0.61 -1.04 118.68 121.70 3hfz s LEU 585 Ca 0.12 -0.48 -0.31 0.00 -0.22 0.00 0.00 54.13 53.24 3hfz s LEU 585 Cb -0.10 -1.30 0.12 0.00 0.50 0.00 0.00 46.19 45.41 3hfz s LEU 585 CO 0.02 0.25 1.03 0.00 -1.32 0.00 0.00 176.35 176.32 3hfz s ALA 586 N -0.24 -1.93 -0.20 5.97 0.00 -0.60 -0.70 121.76 124.05 3hfz s ALA 586 Ca -0.00 1.39 -0.28 0.00 0.00 0.00 0.00 51.96 53.07 3hfz s ALA 586 Cb -0.12 -0.17 0.10 0.00 0.00 0.00 0.00 23.12 22.92 3hfz s ALA 586 CO 0.02 -0.52 0.86 0.20 0.00 0.00 0.00 175.76 176.33 3hfz s GLY 587 N -1.90 -0.37 0.09 0.00 0.00 -1.14 0.11 107.32 104.11 3hfz s GLY 587 Ca 0.04 2.05 0.03 0.00 0.00 0.00 0.00 44.72 46.84 3hfz s GLY 587 CO -0.05 1.43 0.10 0.48 0.00 0.00 0.00 173.10 175.07 3hfz s LEU 588 N -0.37 3.88 0.00 0.66 2.34 -1.23 -2.79 118.68 121.18 3hfz s LEU 588 Ca -0.02 0.02 0.00 0.00 0.06 0.00 0.00 54.13 54.19 3hfz s LEU 588 Cb -0.03 -2.54 0.00 0.00 -0.56 0.00 0.00 46.19 43.06 3hfz s LEU 588 CO 0.01 0.16 0.00 -0.11 -1.06 0.00 0.00 176.35 175.35 3hfz n LEU 589 N 0.34 0.00 0.00 1.48 7.94 0.69 -2.37 117.00 125.08 3hfz n LEU 589 Ca -0.08 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.82 3hfz n LEU 589 Cb 0.52 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.47 3hfz n LEU 589 CO 0.45 0.00 0.00 0.33 -1.11 0.00 0.00 177.39 177.06 3hfz n PHE 590 N 0.00 0.00 0.00 1.96 7.35 -1.20 -4.48 117.46 121.09 3hfz n PHE 590 Ca 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 3hfz n PHE 590 Cb 0.00 0.00 0.00 0.00 0.35 0.00 0.00 39.48 39.83 3hfz n PHE 590 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3hfz n GLY 591 N -1.35 1.07 0.37 7.13 0.00 -1.26 -2.50 105.19 108.66 3hfz n GLY 591 Ca 0.00 -1.97 -0.07 0.00 0.00 0.00 0.00 46.02 43.97 3hfz n GLY 591 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 3hfz h GLU 592 N 0.00 -0.21 0.00 1.61 4.11 -1.23 -3.45 114.58 115.41 3hfz h GLU 592 Ca 0.00 0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.44 3hfz h GLU 592 Cb 0.00 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.30 3hfz h GLU 592 CO 0.00 -0.14 0.00 0.41 0.07 0.00 0.00 179.01 179.35 3hfz n GLY 593 N -1.42 0.71 2.93 1.06 0.00 -1.26 -4.64 105.19 102.57 3hfz n GLY 593 Ca 0.02 -1.59 -0.29 0.00 0.00 0.00 0.00 46.02 44.16 3hfz n GLY 593 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hfz s VAL 594 N -3.90 1.31 0.00 1.61 1.01 0.41 -4.93 120.40 115.91 3hfz s VAL 594 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 61.98 61.23 3hfz s VAL 594 Cb 0.00 -1.43 0.00 0.00 0.00 0.00 0.00 36.38 34.95 3hfz s VAL 594 CO 0.00 0.16 0.00 0.61 0.00 0.00 0.00 175.10 175.87 3hfz n GLY 595 N 4.81 2.26 3.58 4.51 0.00 -1.26 -1.17 105.19 117.91 3hfz n GLY 595 Ca -0.13 -0.32 -0.39 0.00 0.00 0.00 0.00 46.02 45.18 3hfz n GLY 595 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hfz s LEU 596 N 0.00 4.16 0.58 0.99 1.43 -1.26 -4.96 118.68 119.61 3hfz s LEU 596 Ca 0.00 -0.03 0.37 0.00 -1.03 0.00 0.00 54.13 53.44 3hfz s LEU 596 Cb 0.00 -2.23 1.33 0.00 0.03 0.00 0.00 46.19 45.32 3hfz s LEU 596 CO 0.00 -0.15 1.49 -0.65 0.23 0.00 0.00 176.35 177.27 3hfz h PRO 597 N 8.35 0.00 -0.01 1.29 0.11 -1.99 0.74 132.00 140.50 3hfz h PRO 597 Ca -0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 3hfz h PRO 597 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 3hfz h PRO 597 CO 0.60 0.00 -0.16 -2.67 -0.21 0.00 0.00 178.00 175.57 3hfz n TRP 598 N -3.62 0.00 -3.60 0.65 4.27 -1.26 -5.01 117.44 108.87 3hfz n TRP 598 Ca 0.30 0.00 -0.21 0.00 -3.89 0.00 0.00 57.50 53.71 3hfz n TRP 598 Cb 1.63 0.00 -0.03 0.00 -1.36 0.00 0.00 31.31 31.55 3hfz n TRP 598 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 3hfz s ALA 599 N -1.17 4.02 -0.20 -1.67 0.00 0.26 -5.08 121.76 117.92 3hfz s ALA 599 Ca 0.07 -1.82 -0.16 0.00 0.00 0.00 0.00 51.96 50.06 3hfz s ALA 599 Cb 0.07 -1.08 -0.08 0.00 0.00 0.00 0.00 23.12 22.03 3hfz s ALA 599 CO 0.20 -0.17 -0.24 0.36 0.00 0.00 0.00 175.76 175.91 3hfz n LYS 600 N -1.51 0.53 -1.31 0.00 0.00 -1.26 -4.60 118.16 110.00 3hfz n LYS 600 Ca 0.02 0.34 -0.51 0.00 -0.00 0.00 0.00 58.31 58.16 3hfz n LYS 600 Cb 0.61 -1.54 -0.07 0.00 -0.00 0.00 0.00 35.03 34.03 3hfz n LYS 600 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 3hfz n GLU 601 N -4.44 0.00 -4.09 -1.58 4.71 -1.26 -4.89 120.64 109.09 3hfz n GLU 601 Ca -0.25 0.00 -0.10 0.00 -0.01 0.00 0.00 57.16 56.80 3hfz n GLU 601 Cb 0.57 -1.22 -0.09 0.00 -1.01 0.00 0.00 31.44 29.69 3hfz n GLU 601 CO 0.00 0.00 0.00 0.50 0.09 0.00 0.00 177.13 177.72 3hfz s ARG 602 N 1.08 1.10 -0.05 3.49 3.52 -1.26 -4.16 118.95 122.66 3hfz s ARG 602 Ca 0.79 -1.39 0.05 0.00 -0.13 0.00 0.00 55.73 55.05 3hfz s ARG 602 Cb -1.12 0.31 -0.00 0.00 -1.56 0.00 0.00 34.95 32.57 3hfz s ARG 602 CO 0.55 -0.37 -0.20 -0.51 -0.81 0.00 0.00 175.30 173.97 3hfz s LEU 603 N -3.05 1.96 0.00 -0.88 1.43 -0.32 -4.95 118.68 112.88 3hfz s LEU 603 Ca 0.25 -0.42 0.00 0.00 -1.03 0.00 0.00 54.13 52.93 3hfz s LEU 603 Cb 0.06 -1.13 0.00 0.00 0.03 0.00 0.00 46.19 45.15 3hfz s LEU 603 CO 0.04 0.17 0.00 -1.54 0.23 0.00 0.00 176.35 175.26 3hfz n SER 604 N 3.16 0.00 0.00 2.29 3.41 -1.26 0.16 113.62 121.38 3hfz n SER 604 Ca -0.18 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.43 3hfz n SER 604 Cb 0.53 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.48 3hfz n SER 604 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hfz n GLY 605 N 0.00 0.98 0.00 5.00 0.00 -1.26 -2.65 105.19 107.25 3hfz n GLY 605 Ca 0.00 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.26 3hfz n GLY 605 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3hfz n TYR 606 N 0.00 0.00 -0.21 1.61 9.36 -1.26 -2.58 117.16 124.08 3hfz n TYR 606 Ca 0.00 0.00 0.31 0.00 3.32 0.00 0.00 57.90 61.53 3hfz n TYR 606 Cb 0.00 -0.41 0.72 0.00 -0.63 0.00 0.00 39.34 39.02 3hfz n TYR 606 CO 0.00 0.00 0.00 0.74 0.22 0.00 0.00 176.86 177.82 3hfz h PHE 607 N 0.00 0.00 0.70 2.98 0.04 -1.97 0.20 116.94 118.89 3hfz h PHE 607 Ca 0.00 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.74 3hfz h PHE 607 Cb 0.00 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.16 3hfz h PHE 607 CO -0.35 0.00 -0.34 1.25 -0.60 0.00 0.00 178.31 178.27 3hfz h LEU 608 N 0.00 -0.80 -1.94 1.54 5.85 -1.26 0.38 115.31 119.08 3hfz h LEU 608 Ca 0.47 0.03 0.01 0.00 0.84 0.00 0.00 57.88 59.23 3hfz h LEU 608 Cb 2.03 0.21 -0.00 0.00 0.37 0.00 0.00 40.66 43.26 3hfz h LEU 608 CO -0.00 -0.54 0.07 0.25 -0.34 0.00 0.00 178.44 177.87 3hfz h LEU 609 N -1.00 0.07 -0.90 2.25 6.46 -1.04 0.11 115.31 121.26 3hfz h LEU 609 Ca -0.10 -0.00 -0.11 0.00 -0.12 0.00 0.00 57.88 57.56 3hfz h LEU 609 Cb 0.72 -0.02 -0.01 0.00 -0.73 0.00 0.00 40.66 40.62 3hfz h LEU 609 CO 0.16 0.05 -0.33 0.50 -0.62 0.00 0.00 178.44 178.20 3hfz h LYS 610 N 0.09 0.41 0.06 1.25 1.63 -0.39 -2.11 116.57 117.51 3hfz h LYS 610 Ca 0.04 -0.17 -0.00 0.00 -0.85 0.00 0.00 60.65 59.66 3hfz h LYS 610 Cb 0.06 -0.01 0.00 0.00 -0.60 0.00 0.00 32.23 31.67 3hfz h LYS 610 CO -0.01 0.69 -0.03 0.78 -3.45 0.00 0.00 179.45 177.44 3hfz h GLY 611 N 1.09 -0.08 -0.67 5.01 0.00 0.17 -2.67 103.07 105.92 3hfz h GLY 611 Ca 0.04 0.03 0.21 0.00 0.00 0.00 0.00 47.33 47.61 3hfz h GLY 611 CO 0.06 -0.03 -0.04 -0.97 0.00 0.00 0.00 176.54 175.56 3hfz h TYR 612 N -0.79 -0.15 -0.68 5.60 0.05 -0.84 0.22 116.97 120.38 3hfz h TYR 612 Ca -0.01 0.07 -0.08 0.00 0.05 0.00 0.00 58.73 58.76 3hfz h TYR 612 Cb 0.63 0.20 -0.03 0.00 1.01 0.00 0.00 36.73 38.55 3hfz h TYR 612 CO 0.14 -0.34 0.13 -0.07 -1.05 0.00 0.00 178.16 176.97 3hfz h LEU 613 N 0.05 1.06 -1.30 3.88 3.38 -1.40 -1.30 115.31 119.68 3hfz h LEU 613 Ca 0.48 -0.24 -0.01 0.00 0.09 0.00 0.00 57.88 58.20 3hfz h LEU 613 Cb 0.88 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.32 3hfz h LEU 613 CO -0.81 1.04 0.30 -0.33 0.09 0.00 0.00 178.44 178.73 3hfz h GLU 614 N 1.04 0.78 0.00 1.13 5.08 -0.27 -1.30 114.58 121.04 3hfz h GLU 614 Ca 0.21 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 3hfz h GLU 614 Cb 0.42 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.51 3hfz h GLU 614 CO 0.01 0.58 0.00 0.00 -1.00 0.00 0.00 179.01 178.60 3hfz n ALA 615 N -2.45 -0.35 -0.33 3.43 0.00 -0.27 -0.43 120.51 120.10 3hfz n ALA 615 Ca 0.05 0.00 0.27 0.00 0.00 0.00 0.00 53.44 53.77 3hfz n ALA 615 Cb 0.10 0.00 0.45 0.00 0.00 0.00 0.00 19.45 20.00 3hfz n ALA 615 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3hfz n LEU 616 N -1.71 0.10 -0.07 0.00 7.94 -0.54 0.83 117.00 123.56 3hfz n LEU 616 Ca 0.00 0.83 -0.18 0.00 -1.11 0.00 0.00 56.01 55.55 3hfz n LEU 616 Cb 0.00 -0.41 -0.13 0.00 0.53 0.00 0.00 43.42 43.42 3hfz n LEU 616 CO 0.00 -0.89 -0.03 -0.26 -1.11 0.00 0.00 177.39 175.10 3hfz h PHE 617 N 0.00 0.05 -1.02 1.96 0.04 -1.02 -2.21 116.94 114.74 3hfz h PHE 617 Ca 0.57 -0.04 0.25 0.00 2.80 0.00 0.00 57.97 61.56 3hfz h PHE 617 Cb 1.94 -0.00 -0.11 0.00 2.20 0.00 0.00 35.95 39.97 3hfz h PHE 617 CO -0.00 1.24 0.62 0.00 -0.60 0.00 0.00 178.31 179.57 3hfz h ALA 618 N -0.19 1.94 -0.56 2.45 0.00 0.32 1.43 119.26 124.66 3hfz h ALA 618 Ca -0.16 0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.76 3hfz h ALA 618 Cb 1.19 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 3hfz h ALA 618 CO -0.07 -0.40 -0.02 -0.09 0.00 0.00 0.00 179.25 178.67 3hfz h ARG 619 N 0.52 0.98 -0.00 0.00 1.12 -0.77 -2.09 114.38 114.13 3hfz h ARG 619 Ca 0.63 -0.31 0.00 0.00 -1.11 0.00 0.00 59.98 59.19 3hfz h ARG 619 Cb 1.33 -0.09 0.00 0.00 -0.01 0.00 0.00 29.97 31.19 3hfz h ARG 619 CO -0.41 0.97 -0.11 1.28 -3.11 0.00 0.00 179.97 178.59 3hfz n LEU 620 N -4.18 0.12 -1.25 3.80 4.77 0.31 -4.92 117.00 115.65 3hfz n LEU 620 Ca 0.03 0.38 -0.09 0.00 -0.03 0.00 0.00 56.01 56.30 3hfz n LEU 620 Cb 0.34 -0.43 0.01 0.00 -2.33 0.00 0.00 43.42 41.01 3hfz n LEU 620 CO 0.44 0.03 -0.03 0.61 -1.33 0.00 0.00 177.39 177.11 3hfz n GLY 621 N 1.49 0.16 3.38 -0.72 0.00 0.41 -4.99 105.19 104.92 3hfz n GLY 621 Ca 0.07 -0.45 -0.33 0.00 0.00 0.00 0.00 46.02 45.32 3hfz n GLY 621 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hfz s LEU 622 N -2.82 2.57 0.76 0.99 1.43 -0.92 -4.88 118.68 115.81 3hfz s LEU 622 Ca 0.09 -0.33 -0.15 0.00 -1.03 0.00 0.00 54.13 52.71 3hfz s LEU 622 Cb -0.04 -1.54 0.04 0.00 0.03 0.00 0.00 46.19 44.68 3hfz s LEU 622 CO 0.11 0.24 1.05 0.00 0.23 0.00 0.00 176.35 177.98 3hfz n ALA 623 N 3.01 -0.20 -3.53 4.21 0.00 -1.26 -4.37 120.51 118.35 3hfz n ALA 623 Ca -0.18 -0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.01 3hfz n ALA 623 Cb 0.52 -2.16 -0.04 0.00 0.00 0.00 0.00 19.45 17.77 3hfz n ALA 623 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 3hfz s PHE 624 N -1.94 -1.03 0.13 0.00 5.36 -1.25 -2.01 117.98 117.23 3hfz s PHE 624 Ca 0.73 1.79 0.04 0.00 -0.96 0.00 0.00 56.93 58.52 3hfz s PHE 624 Cb -0.32 0.62 -0.04 0.00 -0.34 0.00 0.00 43.02 42.94 3hfz s PHE 624 CO 0.51 -0.51 -0.09 0.50 -1.46 0.00 0.00 175.22 174.17 3hfz s ARG 625 N 2.68 0.97 -0.29 10.12 3.52 -0.86 -5.00 118.95 130.08 3hfz s ARG 625 Ca -0.04 -1.40 -0.03 0.00 -0.13 0.00 0.00 55.73 54.13 3hfz s ARG 625 Cb -0.09 -0.48 0.10 0.00 -1.56 0.00 0.00 34.95 32.92 3hfz s ARG 625 CO -0.18 0.04 0.12 0.08 -0.81 0.00 0.00 175.30 174.55 3hfz s VAL 626 N -3.38 0.25 0.09 7.11 1.01 -1.26 -1.32 120.40 122.90 3hfz s VAL 626 Ca 0.14 -0.95 -0.18 0.00 0.00 0.00 0.00 61.98 60.99 3hfz s VAL 626 Cb 0.03 -1.20 -0.07 0.00 0.00 0.00 0.00 36.38 35.15 3hfz s VAL 626 CO -0.01 -0.69 0.57 -1.61 0.00 0.00 0.00 175.10 173.35 3hfz s GLU 627 N 1.94 4.16 0.44 2.72 2.02 -1.19 -4.85 118.70 123.94 3hfz s GLU 627 Ca 0.09 0.69 -0.24 0.00 0.02 0.00 0.00 54.97 55.53 3hfz s GLU 627 Cb -0.16 -3.17 -0.08 0.00 0.10 0.00 0.00 34.13 30.82 3hfz s GLU 627 CO -0.32 0.60 1.24 0.00 0.02 0.00 0.00 175.26 176.80 3hfz s ALA 628 N -1.19 3.08 -0.30 5.21 0.00 -1.26 0.00 121.76 127.31 3hfz s ALA 628 Ca 0.31 1.09 -0.16 0.00 0.00 0.00 0.00 51.96 53.21 3hfz s ALA 628 Cb -0.19 -3.44 0.16 0.00 0.00 0.00 0.00 23.12 19.65 3hfz s ALA 628 CO 0.19 -0.79 1.02 -1.14 0.00 0.00 0.00 175.76 175.04 3hfz s GLN 629 N -2.50 0.30 0.85 0.00 0.74 -1.18 -4.72 119.66 113.14 3hfz s GLN 629 Ca 0.61 0.63 -0.11 0.00 0.05 0.00 0.00 55.36 56.55 3hfz s GLN 629 Cb -0.34 0.26 0.10 0.00 1.10 0.00 0.00 33.01 34.13 3hfz s GLN 629 CO 0.42 -0.08 1.13 0.00 -0.55 0.00 0.00 175.29 176.20 3hfz s ALA 630 N 1.93 1.82 -0.16 1.58 0.00 -1.26 -3.34 121.76 122.33 3hfz s ALA 630 Ca -0.05 0.48 -0.12 0.00 0.00 0.00 0.00 51.96 52.27 3hfz s ALA 630 Cb -0.05 -3.38 0.05 0.00 0.00 0.00 0.00 23.12 19.74 3hfz s ALA 630 CO -0.16 -2.31 0.40 -0.06 0.00 0.00 0.00 175.76 173.63 3hfz s PHE 631 N -2.72 -0.50 0.16 0.00 0.08 -1.26 -4.97 117.98 108.77 3hfz s PHE 631 Ca 0.65 1.15 -0.23 0.00 0.12 0.00 0.00 56.93 58.61 3hfz s PHE 631 Cb -0.21 0.19 0.06 0.00 -0.57 0.00 0.00 43.02 42.49 3hfz s PHE 631 CO 0.56 -0.27 1.59 -1.35 -0.10 0.00 0.00 175.22 175.66 3hfz h PRO 632 N 6.23 -0.25 0.00 0.24 0.11 -1.95 -2.51 132.00 133.87 3hfz h PRO 632 Ca -0.31 0.02 -0.09 0.00 0.11 0.00 0.00 66.00 65.73 3hfz h PRO 632 Cb 1.18 0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 3hfz h PRO 632 CO 0.28 -0.16 -0.41 0.27 -0.21 0.00 0.00 178.00 177.76 3hfz h PHE 633 N -0.26 0.00 -3.39 0.65 -5.15 -1.73 -3.46 116.94 103.60 3hfz h PHE 633 Ca 0.17 0.00 -0.31 0.00 -0.20 0.00 0.00 57.97 57.64 3hfz h PHE 633 Cb 0.55 0.00 0.12 0.00 0.22 0.00 0.00 35.95 36.84 3hfz h PHE 633 CO -0.55 0.41 0.29 1.28 -2.00 0.00 0.00 178.31 177.73 3hfz n LEU 634 N -3.69 0.00 -4.89 2.10 4.77 -0.94 -1.81 117.00 112.53 3hfz n LEU 634 Ca -0.01 -1.06 -0.29 0.00 -0.03 0.00 0.00 56.01 54.62 3hfz n LEU 634 Cb 0.50 -0.70 -0.03 0.00 -2.33 0.00 0.00 43.42 40.85 3hfz n LEU 634 CO 0.38 -1.15 0.30 -2.28 -1.33 0.00 0.00 177.39 173.31 3hfz s HIS 635 N -3.00 3.47 -0.06 -1.77 5.65 0.80 -3.76 115.29 116.62 3hfz s HIS 635 Ca 0.53 0.81 -0.25 0.00 0.25 0.00 0.00 55.06 56.41 3hfz