#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hyx s LYS 3 N 0.00 3.36 -0.22 0.00 -0.14 -1.26 -4.81 119.74 116.67 3hyx s LYS 3 Ca 0.00 0.92 0.01 0.00 -1.36 0.00 0.00 55.97 55.54 3hyx s LYS 3 Cb 0.00 -2.05 0.03 0.00 -1.68 0.00 0.00 37.83 34.14 3hyx s LYS 3 CO 0.00 -0.76 -0.14 -1.58 -0.76 0.00 0.00 175.35 172.11 3hyx s HIS 4 N -2.94 3.00 -0.08 3.18 5.65 -1.26 -1.77 115.29 121.06 3hyx s HIS 4 Ca 0.58 -1.83 0.01 0.00 0.25 0.00 0.00 55.06 54.07 3hyx s HIS 4 Cb -0.13 -1.96 -0.03 0.00 -1.18 0.00 0.00 32.58 29.29 3hyx s HIS 4 CO 0.49 -0.81 -0.09 0.54 -0.65 0.00 0.00 174.74 174.21 3hyx s VAL 5 N 1.24 3.48 -0.14 0.89 0.11 -0.39 -0.41 120.40 125.18 3hyx s VAL 5 Ca -0.00 -0.55 0.03 0.00 -2.93 0.00 0.00 61.98 58.52 3hyx s VAL 5 Cb -0.16 -2.43 0.01 0.00 -1.53 0.00 0.00 36.38 32.27 3hyx s VAL 5 CO -0.08 0.58 -0.22 0.68 -3.33 0.00 0.00 175.10 172.72 3hyx s VAL 6 N -0.51 2.03 -0.30 2.04 -7.23 -0.08 -1.21 120.40 115.12 3hyx s VAL 6 Ca 0.07 -0.96 -0.11 0.00 -1.81 0.00 0.00 61.98 59.18 3hyx s VAL 6 Cb -0.12 -1.79 -0.02 0.00 0.56 0.00 0.00 36.38 35.01 3hyx s VAL 6 CO 0.02 0.54 0.18 -0.69 -0.31 0.00 0.00 175.10 174.84 3hyx s VAL 7 N 0.81 4.96 -0.46 1.32 1.01 0.76 -0.85 120.40 127.94 3hyx s VAL 7 Ca -0.07 -0.17 -0.18 0.00 0.00 0.00 0.00 61.98 61.56 3hyx s VAL 7 Cb -0.16 -3.46 0.04 0.00 0.00 0.00 0.00 36.38 32.81 3hyx s VAL 7 CO -0.02 0.13 0.51 -0.63 0.00 0.00 0.00 175.10 175.09 3hyx s ILE 8 N 1.69 5.02 0.00 2.22 1.01 0.57 -1.26 121.20 130.46 3hyx s ILE 8 Ca 0.06 -0.51 0.00 0.00 0.00 0.00 0.00 60.65 60.20 3hyx s ILE 8 Cb -0.17 -4.16 0.00 0.00 0.01 0.00 0.00 42.46 38.15 3hyx s ILE 8 CO 0.08 -0.60 0.00 0.61 0.00 0.00 0.00 174.94 175.04 3hyx n GLY 9 N 5.15 3.71 2.29 6.18 0.00 0.78 -0.04 105.19 123.26 3hyx n GLY 9 Ca -0.08 -1.10 -0.33 0.00 0.00 0.00 0.00 46.02 44.52 3hyx n GLY 9 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hyx n GLY 10 N 0.00 5.69 0.00 -0.02 0.00 -1.26 -3.95 105.19 105.65 3hyx n GLY 10 Ca 0.00 -2.17 0.00 0.00 0.00 0.00 0.00 46.02 43.85 3hyx n GLY 10 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hyx n GLY 11 N -0.82 2.75 0.43 -0.02 0.00 -1.26 -4.47 105.19 101.80 3hyx n GLY 11 Ca 0.60 -1.96 -0.16 0.00 0.00 0.00 0.00 46.02 44.50 3hyx n GLY 11 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3hyx h VAL 12 N 0.00 0.13 0.23 1.61 2.07 -1.93 -1.72 116.25 116.65 3hyx h VAL 12 Ca 0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 3hyx h VAL 12 Cb 0.00 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 29.91 3hyx h VAL 12 CO 0.00 0.00 -0.11 1.23 0.02 0.00 0.00 177.57 178.71 3hyx h GLY 13 N -0.76 -0.33 0.23 2.17 0.00 -1.89 -1.48 103.07 101.02 3hyx h GLY 13 Ca -0.01 0.12 0.04 0.00 0.00 0.00 0.00 47.33 47.49 3hyx h GLY 13 CO -0.17 -0.12 -0.29 -1.33 0.00 0.00 0.00 176.54 174.63 3hyx h GLY 14 N -0.33 -0.40 0.99 4.60 0.00 -1.67 0.12 103.07 106.39 3hyx h GLY 14 Ca -0.03 0.36 -0.04 0.00 0.00 0.00 0.00 47.33 47.62 3hyx h GLY 14 CO 0.05 -0.22 0.22 -2.22 0.00 0.00 0.00 176.54 174.38 3hyx h ILE 15 N -0.38 1.23 -0.08 2.60 1.08 -1.29 -0.80 117.51 119.86 3hyx h ILE 15 Ca 0.09 -0.73 -0.01 0.00 -0.39 0.00 0.00 64.86 63.82 3hyx h ILE 15 Cb 0.52 0.62 -0.00 0.00 -3.07 0.00 0.00 36.82 34.89 3hyx h ILE 15 CO -0.32 0.28 0.03 0.00 -0.69 0.00 0.00 178.15 177.45 3hyx h ALA 16 N 1.07 0.11 -0.32 1.87 0.00 -0.90 -0.06 119.26 121.03 3hyx h ALA 16 Ca 0.19 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3hyx h ALA 16 Cb 0.22 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 3hyx h ALA 16 CO -0.01 -0.30 0.21 1.15 0.00 0.00 0.00 179.25 180.30 3hyx h THR 17 N -0.04 1.08 -0.29 0.00 2.02 -0.63 -0.66 112.91 114.39 3hyx h THR 17 Ca 0.03 -0.15 -0.01 0.00 0.77 0.00 0.00 66.41 67.05 3hyx h THR 17 Cb 0.19 0.61 -0.01 0.00 -1.74 0.00 0.00 68.15 67.20 3hyx h THR 17 CO -0.00 0.08 0.14 0.00 0.37 0.00 0.00 175.52 176.10 3hyx h ALA 18 N 1.12 0.37 -0.48 6.16 0.00 -0.99 -1.31 119.26 124.13 3hyx h ALA 18 Ca 0.12 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 3hyx h ALA 18 Cb -0.05 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 3hyx h ALA 18 CO -0.03 -0.07 0.12 1.88 0.00 0.00 0.00 179.25 181.15 3hyx h TYR 19 N 0.33 0.79 -0.38 0.00 -1.99 -0.86 -0.93 116.97 113.93 3hyx h TYR 19 Ca 0.10 -0.09 0.03 0.00 2.00 0.00 0.00 58.73 60.77 3hyx h TYR 19 Cb 0.12 -0.22 -0.03 0.00 2.00 0.00 0.00 36.73 38.59 3hyx h TYR 19 CO -0.02 0.72 0.18 -0.91 -0.00 0.00 0.00 178.16 178.13 3hyx h ASN 20 N 0.64 0.25 0.20 3.88 2.35 -0.98 -1.01 115.58 120.90 3hyx h ASN 20 Ca 0.15 0.02 0.01 0.00 -0.55 0.00 0.00 56.30 55.93 3hyx h ASN 20 Cb 0.32 -0.02 -0.02 0.00 0.05 0.00 0.00 38.32 38.65 3hyx h ASN 20 CO 0.00 0.19 -0.23 -0.07 -1.65 0.00 0.00 177.43 175.66 3hyx h LEU 21 N 0.37 -0.63 -1.74 1.61 3.38 -0.92 0.69 115.31 118.05 3hyx h LEU 21 Ca 0.17 0.06 0.11 0.00 0.09 0.00 0.00 57.88 58.31 3hyx h LEU 21 Cb 0.09 0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.03 3hyx h LEU 21 CO -0.13 -0.34 0.38 -0.09 0.09 0.00 0.00 178.44 178.36 3hyx h ARG 22 N -0.48 0.27 0.00 1.13 9.65 -0.96 0.94 114.38 124.93 3hyx h ARG 22 Ca 0.01 -0.02 -0.16 0.00 -1.10 0.00 0.00 59.98 58.71 3hyx h ARG 22 Cb 0.46 -0.06 -0.02 0.00 -1.39 0.00 0.00 29.97 28.95 3hyx h ARG 22 CO -0.08 0.18 -0.91 -0.91 2.80 0.00 0.00 179.97 181.05 3hyx h ASN 23 N 0.28 0.00 0.43 -3.80 -0.26 -0.56 -3.14 115.58 108.53 3hyx h ASN 23 Ca 0.26 0.00 -0.24 0.00 -0.56 0.00 0.00 56.30 55.76 3hyx h ASN 23 Cb 0.65 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.92 3hyx h ASN 23 CO -0.06 0.70 -1.02 -0.07 -1.06 0.00 0.00 177.43 175.91 3hyx h LEU 24 N 0.00 0.49 -6.58 1.61 3.38 -0.17 -3.43 115.31 110.60 3hyx h LEU 24 Ca -0.06 -0.42 -0.58 0.00 0.09 0.00 0.00 57.88 56.91 3hyx h LEU 24 Cb 1.58 -0.15 -0.39 0.00 0.09 0.00 0.00 40.66 41.79 3hyx h LEU 24 CO 0.08 1.25 -0.86 -0.32 0.09 0.00 0.00 178.44 178.68 3hyx s MET 25 N -3.09 0.61 0.50 1.13 0.00 0.26 -5.00 119.30 113.71 3hyx s MET 25 Ca -0.05 -1.43 0.19 0.00 0.00 0.00 0.00 55.69 54.40 3hyx s MET 25 Cb 0.08 -1.36 1.26 0.00 0.00 0.00 0.00 34.83 34.82 3hyx s MET 25 CO 0.87 -1.23 2.03 -1.35 0.00 0.00 0.00 175.02 175.35 3hyx h PRO 26 N 6.87 0.11 -0.70 4.11 0.11 -1.79 -2.34 132.00 138.37 3hyx h PRO 26 Ca 0.08 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.18 3hyx h PRO 26 Cb 0.96 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.05 3hyx h PRO 26 CO 0.28 0.07 0.00 -0.40 -0.21 0.00 0.00 178.00 177.75 3hyx n ASP 27 N -4.45 4.15 -4.74 -2.05 5.75 -1.26 -4.91 116.55 109.04 3hyx n ASP 27 Ca 0.06 -2.15 -0.39 0.00 -0.01 0.00 0.00 54.79 52.30 3hyx n ASP 27 Cb 0.40 -0.52 -0.05 0.00 -1.03 0.00 0.00 41.12 39.92 3hyx n ASP 27 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 3hyx s LEU 28 N -1.28 4.36 -0.13 -2.12 2.96 -0.88 -4.68 118.68 116.91 3hyx s LEU 28 Ca 0.49 1.08 -0.25 0.00 -0.22 0.00 0.00 54.13 55.22 3hyx s LEU 28 Cb 0.28 -2.89 -0.02 0.00 0.50 0.00 0.00 46.19 44.05 3hyx s LEU 28 CO 0.30 0.03 0.81 -0.54 -1.32 0.00 0.00 176.35 175.63 3hyx s LYS 29 N 0.22 4.35 -0.11 1.98 1.02 -0.73 -4.93 119.74 121.55 3hyx s LYS 29 Ca 0.31 1.01 0.03 0.00 0.02 0.00 0.00 55.97 57.34 3hyx s LYS 29 Cb -0.17 -3.53 -0.00 0.00 -0.52 0.00 0.00 37.83 33.60 3hyx s LYS 29 CO 0.16 -0.21 -0.22 0.42 -0.92 0.00 0.00 175.35 174.57 3hyx s ILE 30 N 1.72 2.20 -0.16 2.17 1.01 -1.26 -1.27 121.20 125.61 3hyx s ILE 30 Ca 0.39 -0.97 0.01 0.00 0.00 0.00 0.00 60.65 60.08 3hyx s ILE 30 Cb -0.17 -1.85 0.01 0.00 0.01 0.00 0.00 42.46 40.45 3hyx s ILE 30 CO 0.15 0.55 -0.18 -0.89 0.00 0.00 0.00 174.94 174.58 3hyx s THR 31 N 0.40 2.36 -0.25 2.92 2.01 -0.35 -1.14 115.64 121.58 3hyx s THR 31 Ca -0.17 -0.86 -0.05 0.00 0.31 0.00 0.00 61.69 60.92 3hyx s THR 31 Cb -0.17 -1.99 -0.00 0.00 0.01 0.00 0.00 72.50 70.34 3hyx s THR 31 CO 0.07 0.52 0.02 -0.22 -0.69 0.00 0.00 174.62 174.33 3hyx s LEU 32 N 1.02 3.36 -0.19 4.42 0.20 0.11 -0.17 118.68 127.42 3hyx s LEU 32 Ca -0.02 -0.50 -0.07 0.00 0.69 0.00 0.00 54.13 54.22 3hyx s LEU 32 Cb -0.15 -1.82 -0.04 0.00 -0.43 0.00 0.00 46.19 43.76 3hyx s LEU 32 CO -0.05 -0.09 0.07 -0.63 -0.29 0.00 0.00 176.35 175.36 3hyx s ILE 33 N 1.50 4.76 -0.08 6.68 1.01 -0.39 -0.45 121.20 134.24 3hyx s ILE 33 Ca 0.04 -0.04 -0.08 0.00 0.00 0.00 0.00 60.65 60.57 3hyx s ILE 33 Cb -0.16 -3.16 0.02 0.00 0.01 0.00 0.00 42.46 39.18 3hyx s ILE 33 CO -0.00 0.44 0.23 -0.55 0.00 0.00 0.00 174.94 175.06 3hyx s SER 34 N 0.51 -0.23 0.00 3.58 0.15 -0.26 -0.16 113.70 117.29 3hyx s SER 34 Ca 0.03 0.43 0.18 0.00 0.70 0.00 0.00 55.95 57.29 3hyx s SER 34 Cb -0.13 0.46 1.04 0.00 -1.71 0.00 0.00 66.02 65.68 3hyx s SER 34 CO 0.01 -0.10 1.68 -0.90 1.20 0.00 0.00 173.24 175.12 3hyx n ASP 35 N 2.84 0.20 -4.10 5.45 5.75 -1.21 -1.77 116.55 123.72 3hyx n ASP 35 Ca -0.13 -1.47 -0.23 0.00 -0.01 0.00 0.00 54.79 52.95 3hyx n ASP 35 Cb 0.58 -0.01 -0.15 0.00 -1.03 0.00 0.00 41.12 40.50 3hyx n ASP 35 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 3hyx s ARG 36 N -1.97 1.32 0.00 0.11 0.52 -1.26 -4.88 118.95 112.79 3hyx s ARG 36 Ca 0.28 -0.51 0.26 0.00 -0.52 0.00 0.00 55.73 55.23 3hyx s ARG 36 Cb 0.13 -1.22 1.48 0.00 0.52 0.00 0.00 34.95 35.86 3hyx s ARG 36 CO 0.22 0.26 1.96 -0.35 0.02 0.00 0.00 175.30 177.40 3hyx n PRO 37 N 2.94 1.06 -4.32 3.54 -0.04 -1.26 -4.80 135.00 132.12 3hyx n PRO 37 Ca -0.16 -0.09 -0.18 0.00 -0.04 0.00 0.00 63.50 63.03 3hyx n PRO 37 Cb 0.54 -1.41 -0.10 0.00 -0.04 0.00 0.00 33.50 32.49 3hyx n PRO 37 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 3hyx s TYR 38 N -1.99 1.62 -0.18 0.54 -0.85 -1.26 -0.61 117.35 114.62 3hyx s TYR 38 Ca 0.38 -0.59 -0.15 0.00 -0.52 0.00 0.00 57.07 56.20 3hyx s TYR 38 Cb 0.18 -0.78 -0.04 0.00 0.38 0.00 0.00 41.96 41.70 3hyx s TYR 38 CO 0.30 0.29 0.34 0.12 -1.52 0.00 0.00 175.55 175.08 3hyx s PHE 39 N -2.83 3.42 -0.24 -3.49 5.36 0.99 -4.85 117.98 116.33 3hyx s PHE 39 Ca 0.19 0.59 -0.15 0.00 -0.96 0.00 0.00 56.93 56.61 3hyx s PHE 39 Cb -0.01 -2.43 -0.04 0.00 -0.34 0.00 0.00 43.02 40.20 3hyx s PHE 39 CO 0.05 0.12 0.37 0.20 -1.46 0.00 0.00 175.22 174.50 3hyx s GLY 40 N 0.77 1.96 -1.07 13.12 0.00 -1.26 -2.49 107.32 118.35 3hyx s GLY 40 Ca 0.17 -0.72 -0.19 0.00 0.00 0.00 0.00 44.72 43.98 3hyx s GLY 40 CO 0.06 0.88 1.39 -0.12 0.00 0.00 0.00 173.10 175.31 3hyx s PHE 41 N 1.73 2.92 0.26 1.90 5.36 -1.05 -4.73 117.98 124.36 3hyx s PHE 41 Ca 0.16 -1.36 -0.03 0.00 -0.96 0.00 0.00 56.93 54.74 3hyx s PHE 41 Cb -0.15 -4.51 0.44 0.00 -0.34 0.00 0.00 43.02 38.46 3hyx s PHE 41 CO 0.09 -1.68 1.82 1.79 -1.46 0.00 0.00 175.22 175.78 3hyx h THR 42 N 5.94 0.93 0.00 0.12 1.35 -1.94 -1.81 112.91 117.49 3hyx h THR 42 Ca 0.25 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.80 3hyx h THR 42 Cb 0.97 -0.03 0.00 0.00 -1.73 0.00 0.00 68.15 67.36 3hyx h THR 42 CO 1.30 0.16 0.17 -2.65 -0.25 0.00 0.00 175.52 174.25 3hyx n PRO 43 N -4.69 0.03 -0.04 4.72 -0.02 -1.26 -1.21 135.00 132.54 3hyx n PRO 43 Ca 0.15 0.43 0.07 0.00 -2.02 0.00 0.00 63.50 62.13 3hyx n PRO 43 Cb 0.29 -1.78 0.08 0.00 -0.02 0.00 0.00 33.50 32.07 3hyx n PRO 43 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hyx n ALA 44 N -1.44 2.43 -0.12 3.55 0.00 -0.68 -4.63 120.51 119.61 3hyx n ALA 44 Ca -0.00 -0.71 -0.00 0.00 0.00 0.00 0.00 53.44 52.73 3hyx n ALA 44 Cb 0.17 -0.47 0.26 0.00 0.00 0.00 0.00 19.45 19.42 3hyx n ALA 44 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 3hyx h PHE 45 N 2.61 0.79 -0.93 0.00 -1.00 -1.26 -2.26 116.94 114.89 3hyx h PHE 45 Ca 0.00 -0.03 0.01 0.00 2.81 0.00 0.00 57.97 60.77 3hyx h PHE 45 Cb 0.60 -0.25 -0.05 0.00 3.61 0.00 0.00 35.95 39.87 3hyx h PHE 45 CO 0.05 0.59 0.62 -1.35 -1.61 0.00 0.00 178.31 176.61 3hyx h PRO 46 N 0.79 1.22 -0.00 1.51 0.11 -1.82 -0.65 132.00 133.16 3hyx h PRO 46 Ca 0.20 -0.07 -0.06 0.00 0.11 0.00 0.00 66.00 66.17 3hyx h PRO 46 Cb 0.10 -0.28 -0.01 0.00 0.11 0.00 0.00 31.00 30.93 3hyx h PRO 46 CO -0.02 0.81 -0.30 0.45 -0.21 0.00 0.00 178.00 178.72 3hyx h HIS 47 N 1.26 0.01 -0.32 0.65 3.86 -1.79 -0.42 115.15 118.39 3hyx h HIS 47 Ca 0.35 -0.00 -0.17 0.00 -1.16 0.00 0.00 60.37 59.39 3hyx h HIS 47 Cb -0.13 -0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.33 3hyx h HIS 47 CO -0.01 0.30 -0.46 1.25 0.86 0.00 0.00 177.93 179.88 3hyx h LEU 48 N 0.01 0.91 -0.89 2.43 5.85 -0.81 0.35 115.31 123.15 3hyx h LEU 48 Ca -0.00 -0.44 -0.07 0.00 0.84 0.00 0.00 57.88 58.20 3hyx h LEU 48 Cb 0.53 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.28 3hyx h LEU 48 CO 0.04 1.22 0.02 0.00 -0.34 0.00 0.00 178.44 179.38 3hyx h ALA 49 N 0.81 1.08 0.00 1.25 0.00 -0.67 -2.49 119.26 119.23 3hyx h ALA 49 Ca 0.04 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.69 3hyx h ALA 49 Cb 1.04 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.63 3hyx h ALA 49 CO 0.10 0.58 0.00 0.52 0.00 0.00 0.00 179.25 180.46 3hyx h MET 50 N 0.79 0.00 -0.12 0.00 2.86 -0.88 -3.17 114.93 114.41 3hyx h MET 50 Ca 0.15 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.79 3hyx h MET 50 Cb 0.44 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.10 3hyx h MET 50 CO 0.02 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.40 3hyx n GLY 51 N 0.36 0.81 0.80 8.32 0.00 0.17 -4.98 105.19 110.66 3hyx n GLY 51 Ca 0.02 -0.64 0.07 0.00 0.00 0.00 0.00 46.02 45.46 3hyx n GLY 51 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3hyx n TRP 52 N -3.03 0.61 -3.96 1.61 8.01 0.10 -4.95 117.44 115.83 3hyx n TRP 52 Ca 0.00 -0.53 -0.11 0.00 -1.31 0.00 0.00 57.50 55.55 3hyx n TRP 52 Cb 0.37 -0.05 -0.13 0.00 -2.01 0.00 0.00 31.31 29.50 3hyx n TRP 52 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.69 177.71 3hyx s ARG 53 N -1.16 0.21 -0.04 -0.99 1.81 -1.22 -4.91 118.95 112.66 3hyx s ARG 53 Ca 0.29 -0.31 -0.18 0.00 -1.72 0.00 0.00 55.73 53.80 3hyx s ARG 53 Cb 0.16 -0.04 -0.05 0.00 -0.45 0.00 0.00 34.95 34.57 3hyx s ARG 53 CO 0.18 0.00 0.51 0.15 -0.68 0.00 0.00 175.30 175.46 3hyx s LYS 54 N -0.69 4.24 0.37 3.54 1.02 -1.26 -4.75 119.74 122.21 3hyx s LYS 54 Ca -0.06 0.56 0.14 0.00 0.02 0.00 0.00 55.97 56.62 3hyx s LYS 54 Cb -0.05 -3.35 0.97 0.00 -0.52 0.00 0.00 37.83 34.89 3hyx s LYS 54 CO -0.00 0.37 1.80 0.35 -0.92 0.00 0.00 175.35 176.95 3hyx h PHE 55 N 5.78 0.77 0.00 3.18 3.04 -1.98 0.12 116.94 127.85 3hyx h PHE 55 Ca -0.45 0.02 -0.02 0.00 3.98 0.00 0.00 57.97 61.50 3hyx h PHE 55 Cb 1.20 -0.23 -0.00 0.00 2.56 0.00 0.00 35.95 39.47 3hyx h PHE 55 CO 0.66 0.15 -0.12 0.93 -2.02 0.00 0.00 178.31 177.91 3hyx h GLU 56 N 0.53 0.00 0.00 1.11 3.07 -1.93 -2.65 114.58 114.70 3hyx h GLU 56 Ca 0.55 0.00 -0.13 0.00 -0.50 0.00 0.00 59.36 59.28 3hyx h GLU 56 Cb 1.19 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 29.09 3hyx h GLU 56 CO -0.29 0.12 -0.63 -0.44 -1.40 0.00 0.00 179.01 176.37 3hyx h ASP 57 N 0.00 0.00 -0.30 1.42 3.32 -1.16 -3.32 116.42 116.38 3hyx h ASP 57 Ca -0.00 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.93 3hyx h ASP 57 Cb 0.29 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.77 3hyx h ASP 57 CO 0.02 0.63 -0.07 2.30 -1.72 0.00 0.00 179.24 180.39 3hyx n ILE 58 N -3.36 2.44 -4.05 0.35 -5.35 -1.02 -4.99 119.36 103.38 3hyx n ILE 58 Ca 0.01 -2.54 -0.08 0.00 -0.27 0.00 0.00 62.75 59.87 3hyx n ILE 58 Cb 0.74 -0.30 -0.10 0.00 -1.74 0.00 0.00 39.64 38.24 3hyx n ILE 58 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 3hyx s SER 59 N -2.45 0.40 -0.17 7.28 1.04 -1.12 -2.54 113.70 116.14 3hyx s SER 59 Ca 0.43 -0.79 -0.03 0.00 0.48 0.00 0.00 55.95 56.05 3hyx s SER 59 Cb 0.38 0.15 0.05 0.00 0.10 0.00 0.00 66.02 66.71 3hyx s SER 59 CO 0.02 -0.47 0.03 -0.69 0.98 0.00 0.00 173.24 173.11 3hyx s VAL 60 N -2.87 0.50 0.25 5.02 1.01 -1.04 -4.93 120.40 118.35 3hyx s VAL 60 Ca -0.03 -0.44 -0.30 0.00 0.00 0.00 0.00 61.98 61.21 3hyx s VAL 60 Cb 0.00 -0.95 -0.11 0.00 0.00 0.00 0.00 36.38 35.33 3hyx s VAL 60 CO -0.06 -0.13 1.56 -2.84 0.00 0.00 0.00 175.10 173.63 3hyx s PRO 61 N 1.88 4.18 -0.10 2.72 0.02 -1.26 -0.00 135.00 142.43 3hyx s PRO 61 Ca 0.00 2.47 0.04 0.00 0.02 0.00 0.00 61.00 63.53 3hyx s PRO 61 Cb -0.16 -3.07 -0.24 0.00 0.02 0.00 0.00 34.50 31.04 3hyx s PRO 61 CO -0.08 -0.58 0.44 1.28 -0.33 0.00 0.00 177.00 177.74 3hyx n LEU 62 N 2.67 1.75 -0.09 -5.54 4.77 0.22 -4.21 117.00 116.57 3hyx n LEU 62 Ca 0.09 0.27 -0.06 0.00 -0.03 0.00 0.00 56.01 56.28 3hyx n LEU 62 Cb 0.38 -0.46 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 3hyx n LEU 62 CO 0.62 0.64 0.73 0.00 -1.33 0.00 0.00 177.39 178.05 3hyx h ALA 63 N 0.52 0.05 0.00 -1.18 0.00 -1.92 0.33 119.26 117.06 3hyx h ALA 63 Ca -0.38 0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.65 3hyx h ALA 63 Cb 2.03 0.45 0.00 0.00 0.00 0.00 0.00 17.79 20.27 3hyx h ALA 63 CO 0.07 -0.58 0.00 -2.30 0.00 0.00 0.00 179.25 176.44 3hyx n PRO 64 N -5.36 0.91 -0.08 0.00 -0.02 -1.26 -4.36 135.00 124.82 3hyx n PRO 64 Ca 0.01 0.00 -0.18 0.00 -2.02 0.00 0.00 63.50 61.32 3hyx n PRO 64 Cb 0.27 -1.50 -0.06 0.00 -0.02 0.00 0.00 33.50 32.20 3hyx n PRO 64 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 3hyx n LEU 65 N -1.04 1.34 -0.26 2.45 7.94 -0.01 -4.66 117.00 122.77 3hyx n LEU 65 Ca 0.22 0.23 -0.01 0.00 -1.11 0.00 0.00 56.01 55.34 3hyx n LEU 65 Cb 0.12 -0.55 0.18 0.00 0.53 0.00 0.00 43.42 43.70 3hyx n LEU 65 CO 0.18 0.26 1.20 -0.07 -1.11 0.00 0.00 177.39 177.85 3hyx h LEU 66 N -0.66 0.97 -1.88 -1.96 3.38 -1.44 -1.58 115.31 112.15 3hyx h LEU 66 Ca -0.40 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.51 3hyx h LEU 66 Cb 1.30 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.80 3hyx h LEU 66 CO -0.24 0.75 0.13 -0.65 0.09 0.00 0.00 178.44 178.51 3hyx h PRO 67 N 1.11 0.00 0.00 1.13 0.11 -1.75 0.15 132.00 132.74 3hyx h PRO 67 Ca 0.29 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.35 3hyx h PRO 67 Cb -0.03 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.07 3hyx h PRO 67 CO -0.05 0.00 -0.23 0.87 -0.21 0.00 0.00 178.00 178.38 3hyx h LYS 68 N 0.00 0.00 -0.35 1.05 1.57 -1.55 -2.98 116.57 114.32 3hyx h LYS 68 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3hyx h LYS 68 Cb 0.25 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.56 3hyx h LYS 68 CO 0.00 0.23 0.00 1.19 -0.57 0.00 0.00 179.45 180.30 3hyx n PHE 69 N -3.38 1.13 -3.68 -1.35 3.72 0.44 -4.95 117.46 109.39 3hyx n PHE 69 Ca 0.00 -0.80 -0.26 0.00 -0.05 0.00 0.00 57.45 56.35 3hyx n PHE 69 Cb 0.44 -0.32 0.06 0.00 -0.94 0.00 0.00 39.48 38.73 3hyx n PHE 69 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 3hyx n ASN 70 N -0.11 -5.93 -4.35 4.37 3.02 -1.08 -4.99 115.26 106.19 3hyx n ASN 70 Ca 0.22 -0.60 -0.36 0.00 -0.03 0.00 0.00 54.58 53.81 3hyx n ASN 70 Cb 0.90 -4.68 -0.13 0.00 -0.61 0.00 0.00 39.78 35.25 3hyx n ASN 70 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3hyx s ILE 71 N -3.31 3.74 -0.11 2.41 1.01 -0.67 -4.47 121.20 119.79 3hyx s ILE 71 Ca 0.61 -0.43 -0.30 0.00 0.00 0.00 0.00 60.65 60.53 3hyx s ILE 71 Cb -0.28 -2.76 -0.02 0.00 0.01 0.00 0.00 42.46 39.42 3hyx s ILE 71 CO 0.75 0.34 1.15 -0.70 0.00 0.00 0.00 174.94 176.48 3hyx s GLU 72 N 1.52 4.33 -0.19 2.79 2.12 -0.29 -3.12 118.70 125.85 3hyx s GLU 72 Ca 0.05 1.57 -0.07 0.00 0.36 0.00 0.00 54.97 56.88 3hyx s GLU 72 Cb -0.15 -3.61 -0.04 0.00 0.26 0.00 0.00 34.13 30.59 3hyx s GLU 72 CO -0.00 -0.50 0.06 0.12 -0.54 0.00 0.00 175.26 174.39 3hyx s PHE 73 N 2.58 3.21 -0.27 5.30 2.19 -1.26 0.06 117.98 129.80 3hyx s PHE 73 Ca 0.52 -0.02 -0.02 0.00 0.33 0.00 0.00 56.93 57.75 3hyx s PHE 73 Cb -0.21 -2.09 0.03 