s HIS 635 Cb -0.01 -2.25 -0.25 0.00 -1.18 0.00 0.00 32.58 28.88 3hfz s HIS 635 CO 0.37 0.06 0.96 -1.35 -0.65 0.00 0.00 174.74 174.13 3hfz h PRO 636 N 1.51 0.18 -0.20 2.88 0.11 -1.90 -3.31 132.00 131.28 3hfz h PRO 636 Ca -0.47 -0.22 -0.14 0.00 0.11 0.00 0.00 66.00 65.27 3hfz h PRO 636 Cb 1.19 0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.36 3hfz h PRO 636 CO 0.65 1.00 -0.48 0.78 -0.21 0.00 0.00 178.00 179.74 3hfz h GLY 637 N -0.55 0.56 -7.40 -0.55 0.00 -1.98 -3.37 103.07 89.79 3hfz h GLY 637 Ca -0.05 -0.60 -0.68 0.00 0.00 0.00 0.00 47.33 46.00 3hfz h GLY 637 CO 0.06 0.54 -0.32 0.14 0.00 0.00 0.00 176.54 176.96 3hfz s VAL 638 N -4.10 3.73 -0.22 4.60 1.01 -1.25 -5.04 120.40 119.12 3hfz s VAL 638 Ca -0.07 -3.49 -0.27 0.00 0.00 0.00 0.00 61.98 58.15 3hfz s VAL 638 Cb 0.12 -3.39 0.11 0.00 0.00 0.00 0.00 36.38 33.22 3hfz s VAL 638 CO 0.82 -0.96 0.94 -0.55 0.00 0.00 0.00 175.10 175.35 3hfz s SER 639 N 0.01 -0.49 0.12 3.32 0.15 -1.24 -2.44 113.70 113.11 3hfz s SER 639 Ca 0.22 0.82 -0.25 0.00 0.70 0.00 0.00 55.95 57.43 3hfz s SER 639 Cb -0.14 0.78 0.08 0.00 -1.71 0.00 0.00 66.02 65.03 3hfz s SER 639 CO -0.08 -0.26 1.11 -0.83 1.20 0.00 0.00 173.24 174.38 3hfz s GLY 640 N -0.24 -0.04 0.36 9.45 0.00 -1.04 -3.11 107.32 112.70 3hfz s GLY 640 Ca -0.00 -0.09 0.07 0.00 0.00 0.00 0.00 44.72 44.70 3hfz s GLY 640 CO -0.01 2.59 0.37 1.09 0.00 0.00 0.00 173.10 177.13 3hfz s ARG 641 N -2.30 2.76 -0.05 2.90 1.70 0.10 -1.92 118.95 122.15 3hfz s ARG 641 Ca 0.22 -1.29 -0.05 0.00 -0.47 0.00 0.00 55.73 54.13 3hfz s ARG 641 Cb -0.01 -2.54 -0.04 0.00 -0.57 0.00 0.00 34.95 31.79 3hfz s ARG 641 CO 0.03 -0.01 0.18 0.08 -1.08 0.00 0.00 175.30 174.50 3hfz s VAL 642 N -2.32 5.44 -0.37 4.99 1.01 0.19 -3.15 120.40 126.19 3hfz s VAL 642 Ca 0.44 0.04 0.00 0.00 0.00 0.00 0.00 61.98 62.47 3hfz s VAL 642 Cb -0.06 -3.49 0.14 0.00 0.00 0.00 0.00 36.38 32.97 3hfz s VAL 642 CO 0.28 0.45 0.22 -0.76 0.00 0.00 0.00 175.10 175.29 3hfz s LEU 643 N -1.54 1.33 -0.41 3.92 2.01 -0.43 -2.63 118.68 120.92 3hfz s LEU 643 Ca 0.22 -2.28 -0.22 0.00 0.01 0.00 0.00 54.13 51.87 3hfz s LEU 643 Cb -0.13 -0.53 0.02 0.00 0.01 0.00 0.00 46.19 45.56 3hfz s LEU 643 CO 0.12 -0.30 0.71 -0.69 1.01 0.00 0.00 176.35 177.20 3hfz s VAL 644 N 0.92 4.77 -0.91 -1.59 1.01 -0.95 -2.04 120.40 121.61 3hfz s VAL 644 Ca 0.18 0.43 0.00 0.00 0.00 0.00 0.00 61.98 62.59 3hfz s VAL 644 Cb -0.23 -4.22 0.00 0.00 0.00 0.00 0.00 36.38 31.93 3hfz s VAL 644 CO 0.01 -0.55 0.00 -0.62 0.00 0.00 0.00 175.10 173.94 3hfz n GLU 645 N 6.39 -0.80 -0.87 2.72 -0.58 -0.85 -3.09 120.64 123.55 3hfz n GLU 645 Ca 0.00 0.56 0.00 0.00 -0.42 0.00 0.00 57.16 57.30 3hfz n GLU 645 Cb 0.48 -4.61 0.00 0.00 -0.57 0.00 0.00 31.44 26.75 3hfz n GLU 645 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3hfz n GLY 646 N -1.13 0.53 2.87 0.62 0.00 -1.26 -5.01 105.19 101.81 3hfz n GLY 646 Ca -0.12 -0.34 -0.18 0.00 0.00 0.00 0.00 46.02 45.38 3hfz n GLY 646 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3hfz s GLU 647 N -0.71 0.49 0.35 1.61 -1.05 -1.18 -5.09 118.70 113.12 3hfz s GLU 647 Ca 0.00 -0.03 -0.29 0.00 -0.15 0.00 0.00 54.97 54.50 3hfz s GLU 647 Cb 0.00 -0.57 -0.11 0.00 -0.44 0.00 0.00 34.13 33.01 3hfz s GLU 647 CO 0.00 -0.07 1.46 -2.00 0.95 0.00 0.00 175.26 175.60 3hfz s GLU 648 N 0.76 4.17 0.00 -4.83 2.12 -1.26 -2.23 118.70 117.43 3hfz s GLU 648 Ca -0.09 2.49 0.00 0.00 0.36 0.00 0.00 54.97 57.73 3hfz s GLU 648 Cb -0.12 -3.00 0.00 0.00 0.26 0.00 0.00 34.13 31.27 3hfz s GLU 648 CO -0.01 -0.47 0.17 1.33 -0.54 0.00 0.00 175.26 175.74 3hfz n VAL 649 N 0.87 0.00 -3.74 3.70 0.24 -1.08 -4.93 118.33 113.39 3hfz n VAL 649 Ca 0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.32 3hfz n VAL 649 Cb 0.40 1.08 0.00 0.00 -1.47 0.00 0.00 33.84 33.85 3hfz n VAL 649 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3hfz n GLY 650 N 0.00 -1.03 3.34 7.63 0.00 -1.26 -1.56 105.19 112.31 3hfz n GLY 650 Ca 0.00 -1.07 -0.17 0.00 0.00 0.00 0.00 46.02 44.78 3hfz n GLY 650 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3hfz s PHE 651 N -3.00 1.60 -0.11 1.61 -0.12 -0.42 0.57 117.98 118.10 3hfz s PHE 651 Ca 0.00 -0.85 -0.07 0.00 -0.05 0.00 0.00 56.93 55.96 3hfz s PHE 651 Cb 0.00 -0.90 0.04 0.00 -0.63 0.00 0.00 43.02 41.53 3hfz s PHE 651 CO 0.00 0.05 0.28 -1.17 -0.05 0.00 0.00 175.22 174.32 3hfz s LEU 652 N -3.31 0.55 0.00 -1.99 2.96 -0.81 -1.46 118.68 114.62 3hfz s LEU 652 Ca 0.27 0.58 0.00 0.00 -0.22 0.00 0.00 54.13 54.76 3hfz s LEU 652 Cb 0.05 0.89 0.00 0.00 0.50 0.00 0.00 46.19 47.62 3hfz s LEU 652 CO 0.08 -0.14 0.00 0.61 -1.32 0.00 0.00 176.35 175.58 3hfz n GLY 653 N 3.75 -0.77 3.82 7.98 0.00 0.36 -2.49 105.19 117.83 3hfz n GLY 653 Ca -0.20 -1.17 -0.36 0.00 0.00 0.00 0.00 46.02 44.29 3hfz n GLY 653 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hfz s ALA 654 N -2.00 3.36 1.19 4.61 0.00 -1.02 -0.49 121.76 127.41 3hfz s ALA 654 Ca 0.00 0.20 -0.13 0.00 0.00 0.00 0.00 51.96 52.03 3hfz s ALA 654 Cb 0.00 -2.87 0.29 0.00 0.00 0.00 0.00 23.12 20.54 3hfz s ALA 654 CO 0.00 0.30 0.99 -0.11 0.00 0.00 0.00 175.76 176.94 3hfz n LEU 655 N 0.50 -1.59 -4.69 0.00 7.94 -0.92 -0.14 117.00 118.10 3hfz n LEU 655 Ca -0.01 -0.18 -0.40 0.00 -1.11 0.00 0.00 56.01 54.31 3hfz n LEU 655 Cb 0.51 -1.25 -0.05 0.00 0.53 0.00 0.00 43.42 43.17 3hfz n LEU 655 CO 0.43 -3.32 0.42 -2.28 -1.11 0.00 0.00 177.39 171.53 3hfz s HIS 656 N -2.39 3.49 0.12 1.96 5.04 -0.75 -3.46 115.29 119.29 3hfz s HIS 656 Ca 0.68 1.15 -0.23 0.00 -1.54 0.00 0.00 55.06 55.12 3hfz s HIS 656 Cb -0.25 -2.83 -0.05 0.00 0.04 0.00 0.00 32.58 29.48 3hfz s HIS 656 CO 0.65 -0.04 1.33 -2.30 -2.34 0.00 0.00 174.74 172.04 3hfz n PRO 657 N 4.40 -0.33 -0.27 2.88 -0.02 -1.26 -0.76 135.00 139.63 3hfz n PRO 657 Ca -0.00 1.31 0.06 0.00 -2.02 0.00 0.00 63.50 62.85 3hfz n PRO 657 Cb 0.50 -1.93 0.21 0.00 -0.02 0.00 0.00 33.50 32.26 3hfz n PRO 657 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3hfz h GLU 658 N 0.00 0.50 -0.30 -0.52 5.08 -1.97 0.99 114.58 118.37 3hfz h GLU 658 Ca 0.12 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.44 3hfz h GLU 658 Cb 0.31 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.43 3hfz h GLU 658 CO -0.71 0.33 0.14 0.82 -1.00 0.00 0.00 179.01 178.59 3hfz h ILE 659 N 0.51 1.11 0.26 3.13 5.03 -1.29 1.05 117.51 127.31 3hfz h ILE 659 Ca 0.44 -0.31 -0.01 0.00 -0.12 0.00 0.00 64.86 64.86 3hfz h ILE 659 Cb 0.65 0.73 0.00 0.00 -3.03 0.00 0.00 36.82 35.18 3hfz h ILE 659 CO -0.39 0.12 -0.13 0.00 -0.68 0.00 0.00 178.15 177.08 3hfz h ALA 660 N 1.75 -0.35 -0.98 1.87 0.00 0.13 -1.47 119.26 120.20 3hfz h ALA 660 Ca 0.11 -0.19 0.22 0.00 0.00 0.00 0.00 54.91 55.04 3hfz h ALA 660 Cb 0.05 0.14 -0.09 0.00 0.00 0.00 0.00 17.79 17.89 3hfz h ALA 660 CO -0.01 -0.42 0.63 1.96 0.00 0.00 0.00 179.25 181.40 3hfz h GLN 661 N -0.91 0.50 0.00 0.00 7.50 0.15 0.90 115.11 123.24 3hfz h GLN 661 Ca -0.04 -0.03 -0.04 0.00 0.50 0.00 0.00 58.65 59.05 3hfz h GLN 661 Cb 0.50 -0.11 -0.01 0.00 0.05 0.00 0.00 27.48 27.91 3hfz h GLN 661 CO 0.06 0.33 -0.18 1.49 -1.50 0.00 0.00 178.83 179.04 3hfz h GLU 662 N 0.52 0.00 -0.01 1.46 4.81 0.11 -3.21 114.58 118.26 3hfz h GLU 662 Ca 0.54 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.77 3hfz h GLU 662 Cb 1.19 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.57 3hfz h GLU 662 CO -0.28 0.18 -0.64 1.28 -0.73 0.00 0.00 179.01 178.81 3hfz n LEU 663 N -3.15 1.64 -2.74 1.64 4.77 0.11 -4.98 117.00 114.28 3hfz n LEU 663 Ca 0.03 -0.67 -0.16 0.00 -0.03 0.00 0.00 56.01 55.18 3hfz n LEU 663 Cb 0.59 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.74 3hfz n LEU 663 CO 0.36 0.33 0.15 -0.62 -1.33 0.00 0.00 177.39 176.28 3hfz n GLU 664 N -0.54 -5.48 -4.48 3.23 1.02 0.27 -5.04 120.64 109.63 3hfz n GLU 664 Ca 0.07 0.60 -0.26 0.00 -0.02 0.00 0.00 57.16 57.56 3hfz n GLU 664 Cb 0.41 -4.94 -0.13 0.00 -0.02 0.00 0.00 31.44 26.75 3hfz n GLU 664 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3hfz s LEU 665 N -5.44 2.24 1.00 -4.62 1.43 -0.70 -5.02 118.68 107.58 3hfz s LEU 665 Ca 0.30 -0.63 -0.15 0.00 -1.03 0.00 0.00 54.13 52.62 3hfz s LEU 665 Cb -0.13 -0.99 0.19 0.00 0.03 0.00 0.00 46.19 45.28 3hfz s LEU 665 CO 0.53 0.13 1.16 -2.84 0.23 0.00 0.00 176.35 175.56 3hfz s PRO 666 N -1.61 0.42 -0.19 1.29 0.02 -1.26 -4.35 135.00 129.33 3hfz s PRO 666 Ca 0.08 0.08 -0.33 0.00 0.02 0.00 0.00 61.00 60.85 3hfz s PRO 666 Cb -0.10 -1.77 -0.10 0.00 0.02 0.00 0.00 34.50 32.55 3hfz s PRO 666 CO 0.03 -2.64 2.04 -0.35 -0.33 0.00 0.00 177.00 175.76 3hfz n PRO 667 N -4.03 1.82 -3.94 5.54 -0.04 -1.26 -4.94 135.00 128.14 3hfz n PRO 667 Ca 0.10 0.60 -0.33 0.00 -0.04 0.00 0.00 63.50 63.82 3hfz n PRO 667 Cb 0.59 -2.72 -0.14 0.00 -0.04 0.00 0.00 33.50 31.19 3hfz n PRO 667 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3hfz s VAL 668 N 5.92 2.63 0.77 0.52 1.01 -1.26 -4.72 120.40 125.27 3hfz s VAL 668 Ca 0.99 -2.13 -0.11 0.00 0.00 0.00 0.00 61.98 60.74 3hfz s VAL 668 Cb -0.66 -2.83 0.05 0.00 0.00 0.00 0.00 36.38 32.94 3hfz s VAL 668 CO 0.48 -0.54 1.08 -1.00 0.00 0.00 0.00 175.10 175.11 3hfz s HIS 669 N 1.02 2.73 -0.01 5.22 3.76 -1.26 -2.16 115.29 124.58 3hfz s HIS 669 Ca 0.07 1.45 -0.26 0.00 -0.15 0.00 0.00 55.06 56.18 3hfz s HIS 669 Cb -0.20 -3.02 0.09 0.00 1.11 0.00 0.00 32.58 30.56 3hfz s HIS 669 CO -0.06 -1.70 1.18 1.47 -0.85 0.00 0.00 174.74 174.78 3hfz n LEU 670 N -3.44 0.00 -3.76 0.89 -0.00 0.36 -0.23 117.00 110.82 3hfz n LEU 670 Ca 0.08 -0.45 -0.08 0.00 -0.00 0.00 0.00 56.01 55.56 3hfz n LEU 670 Cb 0.54 1.80 -0.02 0.00 -0.00 0.00 0.00 43.42 45.73 3hfz n LEU 670 CO 0.55 -0.15 0.45 0.72 -0.00 0.00 0.00 177.39 178.95 3hfz s PHE 671 N -2.11 -0.26 -0.07 1.47 -0.71 -1.12 -0.49 117.98 114.69 3hfz s PHE 671 Ca 0.28 -0.14 -0.30 0.00 -1.04 0.00 0.00 56.93 55.73 3hfz s PHE 671 Cb -0.01 0.67 0.07 0.00 -1.21 0.00 0.00 43.02 42.54 3hfz s PHE 671 CO -0.00 -1.15 0.67 -2.00 -1.34 0.00 0.00 175.22 171.40 3hfz s GLU 672 N -3.88 1.02 0.37 1.99 2.12 -0.54 -2.87 118.70 116.91 3hfz s GLU 672 Ca 0.09 0.31 -0.16 0.00 0.36 0.00 0.00 54.97 55.56 3hfz s GLU 672 Cb -0.05 0.48 0.05 0.00 0.26 0.00 0.00 34.13 34.88 3hfz s GLU 672 CO 0.02 -0.30 0.80 -0.48 -0.54 0.00 0.00 175.26 174.76 3hfz s LEU 673 N -1.06 -0.01 -0.14 2.70 0.05 0.12 -1.30 118.68 119.04 3hfz s LEU 673 Ca -0.10 -1.09 0.01 0.00 0.05 0.00 0.00 54.13 53.00 3hfz s LEU 673 Cb -0.01 2.80 -0.00 0.00 -2.05 0.00 0.00 46.19 46.93 3hfz s LEU 673 CO 0.09 -1.63 -0.18 -0.60 -0.55 0.00 0.00 176.35 173.48 3hfz s ARG 674 N -2.39 3.18 0.29 1.48 3.52 -0.60 -1.58 118.95 122.85 3hfz s ARG 674 Ca 0.16 -0.78 0.02 0.00 -0.13 0.00 0.00 55.73 54.99 3hfz s ARG 674 Cb -0.05 -2.53 -0.03 0.00 -1.56 0.00 0.00 34.95 30.77 3hfz s ARG 674 CO 0.11 0.08 0.46 -0.51 -0.81 0.00 0.00 175.30 174.63 3hfz s LEU 675 N 0.64 4.15 -0.35 -0.88 1.43 -0.64 -4.04 118.68 118.99 3hfz s LEU 675 Ca -0.09 0.32 -0.29 0.00 -1.03 0.00 0.00 54.13 53.04 3hfz s LEU 675 Cb -0.16 -3.14 0.00 0.00 0.03 0.00 0.00 46.19 42.92 3hfz s LEU 675 CO 0.02 -0.18 1.38 -2.16 0.23 0.00 0.00 176.35 175.65 3hfz s PRO 676 N -4.04 3.73 0.72 1.29 0.04 -1.26 -4.33 135.00 131.14 3hfz s PRO 676 Ca 0.38 1.12 -0.17 0.00 0.04 0.00 0.00 61.00 62.37 3hfz s PRO 676 Cb -0.10 -3.97 -0.08 0.00 0.04 0.00 0.00 34.50 30.39 3hfz s PRO 676 CO 0.33 -1.37 0.13 1.28 0.04 0.00 0.00 177.00 177.41 3hfz n LEU 677 N 8.31 -1.49 -4.52 -3.56 4.77 -1.26 -4.81 117.00 114.44 3hfz n LEU 677 Ca 0.16 0.53 -0.43 0.00 -0.03 0.00 0.00 56.01 56.24 3hfz n LEU 677 Cb 0.47 -1.05 0.00 0.00 -2.33 0.00 0.00 43.42 40.52 3hfz n LEU 677 CO 0.67 -4.05 0.31 -2.65 -1.33 0.00 0.00 177.39 170.35 3hfz n PRO 678 N 0.35 0.90 -3.88 3.23 -0.02 -1.26 -4.96 135.00 129.36 3hfz n PRO 678 Ca 0.07 0.32 -0.36 0.00 -2.02 0.00 0.00 63.50 61.52 3hfz n PRO 678 Cb 0.50 -1.68 -0.14 0.00 -0.02 0.00 0.00 33.50 32.16 3hfz n PRO 678 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3hfz s ASP 679 N -0.81 4.66 -0.16 2.55 -1.08 -1.26 -5.03 116.67 115.54 3hfz s ASP 679 Ca 0.62 -0.82 -0.03 0.00 -0.52 0.00 0.00 52.55 51.80 3hfz s ASP 679 Cb -0.64 -1.75 -0.02 0.00 -1.46 0.00 0.00 42.92 39.05 3hfz s ASP 679 CO 0.58 -0.16 -0.06 -0.75 0.52 0.00 0.00 175.17 175.30 3hfz s LYS 680 N 1.39 3.57 0.80 4.34 2.20 -1.26 -5.11 119.74 125.67 3hfz s LYS 680 Ca 0.01 -0.57 -0.11 0.00 -0.36 0.00 0.00 55.97 54.94 3hfz s LYS 680 Cb -0.17 -2.86 0.07 0.00 -1.51 0.00 0.00 37.83 33.36 3hfz s LYS 680 CO -0.02 0.19 1.10 -1.25 -0.36 0.00 0.00 175.35 175.00 3hfz s PRO 681 N 0.49 2.06 -0.14 4.03 0.04 -1.26 -5.02 135.00 135.20 3hfz s PRO 681 Ca -0.05 0.66 -0.21 0.00 0.04 0.00 0.00 61.00 61.45 3hfz s PRO 681 Cb -0.15 -1.91 -0.03 0.00 0.04 0.00 0.00 34.50 32.45 3hfz s PRO 681 CO 0.03 -1.64 0.60 -1.17 0.04 0.00 0.00 177.00 174.87 3hfz s LEU 682 N -5.80 4.22 -0.59 -3.56 2.96 -1.26 -5.00 118.68 109.65 3hfz s LEU 682 Ca 0.61 0.91 -0.00 0.00 -0.22 0.00 0.00 54.13 55.43 3hfz s LEU 682 Cb -0.15 -2.88 0.15 0.00 0.50 0.00 0.00 46.19 43.81 3hfz s LEU 682 CO 0.54 -0.16 0.37 0.00 -1.32 0.00 0.00 176.35 175.79 3hfz s ALA 683 N 1.30 3.48 0.19 5.97 0.00 -1.26 -5.06 121.76 126.38 3hfz s ALA 683 Ca 0.30 -3.28 -0.33 0.00 0.00 0.00 0.00 51.96 48.66 3hfz s ALA 683 Cb -0.16 -2.47 -0.13 0.00 0.00 0.00 0.00 23.12 20.36 3hfz s ALA 683 CO 0.12 -2.07 1.66 0.34 0.00 0.00 0.00 175.76 175.81 3hfz n PHE 684 N 3.33 2.57 -3.76 0.00 7.35 -1.26 -4.95 117.46 120.74 3hfz n PHE 684 Ca 0.07 0.13 -0.33 0.00 -0.76 0.00 0.00 57.45 56.56 3hfz n PHE 684 Cb 0.36 -2.62 -0.09 0.00 0.35 0.00 0.00 39.48 37.47 3hfz n PHE 684 CO 0.00 0.00 0.00 -0.65 -0.76 0.00 0.00 176.76 175.35 3hfz s GLN 685 N 1.02 2.80 -0.84 -4.13 -1.52 -1.26 -5.04 119.66 110.68 3hfz s GLN 685 Ca 0.76 -3.13 -0.31 0.00 -1.95 0.00 0.00 55.36 50.74 3hfz s GLN 685 Cb -0.57 -3.70 -0.18 0.00 -0.22 0.00 