0.00 -1.31 0.00 0.00 43.02 39.44 3hyx s PHE 73 CO 0.17 0.07 -0.04 0.42 1.83 0.00 0.00 175.22 177.68 3hyx s ILE 74 N 0.53 2.91 -1.37 3.12 1.01 0.41 -4.97 121.20 122.83 3hyx s ILE 74 Ca 0.03 -1.16 -0.11 0.00 0.00 0.00 0.00 60.65 59.41 3hyx s ILE 74 Cb -0.13 -2.55 0.10 0.00 0.01 0.00 0.00 42.46 39.89 3hyx s ILE 74 CO 0.01 0.09 2.10 -3.20 0.00 0.00 0.00 174.94 173.94 3hyx n ASN 75 N 4.65 4.92 -3.67 3.58 5.15 -1.26 -1.11 115.26 127.52 3hyx n ASN 75 Ca -0.15 -2.98 -0.10 0.00 -0.60 0.00 0.00 54.58 50.75 3hyx n ASN 75 Cb 0.46 -1.55 -0.05 0.00 -0.53 0.00 0.00 39.78 38.11 3hyx n ASN 75 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 3hyx s GLU 76 N 1.52 1.03 -0.02 1.20 2.02 -0.73 -4.92 118.70 118.80 3hyx s GLU 76 Ca 0.45 -0.73 -0.29 0.00 0.02 0.00 0.00 54.97 54.42 3hyx s GLU 76 Cb 0.12 0.45 -0.03 0.00 0.10 0.00 0.00 34.13 34.77 3hyx s GLU 76 CO -0.04 -0.39 0.95 0.21 0.02 0.00 0.00 175.26 176.01 3hyx s LYS 77 N -3.75 4.54 -0.21 1.61 2.20 -1.26 -3.26 119.74 119.60 3hyx s LYS 77 Ca 0.03 1.35 -0.29 0.00 -0.36 0.00 0.00 55.97 56.70 3hyx s LYS 77 Cb 0.02 -3.46 -0.01 0.00 -1.51 0.00 0.00 37.83 32.86 3hyx s LYS 77 CO -0.11 -0.06 1.32 0.00 -0.36 0.00 0.00 175.35 176.14 3hyx s ALA 78 N 1.06 3.54 -0.17 3.13 0.00 -1.26 -0.21 121.76 127.84 3hyx s ALA 78 Ca 0.50 0.37 -0.18 0.00 0.00 0.00 0.00 51.96 52.65 3hyx s ALA 78 Cb -0.20 -3.69 -0.14 0.00 0.00 0.00 0.00 23.12 19.08 3hyx s ALA 78 CO 0.26 -1.43 0.17 1.49 0.00 0.00 0.00 175.76 176.25 3hyx h GLU 79 N 8.79 0.00 -4.75 0.00 4.81 -0.19 -3.43 114.58 119.81 3hyx h GLU 79 Ca -0.27 0.00 -0.25 0.00 -0.13 0.00 0.00 59.36 58.70 3hyx h GLU 79 Cb 1.11 0.00 -0.15 0.00 0.63 0.00 0.00 28.75 30.34 3hyx h GLU 79 CO 0.99 0.66 -0.69 -1.54 -0.73 0.00 0.00 179.01 177.70 3hyx s SER 80 N -6.37 1.25 -0.13 1.04 1.04 -0.74 -3.72 113.70 106.07 3hyx s SER 80 Ca -0.21 -1.05 0.00 0.00 0.48 0.00 0.00 55.95 55.17 3hyx s SER 80 Cb 0.03 0.09 0.02 0.00 0.10 0.00 0.00 66.02 66.26 3hyx s SER 80 CO 0.46 -0.47 -0.12 -0.63 0.98 0.00 0.00 173.24 173.46 3hyx s ILE 81 N -3.59 1.36 -0.61 -1.02 1.01 -1.24 -1.30 121.20 115.80 3hyx s ILE 81 Ca 0.16 -0.50 -0.17 0.00 0.00 0.00 0.00 60.65 60.14 3hyx s ILE 81 Cb 0.05 -1.31 0.14 0.00 0.01 0.00 0.00 42.46 41.35 3hyx s ILE 81 CO -0.02 0.42 0.62 -0.62 0.00 0.00 0.00 174.94 175.35 3hyx s ASP 82 N 1.57 6.30 0.36 3.58 -1.08 -0.34 -3.20 116.67 123.85 3hyx s ASP 82 Ca 0.05 -1.85 0.19 0.00 -0.52 0.00 0.00 52.55 50.42 3hyx s ASP 82 Cb -0.13 -2.24 0.32 0.00 -1.46 0.00 0.00 42.92 39.41 3hyx s ASP 82 CO -0.10 -0.89 1.57 1.55 0.52 0.00 0.00 175.17 177.82 3hyx h PRO 83 N 8.79 0.00 0.05 4.34 0.13 -1.95 -0.89 132.00 142.46 3hyx h PRO 83 Ca -0.22 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.68 3hyx h PRO 83 Cb 1.08 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.20 3hyx h PRO 83 CO 1.01 0.29 -1.06 -0.44 -0.23 0.00 0.00 178.00 177.58 3hyx h ASP 84 N 0.00 0.19 0.07 1.44 3.32 -1.96 -3.25 116.42 116.23 3hyx h ASP 84 Ca -0.00 -0.20 0.00 0.00 0.02 0.00 0.00 57.03 56.85 3hyx h ASP 84 Cb 1.14 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.63 3hyx h ASP 84 CO 0.04 1.12 -0.17 0.00 -1.72 0.00 0.00 179.24 178.51 3hyx n ALA 85 N -2.44 2.89 -3.52 3.45 0.00 -1.21 -5.00 120.51 114.68 3hyx n ALA 85 Ca -0.04 -0.50 -0.24 0.00 0.00 0.00 0.00 53.44 52.66 3hyx n ALA 85 Cb 0.94 -1.04 0.04 0.00 0.00 0.00 0.00 19.45 19.39 3hyx n ALA 85 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3hyx n ASN 86 N 0.05 -5.90 -3.83 0.00 3.02 -0.61 -4.92 115.26 103.07 3hyx n ASN 86 Ca 0.14 -0.83 -0.12 0.00 -0.03 0.00 0.00 54.58 53.75 3hyx n ASN 86 Cb 0.41 -3.85 -0.10 0.00 -0.61 0.00 0.00 39.78 35.63 3hyx n ASN 86 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3hyx s THR 87 N -3.34 0.05 -0.02 3.41 2.01 -0.44 -1.64 115.64 115.66 3hyx s THR 87 Ca 0.37 -0.41 0.05 0.00 0.31 0.00 0.00 61.69 62.01 3hyx s THR 87 Cb -0.11 -0.41 -0.03 0.00 0.01 0.00 0.00 72.50 71.96 3hyx s THR 87 CO 0.83 -0.22 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.67 3hyx s VAL 88 N -0.83 2.79 -0.10 3.82 1.01 0.00 -1.20 120.40 125.89 3hyx s VAL 88 Ca -0.09 -0.92 0.04 0.00 0.00 0.00 0.00 61.98 61.01 3hyx s VAL 88 Cb -0.05 -2.09 0.00 0.00 0.00 0.00 0.00 36.38 34.24 3hyx s VAL 88 CO 0.01 0.52 -0.24 -0.89 0.00 0.00 0.00 175.10 174.51 3hyx s THR 89 N -0.76 2.05 0.83 3.92 2.01 -0.42 -1.40 115.64 121.87 3hyx s THR 89 Ca 0.12 -1.01 -0.08 0.00 0.31 0.00 0.00 61.69 61.04 3hyx s THR 89 Cb -0.10 -1.77 0.16 0.00 0.01 0.00 0.00 72.50 70.79 3hyx s THR 89 CO 0.01 0.56 1.15 0.42 -0.69 0.00 0.00 174.62 176.07 3hyx s THR 90 N 0.39 2.06 0.13 -0.82 -4.23 -1.09 0.47 115.64 112.55 3hyx s THR 90 Ca -0.18 -0.33 -0.19 0.00 -1.18 0.00 0.00 61.69 59.81 3hyx s THR 90 Cb -0.18 -2.73 -0.05 0.00 1.34 0.00 0.00 72.50 70.88 3hyx s THR 90 CO 0.08 0.00 1.76 -0.61 -0.54 0.00 0.00 174.62 175.31 3hyx h GLN 91 N -1.04 0.22 0.00 3.99 5.75 -0.93 -1.09 115.11 122.00 3hyx h GLN 91 Ca -0.40 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.09 3hyx h GLN 91 Cb 1.25 -0.05 0.00 0.00 1.07 0.00 0.00 27.48 29.75 3hyx h GLN 91 CO 0.39 0.14 0.00 -1.13 -2.65 0.00 0.00 178.83 175.58 3hyx n SER 92 N -5.00 0.00 0.00 -0.69 3.41 -1.26 -4.86 113.62 105.22 3hyx n SER 92 Ca -0.03 -0.25 0.00 0.00 -0.26 0.00 0.00 58.87 58.33 3hyx n SER 92 Cb 0.06 -0.15 0.00 0.00 -0.26 0.00 0.00 64.21 63.86 3hyx n SER 92 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hyx n GLY 93 N 0.15 0.53 3.58 5.00 0.00 -0.41 -5.04 105.19 109.00 3hyx n GLY 93 Ca 0.11 -0.80 -0.41 0.00 0.00 0.00 0.00 46.02 44.91 3hyx n GLY 93 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3hyx s LYS 94 N -3.68 3.76 -0.20 1.61 2.20 -1.26 -4.79 119.74 117.38 3hyx s LYS 94 Ca 0.00 0.06 -0.28 0.00 -0.36 0.00 0.00 55.97 55.39 3hyx s LYS 94 Cb 0.00 -3.77 0.00 0.00 -1.51 0.00 0.00 37.83 32.55 3hyx s LYS 94 CO 0.00 -0.60 0.97 0.15 -0.36 0.00 0.00 175.35 175.51 3hyx s LYS 95 N 2.50 4.28 -0.14 4.03 1.02 -1.26 -2.68 119.74 127.48 3hyx s LYS 95 Ca 0.22 1.25 0.00 0.00 0.02 0.00 0.00 55.97 57.46 3hyx s LYS 95 Cb -0.15 -3.62 -0.01 0.00 -0.52 0.00 0.00 37.83 33.53 3hyx s LYS 95 CO 0.13 -0.52 -0.14 -1.50 -0.92 0.00 0.00 175.35 172.39 3hyx s ILE 96 N 2.82 2.88 0.31 2.17 1.10 -0.50 -5.01 121.20 124.97 3hyx s ILE 96 Ca 0.42 -0.71 -0.07 0.00 -0.51 0.00 0.00 60.65 59.78 3hyx s ILE 96 Cb -0.16 -2.21 -0.06 0.00 0.15 0.00 0.00 42.46 40.18 3hyx s ILE 96 CO 0.09 0.52 0.61 -1.61 -2.11 0.00 0.00 174.94 172.44 3hyx s GLU 97 N 0.55 3.71 0.00 3.50 2.02 -1.26 -0.82 118.70 126.41 3hyx s GLU 97 Ca -0.09 0.19 -0.00 0.00 0.02 0.00 0.00 54.97 55.09 3hyx s GLU 97 Cb -0.16 -2.58 -0.01 0.00 0.10 0.00 0.00 34.13 31.49 3hyx s GLU 97 CO 0.04 0.17 -0.00 1.52 0.02 0.00 0.00 175.26 177.01 3hyx s TYR 98 N -2.09 0.07 -0.13 1.61 1.13 -0.65 -4.92 117.35 112.36 3hyx s TYR 98 Ca 0.47 -0.15 -0.20 0.00 -1.41 0.00 0.00 57.07 55.78 3hyx s TYR 98 Cb -0.11 -0.05 -0.26 0.00 -1.10 0.00 0.00 41.96 40.44 3hyx s TYR 98 CO 0.28 -0.06 0.56 -0.44 -2.51 0.00 0.00 175.55 173.38 3hyx h ASP 99 N 5.69 0.25 -4.30 -0.18 3.32 -1.05 -3.45 116.42 116.70 3hyx h ASP 99 Ca -0.26 -0.82 -0.50 0.00 0.02 0.00 0.00 57.03 55.47 3hyx h ASP 99 Cb 1.21 -0.08 -0.23 0.00 0.22 0.00 0.00 39.33 40.45 3hyx h ASP 99 CO 0.48 1.47 -0.81 -0.31 -1.72 0.00 0.00 179.24 178.34 3hyx s TYR 100 N -2.40 1.54 -0.10 4.55 2.02 -0.35 -4.83 117.35 117.78 3hyx s TYR 100 Ca -0.21 -0.42 0.01 0.00 -0.37 0.00 0.00 57.07 56.09 3hyx s TYR 100 Cb 0.03 -0.87 0.02 0.00 -0.40 0.00 0.00 41.96 40.74 3hyx s TYR 100 CO 0.72 0.12 -0.11 -1.17 -1.57 0.00 0.00 175.55 173.54 3hyx s LEU 101 N -1.65 1.49 -0.20 -1.29 2.96 0.13 -0.90 118.68 119.22 3hyx s LEU 101 Ca 0.03 -0.34 -0.03 0.00 -0.22 0.00 0.00 54.13 53.57 3hyx s LEU 101 Cb -0.10 -0.91 -0.01 0.00 0.50 0.00 0.00 46.19 45.67 3hyx s LEU 101 CO 0.03 -0.03 -0.05 -0.69 -1.32 0.00 0.00 176.35 174.28 3hyx s VAL 102 N 1.18 3.45 -0.28 1.68 1.01 -0.03 -0.45 120.40 126.95 3hyx s VAL 102 Ca -0.04 -0.48 -0.10 0.00 0.00 0.00 0.00 61.98 61.35 3hyx s VAL 102 Cb -0.14 -2.54 -0.04 0.00 0.00 0.00 0.00 36.38 33.66 3hyx s VAL 102 CO -0.03 0.45 0.16 -0.63 0.00 0.00 0.00 175.10 175.05 3hyx s ILE 103 N 1.11 5.00 -0.34 2.22 1.01 0.49 -0.31 121.20 130.38 3hyx s ILE 103 Ca 0.01 -0.01 0.16 0.00 0.00 0.00 0.00 60.65 60.81 3hyx s ILE 103 Cb -0.15 -3.41 0.42 0.00 0.01 0.00 0.00 42.46 39.34 3hyx s ILE 103 CO -0.00 0.23 0.91 0.00 0.00 0.00 0.00 174.94 176.07 3hyx n ALA 104 N 5.02 2.87 1.82 9.38 0.00 0.94 -0.60 120.51 139.95 3hyx n ALA 104 Ca -0.14 -3.10 0.01 0.00 0.00 0.00 0.00 53.44 50.20 3hyx n ALA 104 Cb 0.51 -0.94 0.02 0.00 0.00 0.00 0.00 19.45 19.04 3hyx n ALA 104 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3hyx n THR 105 N 0.02 0.06 -3.68 0.00 -2.24 -1.17 -4.28 114.28 102.99 3hyx n THR 105 Ca 0.13 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.85 3hyx n THR 105 Cb 0.78 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.01 3hyx n THR 105 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hyx n GLY 106 N 0.54 0.83 3.84 3.38 0.00 -1.26 -4.73 105.19 107.80 3hyx n GLY 106 Ca 0.01 -0.84 -0.36 0.00 0.00 0.00 0.00 46.02 44.84 3hyx n GLY 106 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3hyx s PRO 107 N 0.00 4.00 -0.24 1.61 0.04 -1.26 -3.85 135.00 135.30 3hyx s PRO 107 Ca 0.00 0.52 -0.18 0.00 0.04 0.00 0.00 61.00 61.38 3hyx s PRO 107 Cb 0.00 -2.97 -0.03 0.00 0.04 0.00 0.00 34.50 31.54 3hyx s PRO 107 CO 0.00 0.50 0.51 0.21 0.04 0.00 0.00 177.00 178.26 3hyx s LYS 108 N -1.85 4.11 0.03 4.56 2.47 -0.64 -4.96 119.74 123.46 3hyx s LYS 108 Ca 0.37 0.34 -0.30 0.00 -1.56 0.00 0.00 55.97 54.82 3hyx s LYS 108 Cb -0.15 -3.62 -0.04 0.00 -1.46 0.00 0.00 37.83 32.55 3hyx s LYS 108 CO 0.19 -0.28 1.01 -0.51 0.16 0.00 0.00 175.35 175.92 3hyx s LEU 109 N 2.07 4.40 -0.29 5.43 1.43 -1.26 -1.36 118.68 129.10 3hyx s LEU 109 Ca 0.22 1.75 -0.05 0.00 -1.03 0.00 0.00 54.13 55.02 3hyx s LEU 109 Cb -0.16 -3.58 0.02 0.00 0.03 0.00 0.00 46.19 42.51 3hyx s LEU 109 CO 0.09 -0.26 0.04 -0.69 0.23 0.00 0.00 176.35 175.76 3hyx s VAL 110 N 0.81 3.57 -1.37 -1.59 1.01 0.56 -4.95 120.40 118.43 3hyx s VAL 110 Ca 0.52 -0.89 -0.10 0.00 0.00 0.00 0.00 61.98 61.51 3hyx s VAL 110 Cb -0.23 -2.87 0.10 0.00 0.00 0.00 0.00 36.38 33.38 3hyx s VAL 110 CO 0.29 0.07 2.13 0.49 0.00 0.00 0.00 175.10 178.07 3hyx n PHE 111 N 4.79 3.03 0.36 5.22 3.72 -1.26 -1.76 117.46 131.56 3hyx n PHE 111 Ca -0.15 -2.87 0.13 0.00 -0.05 0.00 0.00 57.45 54.51 3hyx n PHE 111 Cb 0.47 -2.16 0.54 0.00 -0.94 0.00 0.00 39.48 37.39 3hyx n PHE 111 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 3hyx h GLY 112 N 8.20 0.00 -4.45 1.37 0.00 -1.93 -3.41 103.07 102.85 3hyx h GLY 112 Ca 0.52 0.00 -0.55 0.00 0.00 0.00 0.00 47.33 47.30 3hyx h GLY 112 CO 1.71 0.00 0.11 0.00 0.00 0.00 0.00 176.54 178.36 3hyx s ALA 113 N -3.40 3.45 0.14 3.60 0.00 -1.26 -5.00 121.76 119.28 3hyx s ALA 113 Ca 0.03 0.24 -0.31 0.00 0.00 0.00 0.00 51.96 51.92 3hyx s ALA 113 Cb 0.09 -2.89 -0.11 0.00 0.00 0.00 0.00 23.12 20.21 3hyx s ALA 113 CO 0.40 0.22 1.82 -1.91 0.00 0.00 0.00 175.76 176.29 3hyx n GLU 114 N 2.14 2.79 -0.80 0.00 2.13 -0.78 -1.63 120.64 124.49 3hyx n GLU 114 Ca -0.06 1.01 0.00 0.00 0.66 0.00 0.00 57.16 58.78 3hyx n GLU 114 Cb 0.50 -2.90 0.00 0.00 0.27 0.00 0.00 31.44 29.31 3hyx n GLU 114 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3hyx n GLY 115 N 4.18 0.72 0.15 8.31 0.00 -1.26 -1.25 105.19 116.04 3hyx n GLY 115 Ca 0.18 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.04 3hyx n GLY 115 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3hyx h GLN 116 N 2.30 0.42 -0.52 1.61 4.15 -1.48 -1.00 115.11 120.59 3hyx h GLN 116 Ca 0.00 -0.38 -0.03 0.00 0.77 0.00 0.00 58.65 59.01 3hyx h GLN 116 Cb 0.00 0.09 -0.03 0.00 0.21 0.00 0.00 27.48 27.75 3hyx h GLN 116 CO 0.00 1.03 0.21 1.49 -1.93 0.00 0.00 178.83 179.63 3hyx h GLU 117 N -0.05 0.75 0.02 1.69 4.81 -1.80 -1.75 114.58 118.26 3hyx h GLU 117 Ca -0.04 -0.11 -0.00 0.00 -0.13 0.00 0.00 59.36 59.08 3hyx h GLU 117 Cb 1.15 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 30.39 3hyx h GLU 117 CO 0.10 0.62 -0.01 0.93 -0.73 0.00 0.00 179.01 179.92 3hyx h GLU 118 N 0.75 -0.03 0.00 1.92 3.07 -1.94 -3.40 114.58 114.95 3hyx h GLU 118 Ca 0.18 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.04 3hyx h GLU 118 Cb 0.15 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.06 3hyx h GLU 118 CO -0.02 0.66 -1.11 0.09 -1.40 0.00 0.00 179.01 177.23 3hyx n ASN 119 N -4.70 0.64 -4.86 1.42 3.02 -0.38 -4.94 115.26 105.45 3hyx n ASN 119 Ca -0.08 -0.42 -0.24 0.00 -0.03 0.00 0.00 54.58 53.81 3hyx n ASN 119 Cb 0.34 0.98 -0.03 0.00 -0.61 0.00 0.00 39.78 40.46 3hyx n ASN 119 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 3hyx s SER 120 N -3.66 4.70 0.26 6.41 0.15 -0.66 -4.67 113.70 116.24 3hyx s SER 120 Ca 0.04 -1.08 0.11 0.00 0.70 0.00 0.00 55.95 55.72 3hyx s SER 120 Cb 0.15 -0.04 -0.05 0.00 -1.71 0.00 0.00 66.02 64.37 3hyx s SER 120 CO 0.83 -0.86 -0.11 0.42 1.20 0.00 0.00 173.24 174.72 3hyx s THR 121 N -2.65 2.97 0.28 6.45 -4.23 -0.96 -4.83 115.64 112.66 3hyx s THR 121 Ca 0.39 -2.11 0.02 0.00 -1.18 0.00 0.00 61.69 58.82 3hyx s THR 121 Cb -0.01 -2.56 -0.06 0.00 1.34 0.00 0.00 72.50 71.21 3hyx s THR 121 CO 0.23 -0.35 0.08 -0.94 -0.54 0.00 0.00 174.62 173.10 3hyx s SER 122 N -3.48 1.57 -0.07 3.99 1.04 -1.26 -2.07 113.70 113.41 3hyx s SER 122 Ca 0.30 -1.38 0.11 0.00 0.48 0.00 0.00 55.95 55.46 3hyx s SER 122 Cb -0.06 0.08 0.16 0.00 0.10 0.00 0.00 66.02 66.30 3hyx s SER 122 CO 0.17 -0.69 1.05 2.30 0.98 0.00 0.00 173.24 177.05 3hyx n ILE 123 N -0.53 1.23 0.05 -1.02 -5.35 -1.26 -3.65 119.36 108.83 3hyx n ILE 123 Ca -0.01 -1.44 -0.20 0.00 -0.27 0.00 0.00 62.75 60.83 3hyx n ILE 123 Cb 0.66 0.12 -0.10 0.00 -1.74 0.00 0.00 39.64 38.58 3hyx n ILE 123 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3hyx s THR 125 N -3.28 4.46 0.39 0.00 -4.23 -1.26 -5.00 115.64 106.73 3hyx s THR 125 Ca -0.09 -1.29 0.34 0.00 -1.18 0.00 0.00 61.69 59.47 3hyx s THR 125 Cb 0.07 -3.36 0.36 0.00 1.34 0.00 0.00 72.50 70.91 3hyx s THR 125 CO 0.92 -0.26 2.13 0.00 -0.54 0.00 0.00 174.62 176.86 3hyx h ALA 126 N 1.82 1.12 -0.07 3.99 0.00 -1.97 -0.68 119.26 123.47 3hyx h ALA 126 Ca -0.48 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.31 3hyx h ALA 126 Cb 1.22 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.01 3hyx h ALA 126 CO 0.62 0.07 -0.22 0.93 0.00 0.00 0.00 179.25 180.65 3hyx h GLU 127 N 0.00 0.27 -0.18 0.00 3.07 -1.96 -2.52 114.58 113.26 3hyx h GLU 127 Ca -0.00 -0.20 -0.11 0.00 -0.50 0.00 0.00 59.36 58.55 3hyx h GLU 127 Cb 0.30 0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.23 3hyx h GLU 127 CO 0.01 0.82 -0.35 0.45 -1.40 0.00 0.00 179.01 178.54 3hyx h HIS 128 N -0.23 0.45 0.36 4.33 3.86 -1.79 -2.27 115.15 119.87 3hyx h HIS 128 Ca -0.01 -0.11 -0.02 0.00 -1.16 0.00 0.00 60.37 59.07 3hyx h HIS 128 Cb 0.84 -0.10 0.00 0.00 1.06 0.00 0.00 27.41 29.21 3hyx h HIS 128 CO 0.12 0.69 -0.17 0.00 0.86 0.00 0.00 177.93 179.43 3hyx h ALA 129 N 1.30 -0.49 -0.80 2.45 0.00 -1.12 0.01 119.26 120.62 3hyx h ALA 129 Ca 0.04 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.86 3hyx h ALA 129 Cb 0.78 0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.71 3hyx h ALA 129 CO 0.06 -0.76 0.53 -0.07 0.00 0.00 0.00 179.25 179.01 3hyx h LEU 130 N -0.53 0.87 -0.08 0.00 3.38 -1.38 -1.11 115.31 116.46 3hyx h LEU 130 Ca -0.05 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 57.92 3hyx h LEU 130 Cb 0.40 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 3hyx h LEU 130 CO 0.08 0.61 -0.03 -0.33 0.09 0.00 0.00 178.44 178.86 3hyx h GLU 131 N 1.02 -0.02 -0.82 1.13 5.08 -1.14 -2.63 114.58 117.20 3hyx h GLU 131 Ca 0.31 0.00 0.14 0.00 -1.00 0.00 0.00 59.36 58.81 3hyx h GLU 131 Cb -0.01 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.15 3hyx h GLU 131 CO -0.08 -0.01 0.40 1.15 -1.00 0.00 0.00 179.01 179.46 3hyx h THR 132 N -0.02 0.72 -0.74 1.13 2.02 0.17 -0.58 112.91 115.61 3hyx h THR 132 Ca 0.04 -0.20 0.16 0.00 0.77 0.00 0.00 66.41 67.19 3hyx h THR 132 Cb 0.08 0.09 -0.11 0.00 -1.74 0.00 0.00 68.15 66.47 3hyx h THR 132 CO -0.10 0.11 0.18 -0.61 0.37 0.00 0.00 175.52 175.47 3hyx h GLN 133 N 0.58 0.26 -0.71 6.66 5.75 -0.90 -0.08 115.11 126.67 3hyx h GLN 133 Ca 0.44 -0.02 0.03 0.00 -0.15 0.00 0.00 58.65 58.96 3hyx h GLN 133 Cb 0.63 -0.06 -0.04 0.00 1.07 0.00 0.00 27.48 29.08 3hyx h GLN 133 CO -0.37 0.17 0.45 0.87 -2.65 0.00 0.00 178.83 177.30 3hyx h LYS 134 N 0.27 0.85 -0.09 1.69 1.57 -0.98 -2.51 116.57 117.37 3hyx h LYS 134 Ca 0.42 -0.05 -0.13 0.00 -1.87 0.00 0.00 60.65 59.02 3hyx h LYS 134 Cb 0.72 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.82 3hyx h LYS 134 CO -0.51 0.57 -0.52 0.87 -0.57 0.00 0.00 179.45 179.28 3hyx h LYS 135 N 0.88 0.24 -0.29 3.15 1.79 -0.89 -2.59 116.57 118.87 3hyx h LYS 135 Ca 0.28 -0.14 -0.08 0.00 -2.18 0.00 0.00 60.65 58.53 3hyx h LYS 135 Cb 0.00 0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 30.65 3hyx h LYS 135 CO -0.10 0.70 -0.16 -0.07 -1.08 0.00 0.00 179.45 178.74 3hyx h LEU 136 N 0.19 0.50 -0.50 2.94 3.38 -0.87 -1.63 115.31 119.33 3hyx h LEU 136 Ca 0.01 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 57.83 3hyx h LEU 136 Cb 0.98 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.57 3hyx h LEU 136 CO 0.08 0.69 0.31 1.56 0.09 0.00 0.00 178.44 181.17 3hyx h GLN 137 N 0.47 0.67 -0.44 1.13 1.08 -1.06 -0.51 115.11 116.44 3hyx h GLN 137 Ca 0.08 -0.05 0.01 0.00 -1.45 0.00 0.00 58.65 57.23 3hyx h GLN 137 Cb 0.56 -0.14 -0.02 0.00 -0.05 0.00 0.00 27.48 27.82 3hyx h GLN 137 CO 0.04 0.48 0.29 1.49 -0.95 0.00 0.00 178.83 180.17 3hyx h GLU 138 N 0.67 0.56 0.10 1.46 4.81 -1.31 -1.93 114.58 118.94 3hyx h GLU 138 Ca 0.18 -0.03 0.02 0.00 -0.13 0.00 0.00 59.36 59.39 3hyx h GLU 138 Cb -0.03 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.19 3hyx h GLU 138 CO -0.04 0.37 -0.24 1.25 -0.73 0.00 0.00 179.01 179.63 3hyx h LEU 139 N 0.58 -0.68 -1.19 1.64 5.85 -0.79 -2.25 115.31 118.47 3hyx h LEU 139 Ca 0.17 0.08 0.10 0.00 0.84 0.00 0.00 57.88 59.07 3hyx h LEU 139 Cb -0.05 0.26 -0.07 0.00 0.37 0.00 0.00 40.66 41.18 3hyx h LEU 139 CO -0.05 -0.32 0.58 1.88 -0.34 0.00 0.00 178.44 180.19 3hyx h TYR 140 N -0.43 0.96 0.26 1.25 0.05 -1.01 -2.33 116.97 115.73 3hyx h TYR 140 Ca 0.03 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 58.83 3hyx h TYR 140 Cb 0.46 -0.31 -0.00 0.00 1.01 0.00 0.00 36.73 37.89 3hyx h TYR 140 CO -0.23 0.43 -0.14 0.00 -1.05 0.00 0.00 178.16 177.17 3hyx h ALA 141 N 1.56 -0.37 -2.90 3.88 0.00 -0.79 -3.39 119.26 117.25 3hyx h ALA 141 Ca 0.42 -0.08 -0.55 0.00 0.00 0.00 0.00 54.91 54.71 3hyx h ALA 141 Cb 0.43 0.16 -0.40 0.00 0.00 0.00 0.00 17.79 17.98 3hyx h ALA 141 CO -0.18 -0.71 -0.77 0.54 0.00 0.00 0.00 179.25 178.12 3hyx s ASN 142 N -4.87 3.68 0.73 0.00 4.22 -0.92 -5.12 114.94 112.66 3hyx s ASN 142 Ca -0.15 -1.39 -0.16 0.00 -2.14 0.00 0.00 52.86 49.03 3hyx s ASN 142 Cb 0.05 -0.51 0.04 0.00 1.28 0.00 0.00 41.25 42.11 3hyx s ASN 142 CO 0.65 -0.43 1.25 -2.84 -2.04 0.00 0.00 177.10 173.68 3hyx s PRO 143 N 1.95 2.09 0.31 3.55 0.02 -0.91 -4.68 135.00 137.34 3hyx s PRO 143 Ca 0.09 1.90 -0.19 0.00 0.02 0.00 0.00 61.00 62.82 3hyx s PRO 143 Cb -0.16 -1.81 0.04 0.00 0.02 0.00 0.00 34.50 32.59 3hyx s PRO 143 CO -0.33 -1.90 0.80 0.20 -0.33 0.00 0.00 177.00 175.43 3hyx s GLY 144 N -1.79 0.12 0.25 