0.00 33.01 28.34 3hfz s GLN 685 CO 0.35 -1.24 2.59 -3.47 -0.25 0.00 0.00 175.29 173.27 3hfz n ASP 686 N 2.46 0.83 -4.66 5.90 2.03 -1.26 -4.81 116.55 117.04 3hfz n ASP 686 Ca 0.17 0.06 -0.44 0.00 0.52 0.00 0.00 54.79 55.10 3hfz n ASP 686 Cb 0.36 -1.08 -0.01 0.00 -0.72 0.00 0.00 41.12 39.67 3hfz n ASP 686 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 3hfz n PRO 687 N 8.56 1.85 -1.83 -0.67 -0.04 -1.26 -4.96 135.00 136.64 3hfz n PRO 687 Ca 0.58 0.65 -0.34 0.00 -0.04 0.00 0.00 63.50 64.35 3hfz n PRO 687 Cb 0.15 -2.17 0.05 0.00 -0.04 0.00 0.00 33.50 31.48 3hfz n PRO 687 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3hfz s SER 688 N -0.29 5.01 -0.17 3.54 0.15 -1.26 -4.98 113.70 115.69 3hfz s SER 688 Ca 0.59 2.21 -0.23 0.00 0.70 0.00 0.00 55.95 59.22 3hfz s SER 688 Cb -0.63 -2.58 -0.22 0.00 -1.71 0.00 0.00 66.02 60.88 3hfz s SER 688 CO 0.59 -1.70 0.42 0.03 1.20 0.00 0.00 173.24 173.78 3hfz h ARG 689 N 0.35 0.03 -6.73 5.44 2.47 -1.88 -3.48 114.38 110.58 3hfz h ARG 689 Ca -0.48 -0.05 -0.55 0.00 -1.26 0.00 0.00 59.98 57.63 3hfz h ARG 689 Cb 1.27 0.02 0.19 0.00 -1.65 0.00 0.00 29.97 29.81 3hfz h ARG 689 CO 0.54 1.03 -0.39 0.72 0.56 0.00 0.00 179.97 182.42 3hfz n HIS 690 N -4.42 -0.83 -1.50 3.04 8.25 -1.26 -4.96 115.22 113.54 3hfz n HIS 690 Ca -0.25 0.32 -0.33 0.00 -0.26 0.00 0.00 57.72 57.21 3hfz n HIS 690 Cb 0.65 -1.90 0.07 0.00 1.12 0.00 0.00 29.99 29.94 3hfz n HIS 690 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 3hfz s PRO 691 N -3.08 2.43 0.46 -0.41 0.04 -1.26 -4.95 135.00 128.23 3hfz s PRO 691 Ca 0.64 1.40 -0.00 0.00 0.04 0.00 0.00 61.00 63.07 3hfz s PRO 691 Cb -0.31 -1.90 -0.00 0.00 0.04 0.00 0.00 34.50 32.33 3hfz s PRO 691 CO 0.60 -1.54 0.70 0.00 0.04 0.00 0.00 177.00 176.80 3hfz s ALA 692 N -2.46 3.70 -0.36 8.56 0.00 -1.26 -4.75 121.76 125.20 3hfz s ALA 692 Ca 0.66 -1.01 -0.08 0.00 0.00 0.00 0.00 51.96 51.54 3hfz s ALA 692 Cb -0.21 -2.20 0.04 0.00 0.00 0.00 0.00 23.12 20.75 3hfz s ALA 692 CO 0.47 -0.42 0.15 0.00 0.00 0.00 0.00 175.76 175.96 3hfz s ALA 693 N -2.60 3.13 0.45 0.00 0.00 0.23 -4.91 121.76 118.06 3hfz s ALA 693 Ca 0.49 -1.79 -0.23 0.00 0.00 0.00 0.00 51.96 50.42 3hfz s ALA 693 Cb -0.10 -2.39 -0.07 0.00 0.00 0.00 0.00 23.12 20.55 3hfz s ALA 693 CO 0.39 -1.39 1.19 -0.06 0.00 0.00 0.00 175.76 175.89 3hfz s PHE 694 N 1.44 2.86 0.04 0.00 0.40 -1.26 -1.08 117.98 120.38 3hfz s PHE 694 Ca -0.00 1.52 -0.07 0.00 -0.60 0.00 0.00 56.93 57.78 3hfz s PHE 694 Cb -0.20 -3.43 -0.01 0.00 0.51 0.00 0.00 43.02 39.90 3hfz s PHE 694 CO 0.04 -1.61 0.14 0.50 0.70 0.00 0.00 175.22 174.98 3hfz s ARG 695 N -2.62 0.66 -0.07 0.44 6.06 0.15 -4.90 118.95 118.66 3hfz s ARG 695 Ca 0.63 -0.75 -0.18 0.00 -2.50 0.00 0.00 55.73 52.93 3hfz s ARG 695 Cb -0.30 0.26 0.04 0.00 0.06 0.00 0.00 34.95 35.01 3hfz s ARG 695 CO 0.37 -0.18 0.42 -0.51 -2.50 0.00 0.00 175.30 172.90 3hfz s ASP 696 N -2.23 -0.36 0.00 -2.12 1.11 -1.26 -0.98 116.67 110.83 3hfz s ASP 696 Ca -0.03 0.45 0.00 0.00 0.18 0.00 0.00 52.55 53.15 3hfz s ASP 696 Cb -0.00 0.54 0.00 0.00 1.07 0.00 0.00 42.92 44.53 3hfz s ASP 696 CO -0.05 -0.38 0.00 0.00 1.18 0.00 0.00 175.17 175.91 3hfz n LEU 697 N 1.70 0.00 -3.97 1.23 -0.00 -1.05 -2.34 117.00 112.57 3hfz n LEU 697 Ca -0.18 0.00 -0.29 0.00 -0.00 0.00 0.00 56.01 55.54 3hfz n LEU 697 Cb 0.56 0.00 -0.17 0.00 -0.00 0.00 0.00 43.42 43.82 3hfz n LEU 697 CO 0.19 0.00 -0.47 0.00 -0.00 0.00 0.00 177.39 177.11 3hfz s ALA 698 N -2.00 1.67 0.05 1.47 0.00 -1.24 0.12 121.76 121.83 3hfz s ALA 698 Ca 0.00 -0.79 -0.29 0.00 0.00 0.00 0.00 51.96 50.88 3hfz s ALA 698 Cb 0.00 -1.02 -0.05 0.00 0.00 0.00 0.00 23.12 22.06 3hfz s ALA 698 CO 0.00 -0.42 0.93 0.08 0.00 0.00 0.00 175.76 176.35 3hfz s VAL 699 N 1.57 4.69 -0.49 0.00 1.01 -0.38 -1.91 120.40 124.89 3hfz s VAL 699 Ca 0.05 1.98 -0.21 0.00 0.00 0.00 0.00 61.98 63.80 3hfz s VAL 699 Cb -0.13 -4.28 0.04 0.00 0.00 0.00 0.00 36.38 32.01 3hfz s VAL 699 CO -0.10 0.26 0.68 -0.69 0.00 0.00 0.00 175.10 175.26 3hfz s VAL 700 N 0.41 4.78 0.09 2.92 1.01 -1.25 -0.14 120.40 128.21 3hfz s VAL 700 Ca 0.47 -0.14 0.09 0.00 0.00 0.00 0.00 61.98 62.40 3hfz s VAL 700 Cb -0.22 -4.30 -0.04 0.00 0.00 0.00 0.00 36.38 31.82 3hfz s VAL 700 CO 0.28 -0.78 -0.20 -0.69 0.00 0.00 0.00 175.10 173.71 3hfz s VAL 701 N 2.92 2.71 0.35 2.92 1.01 0.51 -1.59 120.40 129.23 3hfz s VAL 701 Ca 0.20 -1.42 -0.28 0.00 0.00 0.00 0.00 61.98 60.49 3hfz s VAL 701 Cb -0.16 -2.19 -0.10 0.00 0.00 0.00 0.00 36.38 33.93 3hfz s VAL 701 CO 0.16 0.20 1.26 -2.16 0.00 0.00 0.00 175.10 174.55 3hfz s PRO 702 N -1.84 4.25 0.33 2.72 0.04 -1.26 0.12 135.00 139.35 3hfz s PRO 702 Ca 0.16 2.10 0.23 0.00 0.04 0.00 0.00 61.00 63.53 3hfz s PRO 702 Cb -0.10 -2.95 1.12 0.00 0.04 0.00 0.00 34.50 32.61 3hfz s PRO 702 CO 0.07 -0.24 1.19 0.00 0.04 0.00 0.00 177.00 178.07 3hfz n ALA 703 N 0.57 1.00 0.03 8.56 0.00 -0.89 -1.93 120.51 127.85 3hfz n ALA 703 Ca 0.01 0.68 -0.12 0.00 0.00 0.00 0.00 53.44 54.01 3hfz n ALA 703 Cb 0.43 -0.80 -0.09 0.00 0.00 0.00 0.00 19.45 18.99 3hfz n ALA 703 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3hfz h PRO 704 N 0.00 -0.14 -5.93 0.00 0.13 -1.89 -3.46 132.00 120.71 3hfz h PRO 704 Ca 0.67 0.01 -0.81 0.00 -0.87 0.00 0.00 66.00 64.99 3hfz h PRO 704 Cb 2.09 0.03 -0.02 0.00 0.13 0.00 0.00 31.00 33.24 3hfz h PRO 704 CO -0.39 0.35 1.02 2.41 -0.23 0.00 0.00 178.00 181.16 3hfz n THR 705 N -4.88 0.00 -1.82 1.56 -1.04 -0.81 -4.84 114.28 102.45 3hfz n THR 705 Ca -0.08 0.00 -0.40 0.00 -2.04 0.00 0.00 64.05 61.53 3hfz n THR 705 Cb 0.28 -0.49 0.01 0.00 -1.82 0.00 0.00 70.33 68.31 3hfz n THR 705 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 3hfz s PRO 706 N 4.58 3.79 0.30 -2.82 0.04 -1.26 -4.88 135.00 134.76 3hfz s PRO 706 Ca 1.12 2.43 0.06 0.00 0.04 0.00 0.00 61.00 64.65 3hfz s PRO 706 Cb -1.48 -2.73 0.82 0.00 0.04 0.00 0.00 34.50 31.15 3hfz s PRO 706 CO 0.72 -0.73 1.66 -0.92 0.04 0.00 0.00 177.00 177.77 3hfz h TYR 707 N 2.49 0.60 -0.61 0.56 3.20 -1.97 -1.46 116.97 119.78 3hfz h TYR 707 Ca -0.51 0.04 0.13 0.00 3.14 0.00 0.00 58.73 61.53 3hfz h TYR 707 Cb 1.26 -0.11 -0.11 0.00 1.54 0.00 0.00 36.73 39.31 3hfz h TYR 707 CO 0.51 -0.16 -0.05 0.78 -1.64 0.00 0.00 178.16 177.60 3hfz h GLY 708 N 0.29 0.58 0.95 1.82 0.00 -1.96 -0.89 103.07 103.87 3hfz h GLY 708 Ca 0.61 0.12 -0.01 0.00 0.00 0.00 0.00 47.33 48.05 3hfz h GLY 708 CO -0.61 -0.21 0.14 -2.09 0.00 0.00 0.00 176.54 173.77 3hfz h GLU 709 N 0.08 0.37 0.28 4.80 4.81 -1.63 -0.56 114.58 122.72 3hfz h GLU 709 Ca 0.31 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.50 3hfz h GLU 709 Cb 0.50 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.77 3hfz h GLU 709 CO -0.56 0.33 -0.43 0.28 -0.73 0.00 0.00 179.01 177.91 3hfz h VAL 710 N 0.30 0.15 0.07 0.32 2.07 -1.35 -1.30 116.25 116.50 3hfz h VAL 710 Ca 0.09 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.62 3hfz h