0.52 0.00 -1.26 -5.00 107.32 100.16 3hyx s GLY 144 Ca 0.78 -0.47 -0.31 0.00 0.00 0.00 0.00 44.72 44.72 3hyx s GLY 144 CO 0.45 0.01 1.36 -1.05 0.00 0.00 0.00 173.10 173.87 3hyx n PRO 145 N -0.51 1.96 -4.20 2.90 -0.02 -1.26 -4.44 135.00 129.43 3hyx n PRO 145 Ca -0.06 0.70 -0.34 0.00 -2.02 0.00 0.00 63.50 61.78 3hyx n PRO 145 Cb 0.60 -2.32 -0.15 0.00 -0.02 0.00 0.00 33.50 31.61 3hyx n PRO 145 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3hyx s VAL 146 N -0.26 3.01 -0.06 -1.45 1.01 -0.38 0.18 120.40 122.44 3hyx s VAL 146 Ca 0.66 -0.63 0.05 0.00 0.00 0.00 0.00 61.98 62.05 3hyx s VAL 146 Cb -0.65 -2.32 -0.00 0.00 0.00 0.00 0.00 36.38 33.40 3hyx s VAL 146 CO 0.52 0.48 -0.21 0.54 0.00 0.00 0.00 175.10 176.43 3hyx s VAL 147 N 1.11 1.76 0.07 2.92 0.11 -0.79 -0.95 120.40 124.64 3hyx s VAL 147 Ca 0.01 -0.89 0.04 0.00 -2.93 0.00 0.00 61.98 58.22 3hyx s VAL 147 Cb -0.14 -1.51 -0.03 0.00 -1.53 0.00 0.00 36.38 33.16 3hyx s VAL 147 CO -0.03 0.50 -0.13 -0.63 -3.33 0.00 0.00 175.10 171.48 3hyx s ILE 148 N 0.09 1.00 -2.85 7.04 1.01 -0.24 -3.08 121.20 124.18 3hyx s ILE 148 Ca -0.08 -1.32 0.00 0.00 0.00 0.00 0.00 60.65 59.25 3hyx s ILE 148 Cb -0.14 -1.04 0.00 0.00 0.01 0.00 0.00 42.46 41.29 3hyx s ILE 148 CO 0.04 -0.30 0.00 0.61 0.00 0.00 0.00 174.94 175.30 3hyx n GLY 149 N 1.20 -0.59 2.96 6.18 0.00 -0.99 -1.21 105.19 112.74 3hyx n GLY 149 Ca -0.21 -0.67 -0.21 0.00 0.00 0.00 0.00 46.02 44.94 3hyx n GLY 149 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hyx s ALA 150 N -1.00 0.86 1.01 4.61 0.00 -0.81 -0.97 121.76 125.46 3hyx s ALA 150 Ca 0.00 -0.23 -0.16 0.00 0.00 0.00 0.00 51.96 51.56 3hyx s ALA 150 Cb 0.00 -0.40 0.21 0.00 0.00 0.00 0.00 23.12 22.93 3hyx s ALA 150 CO 0.00 0.08 1.23 0.96 0.00 0.00 0.00 175.76 178.03 3hyx s ILE 151 N 0.55 1.89 0.57 0.00 -4.36 -1.24 -2.53 121.20 116.08 3hyx s ILE 151 Ca -0.09 0.00 -0.21 0.00 -0.26 0.00 0.00 60.65 60.09 3hyx s ILE 151 Cb -0.12 -2.83 -0.04 0.00 1.25 0.00 0.00 42.46 40.72 3hyx s ILE 151 CO 0.01 0.00 1.34 -2.65 0.24 0.00 0.00 174.94 173.89 3hyx n PRO 152 N -4.02 1.58 -0.12 0.37 -0.02 -1.26 -3.17 135.00 128.35 3hyx n PRO 152 Ca 0.13 0.59 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 3hyx n PRO 152 Cb 0.60 -2.57 0.00 0.00 -0.02 0.00 0.00 33.50 31.51 3hyx n PRO 152 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hyx n GLY 153 N 0.79 1.63 3.77 -1.23 0.00 0.17 -4.73 105.19 105.59 3hyx n GLY 153 Ca 0.11 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 3hyx n GLY 153 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hyx s VAL 154 N -2.73 2.79 -0.49 1.61 1.01 -1.19 -4.22 120.40 117.18 3hyx s VAL 154 Ca 0.00 0.79 0.08 0.00 0.00 0.00 0.00 61.98 62.84 3hyx s VAL 154 Cb 0.00 -3.50 0.36 0.00 0.00 0.00 0.00 36.38 33.25 3hyx s VAL 154 CO 0.00 0.18 0.92 -1.54 0.00 0.00 0.00 175.10 174.66 3hyx n SER 155 N 0.75 3.43 0.00 3.32 3.41 -1.26 -1.79 113.62 121.48 3hyx n SER 155 Ca 0.00 -3.46 0.00 0.00 -0.26 0.00 0.00 58.87 55.15 3hyx n SER 155 Cb 0.42 -0.56 0.00 0.00 -0.26 0.00 0.00 64.21 63.82 3hyx n SER 155 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 3hyx n PHE 157 N -0.15 0.00 -0.31 7.33 3.72 -1.26 -2.14 117.46 124.65 3hyx n PHE 157 Ca 0.29 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.61 3hyx n PHE 157 Cb 0.53 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 39.00 3hyx n PHE 157 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3hyx n GLY 158 N -0.49 -1.91 0.33 1.37 0.00 -1.26 -0.83 105.19 102.40 3hyx n GLY 158 Ca 0.00 0.88 0.17 0.00 0.00 0.00 0.00 46.02 47.07 3hyx n GLY 158 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3hyx h PRO 159 N 0.00 0.00 0.08 1.61 0.11 -2.00 -0.62 132.00 131.19 3hyx h PRO 159 Ca 0.12 0.00 -0.28 0.00 0.11 0.00 0.00 66.00 65.95 3hyx h PRO 159 Cb 0.31 0.00 0.02 0.00 0.11 0.00 0.00 31.00 31.44 3hyx h PRO 159 CO -0.70 0.00 -1.17 0.00 -0.21 0.00 0.00 178.00 175.92 3hyx h ALA 160 N 1.79 0.07 -0.59 -0.75 0.00 -1.35 -0.87 119.26 117.56 3hyx h ALA 160 Ca 0.05 -0.76 -0.03 0.00 0.00 0.00 0.00 54.91 54.18 3hyx h ALA 160 Cb 0.38 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 3hyx h ALA 160 CO -0.00 0.72 0.26 1.88 0.00 0.00 0.00 179.25 182.11 3hyx h TYR 161 N 0.29 0.88 0.23 0.00 0.05 -1.12 -1.50 116.97 115.80 3hyx h TYR 161 Ca -0.16 -0.05 -0.01 0.00 0.05 0.00 0.00 58.73 58.55 3hyx h TYR 161 Cb 1.84 -0.27 0.00 0.00 1.01 0.00 0.00 36.73 39.31 3hyx h TYR 161 CO 0.10 0.68 -0.11 0.93 -1.05 0.00 0.00 178.16 178.71 3hyx h GLU 162 N 0.81 -0.30 -0.20 4.88 5.08 -1.10 -2.33 114.58 121.42 3hyx h GLU 162 Ca 0.20 0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.59 3hyx h GLU 162 Cb 0.16 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 3hyx h GLU 162 CO -0.02 -0.20 0.11 0.35 -1.00 0.00 0.00 179.01 178.25 3hyx h PHE 163 N -0.31 0.21 -0.28 4.33 3.04 -1.09 0.24 116.94 123.09 3hyx h PHE 163 Ca -0.03 0.01 0.06 0.00 3.98 0.00 0.00 57.97 61.99 3hyx h PHE 163 Cb 0.24 -0.07 -0.07 0.00 2.56 0.00 0.00 35.95 38.62 3hyx h PHE 163 CO -0.07 0.13 -0.16 0.00 -2.02 0.00 0.00 178.31 176.19 3hyx h ALA 164 N 1.09 0.04 -0.21 2.41 0.00 -1.22 0.26 119.26 121.62 3hyx h ALA 164 Ca 0.08 0.10 -0.19 0.00 0.00 0.00 0.00 54.91 54.90 3hyx h ALA 164 Cb -0.00 0.38 0.00 0.00 0.00 0.00 0.00 17.79 18.16 3hyx h ALA 164 CO -0.04 -0.57 -0.63 -0.07 0.00 0.00 0.00 179.25 177.94 3hyx h LEU 165 N -0.14 0.84 -0.31 0.00 3.38 -1.10 -0.05 115.31 117.94 3hyx h LEU 165 Ca 0.15 -0.49 0.01 0.00 0.09 0.00 0.00 57.88 57.63 3hyx h LEU 165 Cb 0.36 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 3hyx h LEU 165 CO -0.36 1.27 0.20 0.24 0.09 0.00 0.00 178.44 179.87 3hyx h MET 166 N 0.55 0.39 -0.66 1.13 2.86 -0.29 -1.73 114.93 117.18 3hyx h MET 166 Ca -0.01 -0.02 -0.05 0.00 -2.06 0.00 0.00 59.70 57.56 3hyx h MET 166 Cb 1.23 -0.09 -0.03 0.00 0.06 0.00 0.00 31.60 32.77 3hyx h MET 166 CO 0.13 0.26 0.22 1.25 1.06 0.00 0.00 176.91 179.83 3hyx h LEU 167 N 0.41 0.92 0.21 1.22 5.85 -0.33 -1.79 115.31 121.80 3hyx h LEU 167 Ca 0.12 -0.15 0.01 0.00 0.84 0.00 0.00 57.88 58.70 3hyx h LEU 167 Cb -0.03 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 40.72 3hyx h LEU 167 CO -0.04 0.85 -0.44 -0.74 -0.34 0.00 0.00 178.44 177.73 3hyx h HIS 168 N 0.97 -1.24 -0.95 1.25 2.76 -0.71 -0.07 115.15 117.16 3hyx h HIS 168 Ca 0.22 0.03 0.18 0.00 -2.20 0.00 0.00 60.37 58.59 3hyx h HIS 168 Cb 0.25 0.52 -0.08 0.00 1.55 0.00 0.00 27.41 29.64 3hyx h HIS 168 CO 0.02 -0.56 0.60 -0.92 -1.30 0.00 0.00 177.93 175.78 3hyx h TYR 169 N -0.74 0.85 -0.05 5.26 3.20 -0.91 -0.31 116.97 124.27 3hyx h TYR 169 Ca -0.00 0.03 -0.08 0.00 3.14 0.00 0.00 58.73 61.81 3hyx h TYR 169 Cb 0.73 -0.26 0.00 0.00 1.54 0.00 0.00 36.73 38.74 3hyx h TYR 169 CO -0.34 0.24 -0.29 1.49 -1.64 0.00 0.00 178.16 177.62 3hyx h GLU 170 N 0.65 0.28 -0.64 1.82 4.57 -1.00 -0.75 114.58 119.52 3hyx h GLU 170 Ca 0.51 -0.24 0.02 0.00 -1.18 0.00 0.00 59.36 58.47 3hyx h GLU 170 Cb 0.92 0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 29.53 3hyx h GLU 170 CO -0.27 0.89 0.42 -0.07 -1.18 0.00 0.00 179.01 178.81 3hyx h LEU 171 N -0.26 0.70 -0.16 1.64 4.07 -0.51 -2.51 115.31 118.29 3hyx h LEU 171 Ca -0.02 -0.01 -0.22 0.00 0.08 0.00 0.00 57.88 57.71 3hyx h LEU 171 Cb 0.95 -0.17 0.01 0.00 1.08 0.00 0.00 40.66 42.53 3hyx h LEU 171 CO 0.06 0.50 -0.75 0.50 -1.08 0.00 0.00 178.44 177.67 3hyx h LYS 172 N 0.83 0.78 0.00 1.13 3.64 -1.03 -0.54 116.57 121.37 3hyx h LYS 172 Ca 0.24 -0.63 0.00 0.00 -1.27 0.00 0.00 60.65 58.99 3hyx h LYS 172 Cb -0.04 0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.91 3hyx h LYS 172 CO -0.06 1.24 0.00 0.87 -2.27 0.00 0.00 179.45 179.23 3hyx h LYS 173 N 0.51 0.00 -0.65 1.90 1.79 -0.77 -1.39 116.57 117.97 3hyx h LYS 173 Ca -0.05 0.00 -0.33 0.00 -2.18 0.00 0.00 60.65 58.09 3hyx h LYS 173 Cb 1.38 0.00 -0.20 0.00 -1.58 0.00 0.00 32.23 31.83 3hyx h LYS 173 CO 0.16 0.00 0.25 2.89 -1.08 0.00 0.00 179.45 181.67 3hyx n ARG 174 N -2.88 2.06 -2.09 3.15 1.85 -0.98 -4.98 116.66 112.80 3hyx n ARG 174 Ca 0.01 -3.11 -0.07 0.00 -1.00 0.00 0.00 57.85 53.68 3hyx n ARG 174 Cb 0.31 -1.99 -0.01 0.00 -1.05 0.00 0.00 32.46 29.73 3hyx n ARG 174 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 3hyx n GLY 175 N -1.12 -0.14 0.18 2.89 0.00 -0.52 -4.74 105.19 101.74 3hyx n GLY 175 Ca 0.45 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.50 3hyx n GLY 175 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3hyx n ILE 176 N -2.57 0.00 -0.21 -0.61 3.06 -0.30 -4.67 119.36 114.07 3hyx n ILE 176 Ca -0.08 -0.46 -0.03 0.00 -2.50 0.00 0.00 62.75 59.67 3hyx n ILE 176 Cb 0.47 1.09 0.08 0.00 0.54 0.00 0.00 39.64 41.82 3hyx n ILE 176 CO 0.00 0.00 0.00 -0.09 -2.50 0.00 0.00 176.55 173.96 3hyx h ARG 177 N 0.89 0.63 0.00 9.51 9.65 -1.61 -1.66 114.38 131.80 3hyx h ARG 177 Ca 0.00 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.84 3hyx h ARG 177 Cb 0.22 -0.14 0.00 0.00 -1.39 0.00 0.00 29.97 28.66 3hyx h ARG 177 CO 0.00 0.42 0.00 2.48 2.80 0.00 0.00 179.97 185.67 3hyx n TYR 178 N -4.80 0.56 0.13 2.20 0.18 -1.26 -0.03 117.16 114.15 3hyx n TYR 178 Ca 0.07 0.28 0.12 0.00 1.88 0.00 0.00 57.90 60.25 3hyx n TYR 178 Cb 0.14 -0.96 0.27 0.00 -0.38 0.00 0.00 39.34 38.41 3hyx n TYR 178 CO 0.00 0.00 0.00 1.63 -2.08 0.00 0.00 176.86 176.41 3hyx n LYS 179 N -2.07 2.52 -3.78 -3.48 5.02 -0.62 -4.84 118.16 110.90 3hyx n LYS 179 Ca -0.01 -2.32 -0.30 0.00 -2.02 0.00 0.00 58.31 53.67 3hyx n LYS 179 Cb 0.05 -1.52 -0.15 0.00 -0.02 0.00 0.00 35.03 33.38 3hyx n LYS 179 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3hyx s VAL 180 N -1.33 1.01 0.60 -0.18 1.01 0.96 -4.22 120.40 118.27 3hyx s VAL 180 Ca 0.42 -1.35 -0.18 0.00 0.00 0.00 0.00 61.98 60.87 3hyx s VAL 180 Cb 0.23 -1.68 -0.03 0.00 0.00 0.00 0.00 36.38 34.90 3hyx s VAL 180 CO 0.31 -0.55 1.21 -2.84 0.00 0.00 0.00 175.10 173.23 3hyx s PRO 181 N 1.57 2.91 -0.08 2.72 0.02 -1.26 -4.89 135.00 135.98 3hyx s PRO 181 Ca 0.07 1.81 0.00 0.00 0.02 0.00 0.00 61.00 62.90 3hyx s PRO 181 Cb -0.18 -1.92 0.02 0.00 0.02 0.00 0.00 34.50 32.45 3hyx s PRO 181 CO -0.20 -1.25 -0.06 -1.64 -0.33 0.00 0.00 177.00 173.52 3hyx s MET 182 N -3.39 1.15 -0.05 5.54 -1.94 -1.26 -1.26 119.30 118.09 3hyx s MET 182 Ca 0.77 -0.16 0.04 0.00 -1.71 0.00 0.00 55.69 54.64 3hyx s MET 182 Cb -0.30 -1.20 -0.00 0.00 2.01 0.00 0.00 34.83 35.34 3hyx s MET 182 CO 0.34 -0.17 -0.17 0.99 -0.01 0.00 0.00 175.02 176.00 3hyx s THR 183 N 1.36 1.47 -0.29 2.05 2.01 -0.12 -0.94 115.64 121.17 3hyx s THR 183 Ca -0.03 -0.73 -0.07 0.00 0.31 0.00 0.00 61.69 61.17 3hyx s THR 183 Cb -0.14 -1.27 0.00 0.00 0.01 0.00 0.00 72.50 71.11 3hyx s THR 183 CO -0.03 0.42 0.09 0.12 -0.69 0.00 0.00 174.62 174.53 3hyx s PHE 184 N 0.11 3.14 -0.06 4.92 5.36 0.14 -1.08 117.98 130.51 3hyx s PHE 184 Ca -0.06 -0.85 0.04 0.00 -0.96 0.00 0.00 56.93 55.10 3hyx s PHE 184 Cb -0.12 -2.27 -0.02 0.00 -0.34 0.00 0.00 43.02 40.27 3hyx s PHE 184 CO 0.03 -0.53 -0.20 0.96 -1.46 0.00 0.00 175.22 174.02 3hyx s ILE 185 N 1.53 2.56 0.01 3.12 -5.25 -0.35 -0.56 121.20 122.26 3hyx s ILE 185 Ca 0.03 -0.89 -0.06 0.00 -0.99 0.00 0.00 60.65 58.74 3hyx s ILE 185 Cb -0.17 -1.98 -0.00 0.00 2.95 0.00 0.00 42.46 43.26 3hyx s ILE 185 CO 0.03 0.57 0.11 0.28 -1.79 0.00 0.00 174.94 174.14 3hyx s THR 186 N -0.31 0.09 -0.97 8.37 -1.32 -0.19 -1.92 115.64 119.39 3hyx s THR 186 Ca 0.02 -0.77 0.29 0.00 -1.21 0.00 0.00 61.69 60.01 3hyx s THR 186 Cb -0.13 -0.46 0.24 0.00 -1.51 0.00 0.00 72.50 70.64 3hyx s THR 186 CO 0.02 -0.42 1.90 -1.54 -2.21 0.00 0.00 174.62 172.37 3hyx n SER 187 N 1.38 0.11 -4.77 8.08 3.41 -1.05 -2.05 113.62 118.74 3hyx n SER 187 Ca -0.23 0.50 -0.40 0.00 -0.26 0.00 0.00 58.87 58.48 3hyx n SER 187 Cb 0.56 -0.52 -0.01 0.00 -0.26 0.00 0.00 64.21 63.98 3hyx n SER 187 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 3hyx s GLU 188 N -3.01 4.09 0.43 4.33 2.02 -1.26 -4.42 118.70 120.87 3hyx s GLU 188 Ca 0.14 2.30 0.09 0.00 0.02 0.00 0.00 54.97 57.52 3hyx s GLU 188 Cb 0.18 -2.89 0.94 0.00 0.10 0.00 0.00 34.13 32.47 3hyx s GLU 188 CO 0.54 -0.45 2.07 -1.00 0.02 0.00 0.00 175.26 176.44 3hyx h PRO 189 N 2.92 0.43 -4.06 0.39 0.13 -1.91 0.20 132.00 130.11 3hyx h PRO 189 Ca -0.50 -0.03 -0.12 0.00 -0.87 0.00 0.00 66.00 64.48 3hyx h PRO 189 Cb 1.24 -0.10 -0.14 0.00 0.13 0.00 0.00 31.00 32.13 3hyx h PRO 189 CO 0.64 0.29 -0.47 1.52 -0.23 0.00 0.00 178.00 179.74 3hyx s TYR 190 N -5.41 0.48 0.34 1.56 -0.85 -1.26 -4.10 117.35 108.11 3hyx s TYR 190 Ca -0.08 -0.89 -0.29 0.00 -0.52 0.00 0.00 57.07 55.30 3hyx s TYR 190 Cb 0.17 -0.22 -0.11 0.00 0.38 0.00 0.00 41.96 42.19 3hyx s TYR 190 CO 0.72 -0.58 1.49 -0.51 -1.52 0.00 0.00 175.55 175.15 3hyx s LEU 191 N -2.96 4.34 -1.01 -3.49 1.02 -1.26 -2.81 118.68 112.52 3hyx s LEU 191 Ca 0.15 2.96 0.00 0.00 0.02 0.00 0.00 54.13 57.25 3hyx s LEU 191 Cb 0.05 -3.65 0.00 0.00 0.02 0.00 0.00 46.19 42.61 3hyx s LEU 191 CO -0.04 -0.83 0.00 0.61 0.02 0.00 0.00 176.35 176.11 3hyx n GLY 192 N 1.04 0.56 0.22 -3.19 0.00 -1.26 -4.02 105.19 98.53 3hyx n GLY 192 Ca 0.03 -0.50 -0.15 0.00 0.00 0.00 0.00 46.02 45.41 3hyx n GLY 192 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 3hyx h HIS 193 N 0.00 0.92 0.00 1.61 6.17 -1.88 -3.34 115.15 118.62 3hyx h HIS 193 Ca -0.23 -0.33 0.00 0.00 0.71 0.00 0.00 60.37 60.52 3hyx h HIS 193 Cb 0.94 -0.17 0.00 0.00 2.52 0.00 0.00 27.41 30.70 3hyx h HIS 193 CO 0.29 1.12 0.00 1.19 0.71 0.00 0.00 177.93 181.24 3hyx n PHE 194 N -4.15 0.00 -0.59 5.26 3.72 -1.26 0.32 117.46 120.76 3hyx n PHE 194 Ca -0.05 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.35 3hyx n PHE 194 Cb 0.57 -1.45 0.00 0.00 -0.94 0.00 0.00 39.48 37.66 3hyx n PHE 194 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3hyx n GLY 195 N -0.17 1.47 0.31 1.37 0.00 -1.26 -4.49 105.19 102.42 3hyx n GLY 195 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 3hyx n GLY 195 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3hyx n VAL 196 N -2.00 0.76 -2.26 1.61 0.24 -0.74 -4.45 118.33 111.49 3hyx n VAL 196 Ca 0.00 -0.88 -0.05 0.00 -2.04 0.00 0.00 64.34 61.37 3hyx n VAL 196 Cb 0.00 0.65 0.00 0.00 -1.47 0.00 0.00 33.84 33.02 3hyx n VAL 196 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3hyx n GLY 197 N 0.09 0.29 0.20 7.63 0.00 -0.84 -4.74 105.19 107.82 3hyx n GLY 197 Ca 0.05 -0.63 0.02 0.00 0.00 0.00 0.00 46.02 45.47 3hyx n GLY 197 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hyx n GLY 198 N -0.96 -2.55 2.82 -0.02 0.00 0.15 -4.95 105.19 99.68 3hyx n GLY 198 Ca -0.04 -1.41 -0.27 0.00 0.00 0.00 0.00 46.02 44.30 3hyx n GLY 198 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hyx s ILE 199 N -2.92 0.80 0.00 -0.61 1.01 -1.26 -4.99 121.20 113.23 3hyx s ILE 199 Ca 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 60.65 60.13 3hyx s ILE 199 Cb 0.00 -1.10 0.00 0.00 0.01 0.00 0.00 42.46 41.37 3hyx s ILE 199 CO 0.00 0.01 0.00 0.61 0.00 0.00 0.00 174.94 175.56 3hyx n GLY 200 N 4.97 2.51 2.03 6.18 0.00 -1.26 -1.01 105.19 118.62 3hyx n GLY 200 Ca -0.10 -0.14 -0.23 0.00 0.00 0.00 0.00 46.02 45.55 3hyx n GLY 200 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hyx n ALA 201 N 7.86 5.36 0.03 4.61 0.00 -1.26 -4.63 120.51 132.49 3hyx n ALA 201 Ca 0.00 -2.40 0.18 0.00 0.00 0.00 0.00 53.44 51.23 3hyx n ALA 201 Cb 0.00 -1.48 0.68 0.00 0.00 0.00 0.00 19.45 18.65 3hyx n ALA 201 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3hyx h SER 202 N 1.34 0.01 -0.39 0.00 4.64 -1.37 -1.28 113.55 116.49 3hyx h SER 202 Ca 0.46 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.69 3hyx h SER 202 Cb 1.47 -0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.55 3hyx h SER 202 CO 1.04 0.00 -0.10 0.50 -0.87 0.00 0.00 176.83 177.40 3hyx h LYS 203 N 0.01 0.76 -0.44 4.77 3.64 -1.74 0.46 116.57 124.02 3hyx h LYS 203 Ca 0.22 -0.29 -0.12 0.00 -1.27 0.00 0.00 60.65 59.19 3hyx h LYS 203 Cb 0.87 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.63 3hyx h LYS 203 CO -0.00 0.90 -0.20 -0.09 -2.27 0.00 0.00 179.45 177.78 3hyx h ARG 204 N 0.56 0.87 -0.30 1.90 2.43 -1.57 -2.74 114.38 115.54 3hyx h ARG 204 Ca 0.10 -0.35 -0.15 0.00 -0.81 0.00 0.00 59.98 58.77 3hyx h ARG 204 Cb 0.62 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.12 3hyx h ARG 204 CO 0.04 0.99 -0.42 -0.07 -1.51 0.00 0.00 179.97 179.00 3hyx h LEU 205 N 0.76 0.79 0.02 3.80 4.07 -1.10 -2.73 115.31 120.92 3hyx h LEU 205 Ca 0.11 -0.36 -0.26 0.00 0.08 0.00 0.00 57.88 57.44 3hyx h LEU 205 Cb 0.74 -0.22 0.00 0.00 1.08 0.00 0.00 40.66 42.26 3hyx h LEU 205 CO 0.06 1.10 -1.15 0.58 -1.08 0.00 0.00 178.44 177.95 3hyx h VAL 206 N 0.60 1.47 -0.41 1.22 2.07 -0.94 -1.66 116.25 118.60 3hyx h VAL 206 Ca 0.05 -2.86 0.00 0.00 0.82 0.00 0.00 66.70 64.70 3hyx h VAL 206 Cb 0.97 2.78 -0.02 0.00 -1.52 0.00 0.00 31.29 33.49 3hyx h VAL 206 CO 0.09 0.84 0.26 -0.33 0.02 0.00 0.00 177.57 178.45 3hyx h GLU 207 N 0.12 0.54 0.09 1.57 5.08 -1.55 -1.01 114.58 119.42 3hyx h GLU 207 Ca -0.12 -0.04 -0.25 0.00 -1.00 0.00 0.00 59.36 57.96 3hyx h GLU 207 Cb 1.84 -0.12 0.02 0.00 0.50 0.00 0.00 28.75 31.00 3hyx h GLU 207 CO 0.19 0.36 -1.04 -0.44 -1.00 0.00 0.00 179.01 177.08 3hyx h ASP 208 N 0.55 0.76 -0.05 1.42 3.32 -1.39 -2.58 116.42 118.45 3hyx h ASP 208 Ca 0.15 -0.82 0.03 0.00 0.02 0.00 0.00 57.03 56.41 3hyx h ASP 208 Cb -0.05 -0.24 -0.04 0.00 0.22 0.00 0.00 39.33 39.22 3hyx h ASP 208 CO -0.03 1.50 -0.19 0.25 -1.72 0.00 0.00 179.24 179.05 3hyx h LEU 209 N 0.11 -0.57 -0.88 1.55 5.85 -1.00 -1.64 115.31 118.73 3hyx h LEU 209 Ca -0.16 0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.65 3hyx h LEU 209 Cb 1.75 0.25 -0.04 0.00 0.37 0.00 0.00 40.66 42.98 3hyx h LEU 209 CO 0.20 -0.25 0.53 -0.26 -0.34 0.00 0.00 178.44 178.32 3hyx h PHE 210 N -0.28 1.17 -0.48 1.25 -1.00 -1.27 -2.09 116.94 114.24 3hyx h PHE 210 Ca 0.07 -0.01 -0.11 0.00 2.81 0.00 0.00 57.97 60.74 3hyx h PHE 210 Cb 0.38 -0.38 -0.01 0.00 3.61 0.00 0.00 35.95 39.55 3hyx h PHE 210 CO -0.26 0.78 -0.12 0.00 -1.61 0.00 0.00 178.31 177.10 3hyx h ALA 211 N 1.29 0.67 0.00 2.45 0.00 -1.26 0.29 119.26 122.69 3hyx h ALA 211 Ca 0.32 -0.35 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 3hyx h ALA 211 Cb -0.04 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 3hyx h ALA 211 CO -0.06 0.58 -0.20 0.93 0.00 0.00 0.00 179.25 180.50 3hyx h GLU 212 N 0.79 0.00 -0.38 0.00 5.08 -1.08 -2.85 114.58 116.13 3hyx h GLU 212 Ca 0.12 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 3hyx h GLU 212 Cb 0.67 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.92 3hyx h GLU 212 CO 0.05 0.20 0.00 0.54 -1.00 0.00 0.00 179.01 178.80 3hyx n ARG 213 N -4.20 3.15 -4.08 2.33 1.74 -0.81 -4.97 116.66 109.82 3hyx n ARG 213 Ca -0.02 -2.59 -0.32 0.00 -0.77 0.00 0.00 57.85 54.14 3hyx n ARG 213 Cb 0.27 -1.67 -0.01 0.00 -1.02 0.00 0.00 32.46 30.02 3hyx n ARG 213 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 3hyx n ASN 214 N 0.22 -3.15 -4.56 0.55 5.15 -0.19 -4.95 115.26 108.33 3hyx n ASN 214 Ca 0.19 -0.94 -0.40 0.00 -0.60 0.00 0.00 54.58 52.83 3hyx n ASN 214 Cb 0.74 -3.15 -0.09 0.00 -0.53 0.00 0.00 39.78 36.76 3hyx n ASN 214 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3hyx s ILE 215 N -3.42 5.15 0.55 -1.44 1.01 0.84 -4.62 121.20 119.27 3hyx s ILE 215 Ca 0.58 0.25 -0.18 0.00 0.00 0.00 0.00 60.65 61.29 3hyx s ILE 215 Cb -0.31 -3.80 -0.06 0.00 0.01 0.00 0.00 42.46 38.31 3hyx s ILE 215 CO 0.89 -0.03 1.06 -1.81 