VAL 710 Cb 0.08 0.15 -0.03 0.00 -1.52 0.00 0.00 31.29 29.96 3hfz h VAL 710 CO -0.01 0.00 -0.31 -0.08 0.02 0.00 0.00 177.57 177.18 3hfz h GLU 711 N -0.77 -0.43 -0.98 1.57 4.22 -1.04 0.21 114.58 117.36 3hfz h GLU 711 Ca -0.01 0.03 0.32 0.00 0.08 0.00 0.00 59.36 59.77 3hfz h GLU 711 Cb 0.73 0.10 -0.15 0.00 0.50 0.00 0.00 28.75 29.92 3hfz h GLU 711 CO -0.15 -0.29 0.47 0.00 -2.18 0.00 0.00 179.01 176.87 3hfz h ALA 712 N -0.96 1.81 -0.25 2.92 0.00 -1.07 0.68 119.26 122.40 3hfz h ALA 712 Ca -0.00 0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.12 3hfz h ALA 712 Cb 0.45 0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.47 3hfz h ALA 712 CO -0.17 -0.60 0.00 -0.11 0.00 0.00 0.00 179.25 178.36 3hfz n LEU 713 N -5.14 0.01 -0.37 0.00 0.00 -0.50 0.43 117.00 111.45 3hfz n LEU 713 Ca 0.30 0.93 -0.06 0.00 0.00 0.00 0.00 56.01 57.18 3hfz n LEU 713 Cb 0.96 -0.46 -0.04 0.00 0.00 0.00 0.00 43.42 43.88 3hfz n LEU 713 CO 0.07 -0.46 0.47 0.52 0.00 0.00 0.00 177.39 177.99 3hfz n VAL 714 N -1.88 -0.56 0.13 1.96 0.31 -0.05 -1.42 118.33 116.83 3hfz n VAL 714 Ca 0.00 2.16 -0.07 0.00 -0.01 0.00 0.00 64.34 66.41 3hfz n VAL 714 Cb 0.00 -2.74 -0.04 0.00 -0.91 0.00 0.00 33.84 30.15 3hfz n VAL 714 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 3hfz h ARG 715 N 0.00 -0.41 -0.40 5.55 2.43 -0.91 0.26 114.38 120.91 3hfz h ARG 715 Ca 0.22 0.03 0.11 0.00 -0.81 0.00 0.00 59.98 59.53 3hfz h ARG 715 Cb 0.44 0.09 -0.07 0.00 -0.42 0.00 0.00 29.97 30.01 3hfz h ARG 715 CO -0.87 -0.27 0.02 -1.91 -1.51 0.00 0.00 179.97 175.43 3hfz n GLU 716 N -3.54 -0.03 0.00 0.20 0.00 0.17 0.19 120.64 117.62 3hfz n GLU 716 Ca -0.05 0.59 0.09 0.00 0.00 0.00 0.00 57.16 57.79 3hfz n GLU 716 Cb 0.19 -0.95 -0.08 0.00 0.00 0.00 0.00 31.44 30.59 3hfz n GLU 716 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3hfz n ALA 717 N -3.40 4.14 -0.12 4.31 0.00 -0.94 -4.74 120.51 119.76 3hfz n ALA 717 Ca 0.10 -0.52 -0.01 0.00 0.00 0.00 0.00 53.44 53.01 3hfz n ALA 717 Cb 0.32 -0.65 -0.02 0.00 0.00 0.00 0.00 19.45 19.11 3hfz n ALA 717 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hfz n ALA 718 N -1.18 1.66 -1.02 0.00 0.00 0.50 -4.51 120.51 115.95 3hfz n ALA 718 Ca 0.04 -0.21 0.10 0.00 0.00 0.00 0.00 53.44 53.37 3hfz n ALA 718 Cb 0.30 -2.24 -0.04 0.00 0.00 0.00 0.00 19.45 17.47 3hfz n ALA 718 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hfz n GLY 719 N 2.88 -1.53 0.20 0.00 0.00 -1.26 -4.02 105.19 101.46 3hfz n GLY 719 Ca 0.05 -0.57 0.14 0.00 0.00 0.00 0.00 46.02 45.64 3hfz n GLY 719 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3hfz n PRO 720 N -3.39 0.81 -1.01 1.61 -0.04 -1.26 -3.88 135.00 127.85 3hfz n PRO 720 Ca -0.03 -0.40 -0.13 0.00 -0.04 0.00 0.00 63.50 62.90 3hfz n PRO 720 Cb 0.54 -1.49 0.20 0.00 -0.04 0.00 0.00 33.50 32.71 3hfz n PRO 720 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3hfz n TYR 721 N -0.75 2.12 -3.03 0.54 4.01 -1.26 -4.99 117.16 113.80 3hfz n TYR 721 Ca 0.14 -1.65 -0.34 0.00 -0.16 0.00 0.00 57.90 55.88 3hfz n TYR 721 Cb 0.32 -0.71 -0.06 0.00 -0.31 0.00 0.00 39.34 38.57 3hfz n TYR 721 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 3hfz s LEU 722 N -3.24 4.12 -0.03 7.72 2.96 -1.25 -0.96 118.68 128.01 3hfz s LEU 722 Ca 0.51 1.44 -0.04 0.00 -0.22 0.00 0.00 54.13 55.83 3hfz s LEU 722 Cb 0.44 -4.06 -0.02 0.00 0.50 0.00 0.00 46.19 43.05 3hfz s LEU 722 CO 0.06 -0.17 -0.08 1.21 -1.32 0.00 0.00 176.35 176.05 3hfz n GLU 723 N -0.10 0.13 -3.95 1.98 2.13 0.51 -4.74 120.64 116.60 3hfz n GLU 723 Ca 0.03 0.06 -0.13 0.00 0.66 0.00 0.00 57.16 57.77 3hfz n GLU 723 Cb 0.53 -0.73 -0.14 0.00 0.27 0.00 0.00 31.44 31.37 3hfz n GLU 723 CO 0.00 0.00 0.00 -1.12 -0.41 0.00 0.00 177.13 175.60 3hfz s SER 724 N -5.74 0.20 -0.07 4.31 0.01 -1.13 -4.97 113.70 106.31 3hfz s SER 724 Ca -0.08 -0.03 0.04 0.00 1.31 0.00 0.00 55.95 57.19 3hfz s SER 724 Cb 0.03 -0.03 0.00 0.00 0.21 0.00 0.00 66.02 66.23 3hfz s SER 724 CO 0.11 0.01 -0.19 -0.22 0.41 0.00 0.00 173.24 173.36 3hfz s LEU 725 N 0.03 1.91 -0.26 2.44 0.20 -1.25 -2.05 118.68 119.72 3hfz s LEU 725 Ca -0.00 -0.43 -0.17 0.00 0.69 0.00 0.00 54.13 54.22 3hfz s LEU 725 Cb -0.01 -1.13 0.07 0.00 -0.43 0.00 0.00 46.19 44.69 3hfz s LEU 725 CO -0.00 0.13 0.66 0.00 -0.29 0.00 0.00 176.35 176.84 3hfz s ALA 726 N 0.32 -1.73 -0.33 5.97 0.00 0.20 -4.93 121.76 121.27 3hfz s ALA 726 Ca -0.13 2.20 -0.24 0.00 0.00 0.00 0.00 51.96 53.79 3hfz s ALA 726 Cb -0.16 -1.29 0.00 0.00 0.00 0.00 0.00 23.12 21.68 3hfz s ALA 726 CO 0.05 -0.35 0.80 -1.17 0.00 0.00 0.00 175.76 175.09 3hfz s LEU 727 N 1.29 4.09 -0.09 0.00 2.96 -1.25 0.18 118.68 125.86 3hfz s LEU 727 Ca -0.07 0.56 0.14 0.00 -0.22 0.00 0.00 54.13 54.54 3hfz s LEU 727 Cb -0.05 -3.07 -0.21 0.00 0.50 0.00 0.00 46.19 43.36 3hfz s LEU 727 CO -0.14 -0.67 0.18 2.22 -1.32 0.00 0.00 176.35 176.62 3hfz n PHE 728 N 6.31 0.00 -3.77 5.38 -1.74 0.38 -4.98 117.46 119.03 3hfz n PHE 728 Ca 0.04 0.00 -0.14 0.00 -0.56 0.00 0.00 57.45 56.79 3hfz n PHE 728 Cb 0.48 -0.57 -0.15 0.00 1.52 0.00 0.00 39.48 40.77 3hfz n PHE 728 CO 0.00 0.00 0.00 0.34 -0.56 0.00 0.00 176.76 176.54 3hfz s ASP 729 N -4.37 -0.04 -0.31 5.98 2.15 -1.23 -4.97 116.67 113.87 3hfz s ASP 729 Ca -0.07 0.18 0.03 0.00 0.43 0.00 0.00 52.55 53.12 3hfz s ASP 729 Cb 0.07 0.09 0.09 0.00 -0.30 0.00 0.00 42.92 42.87 3hfz s ASP 729 CO 0.62 -0.12 0.01 -0.22 -0.17 0.00 0.00 175.17 175.30 3hfz s LEU 730 N 0.92 4.03 0.20 -1.34 2.96 -1.26 0.23 118.68 124.42 3hfz s LEU 730 Ca -0.07 -1.85 0.10 0.00 -0.22 0.00 0.00 54.13 52.09 3hfz s LEU 730 Cb -0.10 -1.50 -0.04 0.00 0.50 0.00 0.00 46.19 45.05 3hfz s LEU 730 CO -0.04 -0.33 -0.16 -0.47 -1.32 0.00 0.00 176.35 174.04 3hfz s TYR 731 N 1.06 2.47 -0.29 5.38 5.04 -0.80 -4.99 117.35 125.21 3hfz s TYR 731 Ca 0.05 -0.29 -0.14 0.00 -2.44 0.00 0.00 57.07 54.25 3hfz s TYR 731 Cb -0.19 -1.19 0.12 0.00 0.35 0.00 0.00 41.96 41.05 3hfz s TYR 731 CO -0.09 0.54 0.80 1.14 -1.34 0.00 0.00 175.55 176.60 3hfz s GLN 732 N -2.90 0.53 0.00 4.97 -2.07 -1.26 -0.81 119.66 118.11 3hfz s GLN 732 Ca 0.24 1.07 0.00 0.00 -1.82 0.00 0.00 55.36 54.86 3hfz s GLN 732 Cb -0.08 0.37 0.00 0.00 -1.09 0.00 0.00 33.01 32.22 3hfz s GLN 732 CO 0.13 -0.14 0.00 0.41 -1.32 0.00 0.00 175.29 174.37 3hfz n GLY 733 N 4.59 0.22 3.77 2.60 0.00 -1.26 -5.05 105.19 110.05 3hfz n GLY 733 Ca -0.16 -1.28 -0.40 0.00 0.00 0.00 0.00 46.02 44.18 3hfz n GLY 733 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3hfz s PRO 734 N -2.00 4.23 0.00 1.61 0.04 -1.26 -0.49 135.00 137.13 3hfz s PRO 734 Ca 0.00 2.06 0.25 0.00 0.04 0.00 0.00 61.00 63.35 3hfz s PRO 734 Cb 0.00 -2.92 0.69 0.00 0.04 0.00 0.00 34.50 32.31 3hfz s PRO 734 CO 0.00 -0.24 1.54 -0.35 0.04 0.00 0.00 177.00 177.99 3hfz n PRO 735 N 0.52 1.96 -1.13 0.56 -0.04 -1.26 -5.11 135.00 130.50 3hfz n PRO 735 Ca 0.02 -1.40 -0.35 0.00 -0.04 0.00 0.00 63.50 61.72 3hfz n PRO 735 Cb 0.44 -1.46 