0.00 0.00 0.00 174.94 175.05 3hyx s ASP 216 N 1.71 5.97 -0.08 3.58 1.01 -0.12 -4.50 116.67 124.25 3hyx s ASP 216 Ca 0.14 1.90 -0.10 0.00 0.71 0.00 0.00 52.55 55.19 3hyx s ASP 216 Cb -0.16 -2.55 0.02 0.00 1.01 0.00 0.00 42.92 41.24 3hyx s ASP 216 CO 0.11 -1.04 0.27 -1.66 0.21 0.00 0.00 175.17 173.07 3hyx s TRP 217 N -2.20 -0.26 -0.08 4.23 1.48 -1.26 0.24 118.94 121.09 3hyx s TRP 217 Ca 0.66 0.59 0.01 0.00 -1.06 0.00 0.00 56.10 56.31 3hyx s TRP 217 Cb -0.17 0.09 0.02 0.00 -1.16 0.00 0.00 33.47 32.25 3hyx s TRP 217 CO 0.29 -0.20 -0.12 0.42 -4.06 0.00 0.00 176.95 173.29 3hyx s ILE 218 N -0.24 1.17 0.29 0.66 1.01 0.28 -4.94 121.20 119.42 3hyx s ILE 218 Ca -0.04 -0.46 0.11 0.00 0.00 0.00 0.00 60.65 60.26 3hyx s ILE 218 Cb -0.03 -1.10 -0.05 0.00 0.01 0.00 0.00 42.46 41.29 3hyx s ILE 218 CO 0.01 0.37 -0.13 0.00 0.00 0.00 0.00 174.94 175.19 3hyx s ALA 219 N 0.97 2.90 -0.95 9.38 0.00 -1.26 -1.02 121.76 131.78 3hyx s ALA 219 Ca -0.08 -1.87 -0.05 0.00 0.00 0.00 0.00 51.96 49.96 3hyx s ALA 219 Cb -0.15 -0.35 0.01 0.00 0.00 0.00 0.00 23.12 22.63 3hyx s ALA 219 CO -0.00 0.24 0.71 -1.71 0.00 0.00 0.00 175.76 174.99 3hyx n ASN 220 N -0.72 -4.90 -4.10 0.00 5.15 0.70 -4.92 115.26 106.47 3hyx n ASN 220 Ca -0.05 -0.32 -0.09 0.00 -0.60 0.00 0.00 54.58 53.51 3hyx n ASN 220 Cb 0.60 -3.55 -0.10 0.00 -0.53 0.00 0.00 39.78 36.20 3hyx n ASN 220 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 3hyx s VAL 221 N -3.16 0.42 -0.27 3.44 -7.23 -1.20 -4.41 120.40 108.00 3hyx s VAL 221 Ca 0.35 -1.61 -0.09 0.00 -1.81 0.00 0.00 61.98 58.82 3hyx s VAL 221 Cb -0.15 -1.26 -0.04 0.00 0.56 0.00 0.00 36.38 35.49 3hyx s VAL 221 CO 0.43 -0.79 0.13 0.00 -0.31 0.00 0.00 175.10 174.57 3hyx s ALA 222 N -3.07 3.35 -0.19 1.32 0.00 0.14 -3.88 121.76 119.42 3hyx s ALA 222 Ca 0.03 -1.12 -0.29 0.00 0.00 0.00 0.00 51.96 50.58 3hyx s ALA 222 Cb 0.02 -2.29 -0.01 0.00 0.00 0.00 0.00 23.12 20.83 3hyx s ALA 222 CO -0.05 -0.53 1.32 0.08 0.00 0.00 0.00 175.76 176.58 3hyx s VAL 223 N 1.69 4.16 -0.14 0.00 1.01 -1.26 0.35 120.40 126.21 3hyx s VAL 223 Ca 0.07 1.38 0.12 0.00 0.00 0.00 0.00 61.98 63.55 3hyx s VAL 223 Cb -0.16 -3.98 -0.17 0.00 0.00 0.00 0.00 36.38 32.07 3hyx s VAL 223 CO 0.07 -0.22 0.05 0.29 0.00 0.00 0.00 175.10 175.29 3hyx n LYS 224 N 6.88 1.67 -3.76 2.72 4.76 -0.65 -4.53 118.16 125.25 3hyx n LYS 224 Ca 0.15 -0.01 -0.13 0.00 -2.87 0.00 0.00 58.31 55.45 3hyx n LYS 224 Cb 0.45 -1.36 -0.11 0.00 -1.84 0.00 0.00 35.03 32.17 3hyx n LYS 224 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3hyx s ALA 225 N -2.34 -0.78 -0.21 7.82 0.00 -0.89 -1.87 121.76 123.49 3hyx s ALA 225 Ca -0.07 0.95 0.01 0.00 0.00 0.00 0.00 51.96 52.85 3hyx s ALA 225 Cb 0.04 -0.56 0.05 0.00 0.00 0.00 0.00 23.12 22.65 3hyx s ALA 225 CO 0.58 -0.16 -0.09 0.42 0.00 0.00 0.00 175.76 176.51 3hyx s ILE 226 N 0.38 1.62 0.24 0.00 1.01 -0.38 0.01 121.20 124.07 3hyx s ILE 226 Ca -0.02 -1.09 0.07 0.00 0.00 0.00 0.00 60.65 59.61 3hyx s ILE 226 Cb -0.04 -1.75 -0.04 0.00 0.01 0.00 0.00 42.46 40.64 3hyx s ILE 226 CO -0.02 0.08 0.17 -1.61 0.00 0.00 0.00 174.94 173.56 3hyx s GLU 227 N 1.39 2.86 0.42 2.79 0.41 1.00 -4.23 118.70 123.34 3hyx s GLU 227 Ca -0.03 -1.06 0.26 0.00 -0.41 0.00 0.00 54.97 53.72 3hyx s GLU 227 Cb -0.17 -2.54 1.31 0.00 -1.78 0.00 0.00 34.13 30.95 3hyx s GLU 227 CO -0.07 0.41 1.67 -1.35 -0.49 0.00 0.00 175.26 175.43 3hyx h PRO 228 N 1.66 0.18 0.00 0.39 0.11 -1.93 -2.56 132.00 129.85 3hyx h PRO 228 Ca -0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3hyx h PRO 228 Cb 1.23 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3hyx h PRO 228 CO 0.61 0.12 -1.38 -0.40 -0.21 0.00 0.00 178.00 176.74 3hyx n ASP 229 N -4.70 1.77 -3.27 -2.05 5.75 -1.26 -4.78 116.55 108.01 3hyx n ASP 229 Ca 0.33 -0.16 -0.13 0.00 -0.01 0.00 0.00 54.79 54.82 3hyx n ASP 229 Cb 1.24 1.46 -0.03 0.00 -1.03 0.00 0.00 41.12 42.76 3hyx n ASP 229 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 3hyx s LYS 230 N -2.74 1.93 -0.09 0.11 -2.85 -0.96 -1.20 119.74 113.94 3hyx s LYS 230 Ca -0.03 -1.65 -0.00 0.00 -1.00 0.00 0.00 55.97 53.29 3hyx s LYS 230 Cb 0.08 0.48 0.02 0.00 -2.06 0.00 0.00 37.83 36.35 3hyx s LYS 230 CO 0.53 -0.82 -0.06 0.08 0.10 0.00 0.00 175.35 175.18 3hyx s VAL 231 N -3.03 0.81 -0.15 1.79 1.01 -0.76 -0.00 120.40 120.07 3hyx s VAL 231 Ca 0.27 -0.18 -0.07 0.00 0.00 0.00 0.00 61.98 62.00 3hyx s VAL 231 Cb -0.01 -0.86 -0.04 0.00 0.00 0.00 0.00 36.38 35.47 3hyx s VAL 231 CO 0.18 0.32 0.11 -0.63 0.00 0.00 0.00 175.10 175.08 3hyx s ILE 232 N 1.59 5.20 0.16 2.22 1.01 0.10 -1.81 121.20 129.67 3hyx s ILE 232 Ca 0.01 0.10 0.02 0.00 0.00 0.00 0.00 60.65 60.79 3hyx s ILE 232 Cb -0.13 -3.31 -0.05 0.00 0.01 0.00 0.00 42.46 38.99 3hyx s ILE 232 CO -0.05 0.53 -0.02 -0.72 0.00 0.00 0.00 174.94 174.68 3hyx s TYR 233 N -0.30 1.20 -0.07 3.97 1.13 0.60 -1.64 117.35 122.24 3hyx s TYR 233 Ca 0.10 -0.96 0.03 0.00 -1.41 0.00 0.00 57.07 54.83 3hyx s TYR 233 Cb -0.12 -0.68 0.00 0.00 -1.10 0.00 0.00 41.96 40.07 3hyx s TYR 233 CO 0.01 -0.15 -0.17 -2.00 -2.51 0.00 0.00 175.55 170.73 3hyx s GLU 234 N -3.88 2.04 0.35 -3.49 2.12 0.16 -1.06 118.70 114.93 3hyx s GLU 234 Ca 0.22 -0.59 -0.00 0.00 0.36 0.00 0.00 54.97 54.95 3hyx s GLU 234 Cb 0.05 -1.66 0.07 0.00 0.26 0.00 0.00 34.13 32.85 3hyx s GLU 234 CO 0.03 0.14 0.48 -0.40 -0.54 0.00 0.00 175.26 174.96 3hyx n ASP 235 N 3.50 0.60 0.00 -1.70 5.68 -0.98 0.26 116.55 123.93 3hyx n ASP 235 Ca -0.20 -1.52 0.12 0.00 -0.50 0.00 0.00 54.79 52.69 3hyx n ASP 235 Cb 0.52 -0.31 0.61 0.00 -1.14 0.00 0.00 41.12 40.80 3hyx n ASP 235 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 3hyx n LEU 236 N 0.00 0.00 0.10 -2.12 4.77 -1.26 -2.36 117.00 116.12 3hyx n LEU 236 Ca 0.08 0.32 0.12 0.00 -0.03 0.00 0.00 56.01 56.49 3hyx n LEU 236 Cb 0.28 -0.32 0.03 0.00 -2.33 0.00 0.00 43.42 41.07 3hyx n LEU 236 CO 0.19 -0.05 0.09 0.78 -1.33 0.00 0.00 177.39 177.06 3hyx h ASN 237 N 0.00 0.00 0.00 -1.43 -0.26 -1.97 -3.47 115.58 108.44 3hyx h ASN 237 Ca 0.00 -0.05 0.00 0.00 -0.56 0.00 0.00 56.30 55.69 3hyx h ASN 237 Cb 0.27 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.53 3hyx h ASN 237 CO 0.00 0.02 0.00 0.61 -1.06 0.00 0.00 177.43 177.00 3hyx n GLY 238 N 1.21 0.97 3.74 2.83 0.00 -1.00 -5.09 105.19 107.85 3hyx n GLY 238 Ca 0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 3hyx n GLY 238 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3hyx s ASN 239 N -2.10 7.27 0.17 1.61 0.01 -1.26 -4.90 114.94 115.74 3hyx s ASN 239 Ca 0.00 1.52 -0.22 0.00 -0.71 0.00 0.00 52.86 53.44 3hyx s ASN 239 Cb 0.00 -2.50 -0.08 0.00 0.41 0.00 0.00 41.25 39.08 3hyx s ASN 239 CO 0.00 -0.03 0.73 -0.89 -1.51 0.00 0.00 177.10 175.40 3hyx s THR 240 N 0.08 4.49 0.03 1.60 2.01 -1.26 -2.31 115.64 120.28 3hyx s THR 240 Ca 0.41 1.48 0.01 0.00 0.31 0.00 0.00 61.69 63.91 3hyx s THR 240 Cb -0.21 -4.00 -0.02 0.00 0.01 0.00 0.00 72.50 68.28 3hyx s THR 240 CO 0.24 0.41 -0.05 -1.00 -0.69 0.00 0.00 174.62 173.53 3hyx s HIS 241 N -1.28 0.46 0.34 4.92 3.76 -0.23 -5.01 115.29 118.25 3hyx s HIS 241 Ca 0.37 -0.47 0.10 0.00 -0.15 0.00 0.00 55.06 54.91 3hyx s HIS 241 Cb -0.20 -0.29 -0.06 0.00 1.11 0.00 0.00 32.58 33.13 3hyx s HIS 241 CO 0.23 -0.12 -0.10 -1.83 -0.85 0.00 0.00 174.74 172.07 3hyx s GLU 242 N -1.38 1.82 -0.13 1.40 -1.05 -1.26 -0.29 118.70 117.80 3hyx s GLU 242 Ca -0.11 -1.93 -0.06 0.00 -0.15 0.00 0.00 54.97 52.71 3hyx s GLU 242 Cb -0.09 -1.71 0.05 0.00 -0.44 0.00 0.00 34.13 31.94 3hyx s GLU 242 CO -0.00 0.15 0.30 0.08 0.95 0.00 0.00 175.26 176.73 3hyx s VAL 243 N -2.60 -0.12 0.58 1.83 1.01 -0.75 -4.98 120.40 115.37 3hyx s VAL 243 Ca 0.32 0.15 -0.19 0.00 0.00 0.00 0.00 61.98 62.27 3hyx s VAL 243 Cb 0.02 -0.46 -0.04 0.00 0.00 0.00 0.00 36.38 35.90 3hyx s VAL 243 CO 0.16 0.06 1.18 -2.84 0.00 0.00 0.00 175.10 173.66 3hyx s PRO 244 N 1.52 3.07 -0.26 2.72 0.02 -1.26 -1.83 135.00 138.98 3hyx s PRO 244 Ca -0.08 1.73 -0.09 0.00 0.02 0.00 0.00 61.00 62.58 3hyx s PRO 244 Cb -0.10 -1.95 0.11 0.00 0.02 0.00 0.00 34.50 32.58 3hyx s PRO 244 CO -0.10 -1.10 0.57 0.00 -0.33 0.00 0.00 177.00 176.04 3hyx s ALA 245 N -1.71 -1.72 -0.11 -1.55 0.00 -0.34 -4.63 121.76 111.70 3hyx s ALA 245 Ca 0.75 2.05 0.16 0.00 0.00 0.00 0.00 51.96 54.92 3hyx s ALA 245 Cb -0.28 -1.59 -0.18 0.00 0.00 0.00 0.00 23.12 21.07 3hyx s ALA 245 CO 0.32 -0.84 0.69 1.17 0.00 0.00 0.00 175.76 177.11 3hyx n LYS 246 N 5.36 0.63 -3.74 0.00 4.81 0.48 -4.05 118.16 121.65 3hyx n LYS 246 Ca -0.11 0.19 -0.14 0.00 -0.87 0.00 0.00 58.31 57.38 3hyx n LYS 246 Cb 0.50 -1.76 -0.14 0.00 0.02 0.00 0.00 35.03 33.64 3hyx n LYS 246 CO 0.00 0.00 0.00 0.12 1.17 0.00 0.00 177.40 178.69 3hyx s PHE 247 N -2.85 -0.17 0.08 5.64 2.19 -1.04 -5.01 117.98 116.83 3hyx s PHE 247 Ca -0.04 0.50 0.07 0.00 0.33 0.00 0.00 56.93 57.78 3hyx s PHE 247 Cb 0.09 -0.09 -0.03 0.00 -1.31 0.00 0.00 43.02 41.68 3hyx s PHE 247 CO 0.82 -0.17 -0.18 0.95 1.83 0.00 0.00 175.22 178.47 3hyx s THR 248 N 1.23 1.47 -0.20 0.12 -4.23 -1.26 -1.88 115.64 110.88 3hyx s THR 248 Ca -0.09 -1.37 -0.04 0.00 -1.18 0.00 0.00 61.69 59.01 3hyx s THR 248 Cb -0.12 -1.34 0.09 0.00 1.34 0.00 0.00 72.50 72.47 3hyx s THR 248 CO -0.06 -0.07 0.20 -0.32 -0.54 0.00 0.00 174.62 173.84 3hyx s MET 249 N -1.68 0.18 -0.00 3.99 0.00 -1.18 -2.26 119.30 118.35 3hyx s MET 249 Ca 0.04 0.14 0.08 0.00 0.00 0.00 0.00 55.69 55.94 3hyx s MET 249 Cb -0.10 -1.28 -0.02 0.00 0.00 0.00 0.00 34.83 33.44 3hyx s MET 249 CO 0.03 -0.68 -0.24 -0.06 0.00 0.00 0.00 175.02 174.08 3hyx s PHE 250 N 2.30 2.11 -0.07 4.11 0.08 -0.88 -2.34 117.98 123.29 3hyx s PHE 250 Ca 0.06 -0.40 -0.30 0.00 0.12 0.00 0.00 56.93 56.42 3hyx s PHE 250 Cb -0.16 -1.33 -0.03 0.00 -0.57 