0.01 0.00 -0.04 0.00 0.00 33.50 32.44 3hfz n PRO 735 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3hfz n LEU 736 N 0.67 -3.42 -4.58 1.53 4.77 0.35 -4.63 117.00 111.70 3hfz n LEU 736 Ca 0.17 0.58 -0.23 0.00 -0.03 0.00 0.00 56.01 56.50 3hfz n LEU 736 Cb 0.45 -0.77 -0.08 0.00 -2.33 0.00 0.00 43.42 40.69 3hfz n LEU 736 CO 0.15 -4.41 1.35 -2.16 -1.33 0.00 0.00 177.39 171.00 3hfz s PRO 737 N -0.95 2.07 0.00 3.23 0.04 -1.26 -4.82 135.00 133.30 3hfz s PRO 737 Ca 0.51 -0.79 0.00 0.00 0.04 0.00 0.00 61.00 60.76 3hfz s PRO 737 Cb -0.44 -5.13 0.00 0.00 0.04 0.00 0.00 34.50 28.97 3hfz s PRO 737 CO 0.61 -4.40 0.00 0.39 0.04 0.00 0.00 177.00 173.64 3hfz n GLU 738 N 8.33 0.00 -1.38 4.56 1.02 -1.26 -3.74 120.64 128.16 3hfz n GLU 738 Ca 0.43 0.00 -0.01 0.00 -0.02 0.00 0.00 57.16 57.56 3hfz n GLU 738 Cb 0.46 0.00 -0.00 0.00 -0.02 0.00 0.00 31.44 31.88 3hfz n GLU 738 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3hfz n GLY 739 N 0.00 0.42 0.00 0.62 0.00 -1.26 -5.02 105.19 99.95 3hfz n GLY 739 Ca 0.00 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 45.05 3hfz n GLY 739 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3hfz n HIS 740 N -3.33 0.00 -3.54 1.61 8.25 -1.25 -2.10 115.22 114.86 3hfz n HIS 740 Ca -0.01 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.33 3hfz n HIS 740 Cb 0.20 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.27 3hfz n HIS 740 CO 0.00 0.00 0.00 -1.59 0.64 0.00 0.00 176.34 175.39 3hfz s LYS 741 N -1.00 0.76 -0.03 -0.41 -2.85 0.31 -4.30 119.74 112.23 3hfz s LYS 741 Ca 0.00 0.03 0.07 0.00 -1.00 0.00 0.00 55.97 55.07 3hfz s LYS 741 Cb 0.00 0.36 -0.02 0.00 -2.06 0.00 0.00 37.83 36.11 3hfz s LYS 741 CO 0.00 -0.27 -0.24 -1.54 0.10 0.00 0.00 175.35 173.40 3hfz s SER 742 N -1.53 2.90 -0.28 0.03 1.04 0.01 0.19 113.70 116.07 3hfz s SER 742 Ca -0.02 -0.46 -0.02 0.00 0.48 0.00 0.00 55.95 55.93 3hfz s SER 742 Cb -0.01 -0.52 0.04 0.00 0.10 0.00 0.00 66.02 65.63 3hfz s SER 742 CO 0.00 0.27 -0.01 -0.76 0.98 0.00 0.00 173.24 173.72 3hfz s LEU 743 N -0.39 3.63 -0.16 2.42 1.43 0.80 -1.91 118.68 124.49 3hfz s LEU 743 Ca 0.04 -1.05 -0.29 0.00 -1.03 0.00 0.00 54.13 51.80 3hfz s LEU 743 Cb -0.11 -1.72 -0.04 0.00 0.03 0.00 0.00 46.19 44.35 3hfz s LEU 743 CO 0.01 -0.20 1.66 0.00 0.23 0.00 0.00 176.35 178.04 3hfz s ALA 744 N 1.32 3.36 -0.21 4.21 0.00 0.62 -1.25 121.76 129.81 3hfz s ALA 744 Ca -0.02 0.64 -0.01 0.00 0.00 0.00 0.00 51.96 52.57 3hfz s ALA 744 Cb -0.18 -3.83 0.01 0.00 0.00 0.00 0.00 23.12 19.12 3hfz s ALA 744 CO -0.02 -1.81 -0.12 -0.06 0.00 0.00 0.00 175.76 173.75 3hfz s PHE 745 N 4.97 2.91 -0.20 0.00 0.08 0.33 -0.47 117.98 125.60 3hfz s PHE 745 Ca 0.74 -1.44 -0.18 0.00 0.12 0.00 0.00 56.93 56.16 3hfz s PHE 745 Cb -0.28 -2.00 -0.03 0.00 -0.57 0.00 0.00 43.02 40.13 3hfz s PHE 745 CO 0.30 -0.72 0.52 -1.01 -0.10 0.00 0.00 175.22 174.20 3hfz s HIS 746 N 1.35 3.37 0.38 0.36 3.76 0.47 -2.52 115.29 122.46 3hfz s HIS 746 Ca 0.04 0.77 0.08 0.00 -0.15 0.00 0.00 55.06 55.80 3hfz s HIS 746 Cb -0.14 -2.67 -0.07 0.00 1.11 0.00 0.00 32.58 30.81 3hfz s HIS 746 CO -0.08 -0.10 -0.03 -0.51 -0.85 0.00 0.00 174.74 173.17 3hfz s LEU 747 N 1.62 2.81 -0.28 0.89 1.02 -0.15 -0.62 118.68 123.96 3hfz s LEU 747 Ca 0.24 -1.30 -0.18 0.00 0.02 0.00 0.00 54.13 52.91 3hfz s LEU 747 Cb -0.15 -0.93 0.09 0.00 0.02 0.00 0.00 46.19 45.22 3hfz s LEU 747 CO 0.10 -0.35 0.77 -0.13 0.02 0.00 0.00 176.35 176.75 3hfz s ARG 748 N -3.67 0.66 0.08 1.70 0.52 -0.87 -0.68 118.95 116.68 3hfz s ARG 748 Ca 0.34 1.06 0.09 0.00 -0.52 0.00 0.00 55.73 56.70 3hfz s ARG 748 Cb 0.07 0.17 -0.03 0.00 0.52 0.00 0.00 34.95 35.68 3hfz s ARG 748 CO 0.17 -0.13 -0.25 -0.06 0.02 0.00 0.00 175.30 175.06 3hfz s PHE 749 N 1.34 2.19 -0.23 -0.53 0.40 -0.24 0.19 117.98 121.09 3hfz s PHE 749 Ca -0.08 -0.40 -0.10 0.00 -0.60 0.00 0.00 56.93 55.76 3hfz s PHE 749 Cb -0.05 -1.26 0.09 0.00 0.51 0.00 0.00 43.02 42.31 3hfz s PHE 749 CO -0.15 0.19 0.52 0.50 0.70 0.00 0.00 175.22 176.98 3hfz s ARG 750 N -1.53 0.47 0.03 0.44 3.52 -0.14 0.78 118.95 122.52 3hfz s ARG 750 Ca 0.11 1.10 -0.19 0.00 -0.13 0.00 0.00 55.73 56.63 3hfz s ARG 750 Cb -0.10 0.33 -0.06 0.00 -1.56 0.00 0.00 34.95 33.56 3hfz s ARG 750 CO 0.03 -0.20 0.54 -1.58 -0.81 0.00 0.00 175.30 173.29 3hfz s HIS 751 N 2.19 3.74 0.05 5.12 5.65 -1.26 -4.80 115.29 125.98 3hfz s HIS 751 Ca -0.06 1.18 -0.20 0.00 0.25 0.00 0.00 55.06 56.22 3hfz s HIS 751 Cb -0.10 -2.49 -0.13 0.00 -1.18 0.00 0.00 32.58 28.67 3hfz s HIS 751 CO -0.16 0.51 1.39 -1.00 -0.65 0.00 0.00 174.74 174.83 3hfz h PRO 752 N 5.01 0.33 0.05 2.88 0.13 -1.98 -3.35 132.00 135.08 3hfz h PRO 752 Ca -0.48 -0.15 -0.23 0.00 -0.87 0.00 0.00 66.00 64.26 3hfz h PRO 752 Cb 1.21 -0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.32 3hfz h PRO 752 CO 0.66 0.67 -1.09 -0.22 -0.23 0.00 0.00 178.00 177.78 3hfz h LYS 753 N -0.01 0.11 -4.02 0.86 3.64 -2.00 -3.38 116.57 111.77 3hfz h LYS 753 Ca 0.03 -0.18 -0.21 0.00 -1.27 0.00 0.00 60.65 59.02 3hfz h LYS 753 Cb 0.58 0.07 -0.09 0.00 -0.41 0.00 0.00 32.23 32.38 3hfz h LYS 753 CO 0.03 1.09 -0.20 -0.98 -2.27 0.00 0.00 179.45 177.11 3hfz s ARG 754 N -2.69 1.75 0.80 1.90 1.04 -1.26 -4.97 118.95 115.52 3hfz s ARG 754 Ca -0.01 -1.60 -0.12 0.00 -1.04 0.00 0.00 55.73 52.96 3hfz s ARG 754 Cb 0.09 0.44 0.07 0.00 -2.04 0.00 0.00 34.95 33.51 3hfz s ARG 754 CO 0.85 -0.72 1.13 0.99 -0.04 0.00 0.00 175.30 177.51 3hfz s THR 755 N -3.40 2.59 -0.08 4.99 2.01 -1.26 -4.01 115.64 116.48 3hfz s THR 755 Ca 0.29 0.19 0.01 0.00 0.31 0.00 0.00 61.69 62.49 3hfz s THR 755 Cb 0.00 -3.09 -0.03 0.00 0.01 0.00 0.00 72.50 69.39 3hfz s THR 755 CO 0.16 -0.25 -0.10 -0.76 -0.69 0.00 0.00 174.62 172.98 3hfz s LEU 756 N -5.65 2.96 0.76 4.42 1.43 -1.26 -4.91 118.68 116.44 3hfz s LEU 756 Ca 0.61 -0.14 -0.11 0.00 -1.03 0.00 0.00 54.13 53.47 3hfz s LEU 756 Cb -0.12 -1.64 0.05 0.00 0.03 0.00 0.00 46.19 44.50 3hfz s LEU 756 CO 0.52 0.30 1.09 -0.13 0.23 0.00 0.00 176.35 178.35 3hfz s ARG 757 N -0.46 2.35 0.37 1.70 1.81 -1.26 -4.94 118.95 118.51 3hfz s ARG 757 Ca 0.06 1.12 0.15 0.00 -1.72 0.00 0.00 55.73 55.35 3hfz s ARG 757 Cb -0.12 -1.91 0.72 0.00 -0.45 0.00 0.00 34.95 33.19 3hfz s ARG 757 CO 0.02 -1.57 1.79 -0.44 -0.68 0.00 0.00 175.30 174.42 3hfz h ASP 758 N -1.07 0.00 0.14 0.23 3.32 -1.99 -2.48 116.42 114.56 3hfz h ASP 758 Ca -0.44 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.49 3hfz h ASP 758 Cb 1.23 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.77 3hfz h ASP 758 CO 0.52 0.39 -0.44 -0.33 -1.72 0.00 0.00 179.24 177.67 3hfz h GLU 759 N 0.00 0.37 0.00 3.56 3.07 -1.97 0.50 114.58 120.10 3hfz h GLU 759 Ca -0.00 -0.19 -0.11 0.00 -0.50 0.00 0.00 59.36 58.55 3hfz h GLU 759 Cb 0.76 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.66 3hfz h GLU 759 CO 0.05 0.74 -0.53 0.93 -1.40 0.00 0.00 179.01 178.81 3hfz h GLU 760 N 0.30 0.00 0.05 2.33 5.08 -1.82 -2.25 114.58 118.27 3hfz h GLU 760 Ca 0.02 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 58.05 3hfz h GLU 760 Cb 0.89 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.11 3hfz h GLU 760 CO 0.07 0.53 -1.84 0.28 -1.00 0.00 0.00 179.01 177.06 3hfz n VAL 761 N -3.62 1.63 0.08 3.13 0.31 -1.04 -2.58 118.33 116.25 3hfz n VAL 761 Ca -0.00 -0.37 0.05 0.00 -0.01 0.00 0.00 64.34 64.00 3hfz n VAL 761 Cb 0.60 -1.84 0.49 0.00 -0.91 0.00 0.00 33.84 32.18 3hfz n VAL 761 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 3hfz h GLU 762 N -0.47 0.36 0.00 5.55 4.39 -0.11 0.19 114.58 124.49 3hfz h GLU 762 Ca -0.45 -0.02 -0.14 0.00 0.34 0.00 0.00 59.36 59.09 3hfz h GLU 762 Cb 1.69 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 30.24 3hfz h GLU 762 CO -0.11 0.25 -0.99 1.49 -1.16 0.00 0.00 179.01 178.49 3hfz h GLU 763 N 0.38 0.00 0.00 2.33 4.22 -1.57 -3.10 114.58 116.84 3hfz h GLU 763 Ca 0.10 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.54 3hfz h GLU 763 Cb -0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.22 3hfz h GLU 763 CO -0.02 0.40 -0.25 0.00 -2.18 0.00 0.00 179.01 176.96 3hfz n ALA 764 N -2.32 2.69 -0.04 2.92 0.00 -0.47 -3.43 120.51 119.87 3hfz n ALA 764 Ca -0.04 -0.16 -0.15 0.00 0.00 0.00 0.00 53.44 53.09 3hfz n ALA 764 Cb 0.79 -1.33 -0.14 0.00 0.00 0.00 0.00 19.45 18.77 3hfz n ALA 764 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 3hfz n VAL 765 N -1.86 1.64 0.29 0.00 0.24 0.55 -3.90 118.33 115.29 3hfz n VAL 765 Ca 0.05 -0.72 0.16 0.00 -2.04 0.00 0.00 64.34 61.80 3hfz n VAL 765 Cb 0.39 -1.30 0.91 0.00 -1.47 0.00 0.00 33.84 32.36 3hfz n VAL 765 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 3hfz h SER 766 N 0.03 0.00 -0.10 -1.34 0.02 -1.60 0.02 113.55 110.58 3hfz h SER 766 Ca -0.42 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.42 3hfz h SER 766 Cb 2.04 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 64.56 3hfz h SER 766 CO 0.05 0.05 -0.32 0.03 -1.14 0.00 0.00 176.83 175.50 3hfz h ARG 767 N 0.00 0.58 0.00 3.45 2.47 -1.67 -1.91 114.38 117.30 3hfz h ARG 767 Ca -0.00 -0.26 0.00 0.00 -1.26 0.00 0.00 59.98 58.46 3hfz h ARG 767 Cb 0.18 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.48 3hfz h ARG 767 CO 0.01 0.83 -0.84 0.28 0.56 0.00 0.00 179.97 180.81 3hfz h VAL 768 N 0.50 0.00 0.00 2.04 2.07 -1.19 -3.14 116.25 116.53 3hfz h VAL 768 Ca 0.06 -0.69 0.00 0.00 0.82 0.00 0.00 66.70 66.89 3hfz h VAL 768 Cb 0.80 1.19 0.00 0.00 -1.52 0.00 0.00 31.29 31.76 3hfz h VAL 768 CO 0.07 0.00 -0.90 0.00 0.02 0.00 0.00 177.57 176.76 3hfz n ALA 769 N -1.97 3.01 -0.08 1.67 0.00 -0.53 -3.09 120.51 119.52 3hfz n ALA 769 Ca 0.02 -0.31 -0.16 0.00 0.00 0.00 0.00 53.44 52.99 3hfz n ALA 769 Cb 0.48 -1.07 -0.12 0.00 0.00 0.00 0.00 19.45 18.74 3hfz n ALA 769 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 3hfz h GLU 770 N 0.00 0.00 0.00 0.00 4.81 -1.43 -2.78 114.58 115.18 3hfz h GLU 770 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3hfz h GLU 770 Cb 0.80 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.18 3hfz h GLU 770 CO 0.00 0.95 0.00 0.00 -0.73 0.00 0.00 179.01 179.23 3hfz h ALA 771 N -0.22 1.00 0.10 2.92 0.00 -1.71 0.28 119.26 121.63 3hfz h ALA 771 Ca -0.12 0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.64 3hfz h ALA 771 Cb 1.06 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.87 3hfz h ALA 771 CO -0.07 0.00 -0.66 1.25 0.00 0.00 0.00 179.25 179.77 3hfz h LEU 772 N 0.00 0.42 -0.31 0.00 5.85 -1.63 -3.12 115.31 116.51 3hfz h LEU 772 Ca 0.00 -0.92 -0.19 0.00 0.84 0.00 0.00 57.88 57.61 3hfz h LEU 772 Cb 0.42 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 3hfz h LEU 772 CO 0.00 1.30 -0.85 0.03 -0.34 0.00 0.00 178.44 178.58 3hfz h ARG 773 N -0.40 0.22 0.00 1.25 3.08 -1.17 -0.79 114.38 116.57 3hfz h ARG 773 Ca -0.11 -0.23 0.00 0.00 0.07 0.00 0.00 59.98 59.71 3hfz h ARG 773 Cb 1.49 0.06 0.00 0.00 0.08 0.00 0.00 29.97 31.60 3hfz h ARG 773 CO 0.13 0.94 0.00 0.00 -1.07 0.00 0.00 179.97 179.97 3hfz n ALA 774 N -2.47 1.77 -0.04 0.04 0.00 0.96 -0.86 120.51 119.90 3hfz n ALA 774 Ca -0.04 -0.06 -0.01 0.00 0.00 0.00 0.00 53.44 53.34 3hfz n ALA 774 Cb 0.79 -1.18 -0.10 0.00 0.00 0.00 0.00 19.45 18.96 3hfz n ALA 774 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3hfz n ARG 775 N -1.17 1.29 0.00 0.00 5.12 -1.03 -5.01 116.66 115.87 3hfz n ARG 775 Ca 0.06 -0.06 0.00 0.00 -1.93 0.00 0.00 57.85 55.93 3hfz n ARG 775 Cb 0.07 -1.32 0.00 0.00 -1.16 0.00 0.00 32.46 30.04 3hfz n ARG 775 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3hfz n GLY 776 N 2.02 1.68 3.66 -0.13 0.00 -0.04 -5.10 105.19 107.27 3hfz n GLY 776 Ca -0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.56 3hfz n GLY 776 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hfz s PHE 777 N -2.00 3.05 0.00 1.61 0.08 -0.33 -4.88 117.98 115.51 3hfz s PHE 777 Ca 0.00 0.09 0.00 0.00 0.12 0.00 0.00 56.93 57.14 3hfz s PHE 777 Cb 0.00 -1.70 0.00 0.00 -0.57 0.00 0.00 43.02 40.75 3hfz s PHE 777 CO 0.00 0.43 0.00 0.41 -0.10 0.00 0.00 175.22 175.96 3hfz n GLY 778 N 1.75 1.40 3.15 4.36 0.00 -0.62 -3.07 105.19 112.16 3hfz n GLY 778 Ca -0.16 -1.57 0.05 0.00 0.00 0.00 0.00 46.02 44.34 3hfz n GLY 778 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3hfz s LEU 779 N 0.00 -0.75 0.03 0.99 2.96 -1.26 -3.85 118.68 116.81 3hfz s LEU 779 Ca 0.00 0.24 -0.21 0.00 -0.22 0.00 0.00 54.13 53.94 3hfz s LEU 779 Cb 0.00 1.53 -0.12 0.00 0.50 0.00 0.00 46.19 48.11 3hfz s LEU 779 CO 0.00 -0.14 1.27 -0.09 -1.32 0.00 0.00 176.35 176.07 3hfz h ARG 780 N 7.71 -0.73 -4.78 1.98 2.43 -1.74 -3.48 114.38 115.77 3hfz h ARG 780 Ca -0.11 0.05 -0.35 0.00 -0.81 0.00 0.00 59.98 58.76 3hfz h ARG 780 Cb 1.18 0.17 -0.14 0.00 -0.42 0.00 0.00 29.97 30.75 3hfz h ARG 780 CO -0.02 -0.49 -0.58 0.20 -1.51 0.00 0.00 179.97 177.58 3hfz s GLY 781 N -1.64 1.84 -0.24 2.80 0.00 -1.26 -5.00 107.32 103.82 3hfz s GLY 781 Ca -0.11 -1.80 -0.26 0.00 0.00 0.00 0.00 44.72 42.55 3hfz s GLY 781 CO 0.33 -1.50 0.76 -2.27 0.00 0.00 0.00 173.10 170.42 3hfz s LEU 782 N -3.29 -0.70 -0.28 0.66 0.20 -1.26 -3.72 118.68 110.30 3hfz s LEU 782 Ca 0.38 1.27 -0.01 0.00 0.69 0.00 0.00 54.13 56.46 3hfz s LEU 782 Cb 0.06 2.40 0.00 0.00 -0.43 0.00 0.00 46.19 48.22 3hfz s LEU 782 CO 0.17 -0.29 0.01 -0.67 -0.29 0.00 0.00 176.35 175.28 3hfz n ASP 783 N 2.36 -7.29 -3.58 3.68 2.03 -0.99 -5.01 116.55 107.75 3hfz n ASP 783 Ca -0.14 1.34 -0.26 0.00 0.52 0.00 0.00 54.79 56.25 3hfz n ASP 783 Cb 0.55 -5.06 -0.16 0.00 -0.72 0.00 0.00 41.12 35.73 3hfz n ASP 783 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 3hfz s THR 784 N -1.48 -0.11 -2.00 5.18 2.01 -1.26 -5.02 115.64 112.96 3hfz s THR 784 Ca -0.01 -0.29 0.15 0.00 0.31 0.00 0.00 61.69 61.85 3hfz s THR 784 Cb 0.00 -0.67 0.42 0.00 0.01 0.00 0.00 72.50 72.26 3hfz s THR 784 CO 0.74 -0.37 1.30 -0.81 -0.69 0.00 0.00 174.62 174.79