0.00 0.00 43.02 40.93 3hyx s PHE 250 CO -0.13 0.01 1.21 -1.64 -0.10 0.00 0.00 175.22 174.57 3hyx s MET 251 N -0.74 4.33 0.92 0.44 -1.94 -0.15 -4.58 119.30 117.59 3hyx s MET 251 Ca 0.09 1.67 -0.12 0.00 -1.71 0.00 0.00 55.69 55.63 3hyx s MET 251 Cb -0.09 -3.59 0.14 0.00 2.01 0.00 0.00 34.83 33.30 3hyx s MET 251 CO -0.00 -0.49 1.09 -1.25 -0.01 0.00 0.00 175.02 174.36 3hyx s PRO 252 N 2.40 1.04 0.34 2.03 0.04 -1.26 -3.59 135.00 136.01 3hyx s PRO 252 Ca 0.56 0.78 0.02 0.00 0.04 0.00 0.00 61.00 62.40 3hyx s PRO 252 Cb -0.24 -1.79 -0.02 0.00 0.04 0.00 0.00 34.50 32.49 3hyx s PRO 252 CO 0.21 -2.38 0.51 -1.54 0.04 0.00 0.00 177.00 173.84 3hyx s SER 253 N -3.39 6.18 0.07 6.66 1.04 -0.72 -4.72 113.70 118.82 3hyx s SER 253 Ca 0.64 0.24 0.03 0.00 0.48 0.00 0.00 55.95 57.35 3hyx s SER 253 Cb -0.18 -1.80 -0.04 0.00 0.10 0.00 0.00 66.02 64.10 3hyx s SER 253 CO 0.57 -0.33 0.04 -0.36 0.98 0.00 0.00 173.24 174.14 3hyx s PHE 254 N -2.26 3.10 0.10 5.02 0.08 -1.26 -0.32 117.98 122.44 3hyx s PHE 254 Ca 0.41 0.04 -0.09 0.00 0.12 0.00 0.00 56.93 57.41 3hyx s PHE 254 Cb -0.09 -1.60 -0.00 0.00 -0.57 0.00 0.00 43.02 40.75 3hyx s PHE 254 CO 0.34 0.50 0.21 1.14 -0.10 0.00 0.00 175.22 177.31 3hyx s GLN 255 N -2.20 0.90 0.69 0.44 -2.07 -0.46 -4.91 119.66 112.04 3hyx s GLN 255 Ca 0.26 -0.99 -0.14 0.00 -1.82 0.00 0.00 55.36 52.67 3hyx s GLN 255 Cb -0.12 0.35 0.01 0.00 -1.09 0.00 0.00 33.01 32.17 3hyx s GLN 255 CO 0.18 -0.30 1.11 0.20 -1.32 0.00 0.00 175.29 175.17 3hyx s GLY 256 N -2.88 2.08 0.96 2.60 0.00 0.17 -1.63 107.32 108.62 3hyx s GLY 256 Ca 0.07 0.53 -0.16 0.00 0.00 0.00 0.00 44.72 45.16 3hyx s GLY 256 CO -0.09 0.88 1.32 2.56 0.00 0.00 0.00 173.10 177.77 3hyx s PRO 257 N -4.22 0.61 0.17 2.90 0.04 -1.26 -4.76 135.00 128.49 3hyx s PRO 257 Ca 0.67 -0.47 0.07 0.00 0.04 0.00 0.00 61.00 61.31 3hyx s PRO 257 Cb -0.21 -1.86 0.00 0.00 0.04 0.00 0.00 34.50 32.47 3hyx s PRO 257 CO 0.44 -2.42 1.40 1.49 0.04 0.00 0.00 177.00 177.95 3hyx h GLU 258 N -1.63 0.03 -0.84 4.56 4.57 -1.92 -2.77 114.58 116.58 3hyx h GLU 258 Ca -0.44 -0.04 0.06 0.00 -1.18 0.00 0.00 59.36 57.77 3hyx h GLU 258 Cb 1.23 0.01 -0.06 0.00 -0.16 0.00 0.00 28.75 29.77 3hyx h GLU 258 CO 0.37 0.87 0.52 -0.24 -1.18 0.00 0.00 179.01 179.34 3hyx h VAL 259 N 0.01 1.03 -0.06 0.32 3.04 -1.83 0.87 116.25 119.63 3hyx h VAL 259 Ca -0.02 -0.32 -0.01 0.00 -1.01 0.00 0.00 66.70 65.34 3hyx h VAL 259 Cb 1.52 0.01 -0.00 0.00 -2.01 0.00 0.00 31.29 30.81 3hyx h VAL 259 CO 0.12 0.17 -0.02 0.58 -1.01 0.00 0.00 177.57 177.41 3hyx h VAL 260 N 0.94 1.31 -1.05 1.51 2.07 -1.87 -2.96 116.25 116.19 3hyx h VAL 260 Ca 0.37 -0.96 0.28 0.00 0.82 0.00 0.00 66.70 67.21 3hyx h VAL 260 Cb 0.17 1.83 -0.07 0.00 -1.52 0.00 0.00 31.29 31.70 3hyx h VAL 260 CO -0.17 0.26 0.71 0.00 0.02 0.00 0.00 177.57 178.39 3hyx h ALA 261 N 0.65 2.56 -0.24 1.67 0.00 -1.13 -2.09 119.26 120.67 3hyx h ALA 261 Ca 0.01 0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 3hyx h ALA 261 Cb 0.43 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 3hyx h ALA 261 CO 0.01 -0.92 -0.22 0.66 0.00 0.00 0.00 179.25 178.78 3hyx h SER 262 N 0.23 0.44 -4.11 0.00 4.64 -0.67 -3.41 113.55 110.67 3hyx h SER 262 Ca 0.56 -0.14 -0.49 0.00 -0.47 0.00 0.00 61.79 61.25 3hyx h SER 262 Cb 1.72 -0.12 0.16 0.00 -0.31 0.00 0.00 62.40 63.85 3hyx h SER 262 CO -0.17 0.67 0.24 0.00 -0.87 0.00 0.00 176.83 176.70 3hyx s ALA 263 N -4.55 1.56 1.20 5.18 0.00 -0.79 -4.73 121.76 119.63 3hyx s ALA 263 Ca -0.07 0.15 -0.14 0.00 0.00 0.00 0.00 51.96 51.90 3hyx s ALA 263 Cb 0.14 -3.27 0.22 0.00 0.00 0.00 0.00 23.12 20.21 3hyx s ALA 263 CO 0.78 -2.39 0.50 0.41 0.00 0.00 0.00 175.76 175.05 3hyx n GLY 264 N -0.73 -3.40 0.00 0.00 0.00 -1.26 -4.58 105.19 95.21 3hyx n GLY 264 Ca 0.08 -1.11 0.05 0.00 0.00 0.00 0.00 46.02 45.04 3hyx n GLY 264 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3hyx n ASP 265 N -4.00 0.00 0.01 1.61 5.75 -1.26 -2.19 116.55 116.46 3hyx n ASP 265 Ca 0.08 -1.23 -0.04 0.00 -0.01 0.00 0.00 54.79 53.58 3hyx n ASP 265 Cb 0.34 0.00 -0.11 0.00 -1.03 0.00 0.00 41.12 40.32 3hyx n ASP 265 CO 0.00 0.00 0.00 0.11 -0.11 0.00 0.00 177.20 177.20 3hyx h LYS 266 N 0.00 0.00 0.00 0.11 1.79 -1.99 -3.39 116.57 113.09 3hyx h LYS 266 Ca 0.00 0.00 -0.36 0.00 -2.18 0.00 0.00 60.65 58.11 3hyx h LYS 266 Cb 0.00 0.00 -0.07 0.00 -1.58 0.00 0.00 32.23 30.58 3hyx h LYS 266 CO 0.00 0.41 -2.37 0.28 -1.08 0.00 0.00 179.45 176.69 3hyx n VAL 267 N -2.98 1.37 -3.64 0.50 0.31 -1.12 -4.72 118.33 108.04 3hyx n VAL 267 Ca -0.13 -0.75 -0.40 0.00 -0.01 0.00 0.00 64.34 63.05 3hyx n VAL 267 Cb 0.94 -0.73 -0.11 0.00 -0.91 0.00 0.00 33.84 33.03 3hyx n VAL 267 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3hyx s ALA 268 N -2.48 3.22 -0.30 3.52 0.00 -0.93 -1.14 121.76 123.65 3hyx s ALA 268 Ca -0.16 -1.69 -0.30 0.00 0.00 0.00 0.00 51.96 49.81 3hyx s ALA 268 Cb 0.07 -2.50 -0.07 0.00 0.00 0.00 0.00 23.12 20.62 3hyx s ALA 268 CO 0.74 -1.32 2.25 -1.71 0.00 0.00 0.00 175.76 175.71 3hyx n ASN 269 N 4.95 2.76 0.01 0.00 4.05 0.50 -4.60 115.26 122.94 3hyx n ASN 269 Ca -0.12 0.18 0.21 0.00 0.45 0.00 0.00 54.58 55.30 3hyx n ASN 269 Cb 0.46 -1.46 0.72 0.00 1.23 0.00 0.00 39.78 40.73 3hyx n ASN 269 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 177.26 175.76 3hyx h PRO 270 N 14.74 0.00 0.00 1.20 0.13 -1.88 0.39 132.00 146.57 3hyx h PRO 270 Ca -0.34 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.69 3hyx h PRO 270 Cb 1.27 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.39 3hyx h PRO 270 CO 1.01 0.00 -0.46 0.00 -0.23 0.00 0.00 178.00 178.32 3hyx h ALA 271 N 1.65 0.91 0.00 -0.56 0.00 -1.97 -3.39 119.26 115.90 3hyx h ALA 271 Ca 0.25 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.74 3hyx h ALA 271 Cb 1.10 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.82 3hyx h ALA 271 CO -0.00 0.57 0.00 0.27 0.00 0.00 0.00 179.25 180.09 3hyx n ASN 272 N -3.52 0.00 -0.82 0.00 0.23 -0.57 -5.03 115.26 105.55 3hyx n ASN 272 Ca -0.00 -1.00 -0.11 0.00 -0.53 0.00 0.00 54.58 52.94 3hyx n ASN 272 Cb 0.58 0.00 -0.05 0.00 -2.08 0.00 0.00 39.78 38.23 3hyx n ASN 272 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 3hyx n LYS 273 N 0.00 -1.53 -2.85 -3.83 5.02 0.13 0.41 118.16 115.51 3hyx n LYS 273 Ca 0.00 0.86 -0.26 0.00 -2.02 0.00 0.00 58.31 56.88 3hyx n LYS 273 Cb 0.31 -5.18 -0.00 0.00 -0.02 0.00 0.00 35.03 30.14 3hyx n LYS 273 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 3hyx s MET 274 N -2.82 3.51 0.03 1.97 -1.94 -1.25 -3.75 119.30 115.04 3hyx s MET 274 Ca 0.00 0.04 -0.30 0.00 -1.71 0.00 0.00 55.69 53.71 3hyx s MET 274 Cb 0.00 -2.46 -0.06 0.00 2.01 0.00 0.00 34.83 34.33 3hyx s MET 274 CO 0.00 -0.11 1.30 0.08 -0.01 0.00 0.00 175.02 176.28 3hyx s VAL 275 N -2.62 3.84 -0.13 -6.03 1.01 -0.52 -0.37 120.40 115.57 3hyx s VAL 275 Ca 0.45 1.27 -0.29 0.00 0.00 0.00 0.00 61.98 63.41 3hyx s VAL 275 Cb -0.10 -3.82 -0.03 0.00 0.00 0.00 0.00 36.38 32.43 3hyx s VAL 275 CO 0.42 0.05 1.50 -0.63 0.00 0.00 0.00 175.10 176.44 3hyx s ILE 276 N 1.74 3.87 0.09 2.22 1.01 -0.29 -1.31 121.20 128.52 3hyx s ILE 276 Ca 0.61 1.03 0.04 0.00 0.00 0.00 0.00 60.65 62.33 3hyx s ILE 276 Cb -0.30 -3.72 -0.03 0.00 0.01 0.00 0.00 42.46 38.41 3hyx s ILE 276 CO 0.27 -0.15 -0.11 0.68 0.00 0.00 0.00 174.94 175.63 3hyx s VAL 277 N 4.09 0.96 0.00 2.92 -7.23 -1.26 -4.15 120.40 115.73 3hyx s VAL 277 Ca 0.66 -1.56 0.00 0.00 -1.81 0.00 0.00 61.98 59.27 3hyx s VAL 277 Cb -0.27 -1.28 0.00 0.00 0.56 0.00 0.00 36.38 35.39 3hyx s VAL 277 CO 0.24 -0.49 0.00 -0.46 -0.31 0.00 0.00 175.10 174.08 3hyx n ASN 278 N 0.72 0.00 -0.22 4.85 0.23 0.96 -4.17 115.26 117.63 3hyx n ASN 278 Ca -0.17 -0.02 -0.01 0.00 -0.53 0.00 0.00 54.58 53.85 3hyx n ASN 278 Cb 0.57 0.00 0.20 0.00 -2.08 0.00 0.00 39.78 38.46 3hyx n ASN 278 CO 0.00 0.00 0.00 0.03 -0.93 0.00 0.00 177.26 176.36 3hyx h ARG 279 N 0.00 1.01 -0.54 -3.83 3.08 -0.87 -1.98 114.38 111.24 3hyx h ARG 279 Ca 0.00 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 59.94 3hyx h ARG 279 Cb 0.00 -0.20 0.00 0.00 0.08 0.00 0.00 29.97 29.85 3hyx h ARG 279 CO 0.00 0.74 0.00 0.00 -1.07 0.00 0.00 179.97 179.64 3hyx n PHE 281 N 0.31 -0.88 -4.25 0.00 3.01 -0.74 -4.73 117.46 110.17 3hyx n PHE 281 Ca 0.10 0.00 -0.32 0.00 1.01 0.00 0.00 57.45 58.24 3hyx n PHE 281 Cb 0.42 -3.85 -0.09 0.00 -0.01 0.00 0.00 39.48 35.96 3hyx n PHE 281 CO 0.00 0.00 0.00 -1.14 1.01 0.00 0.00 176.76 176.63 3hyx s GLN 282 N -4.85 2.80 0.12 -1.08 0.74 -1.26 -2.26 119.66 113.87 3hyx s GLN 282 Ca 0.00 -0.61 -0.31 0.00 0.05 0.00 0.00 55.36 54.49 3hyx s GLN 282 Cb 0.00 -2.68 -0.08 0.00 1.10 0.00 0.00 33.01 31.35 3hyx s GLN 282 CO 0.00 0.62 1.41 1.21 -0.55 0.00 0.00 175.29 177.98 3hyx s ASN 283 N -1.62 6.80 0.37 6.67 2.47 0.71 -0.03 114.94 130.31 3hyx s ASN 283 Ca 0.20 2.35 0.09 0.00 0.42 0.00 0.00 52.86 55.92 3hyx s ASN 283 Cb -0.12 -2.59 0.83 0.00 -1.45 0.00 0.00 41.25 37.93 3hyx s ASN 283 CO 0.11 -0.67 1.92 -0.65 -3.72 0.00 0.00 177.10 174.09 3hyx h PRO 284 N 6.84 0.65 0.01 0.43 0.11 -1.88 -3.29 132.00 134.87 3hyx h PRO 284 Ca -0.42 -0.04 -0.39 0.00 0.11 0.00 0.00 66.00 65.26 3hyx h PRO 284 Cb 1.21 -0.15 -0.06 0.00 0.11 0.00 0.00 31.00 32.11 3hyx h PRO 284 CO 0.87 0.43 -2.42 0.25 -0.21 0.00 0.00 178.00 176.92 3hyx n THR 285 N -4.51 1.51 -3.38 -1.15 -2.24 -1.26 -4.73 114.28 98.51 3hyx n THR 285 Ca 0.14 -0.60 -0.45 0.00 -2.27 0.00 0.00 64.05 60.87 3hyx n THR 285 Cb 0.38 -1.38 -0.03 0.00 -2.10 0.00 0.00 70.33 67.20 3hyx n THR 285 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 3hyx s TYR 286 N -2.52 3.83 0.07 4.78 1.51 -1.24 -4.92 117.35 118.86 3hyx s TYR 286 Ca -0.32 -2.24 0.25 0.00 -1.01 0.00 0.00 57.07 53.75 3hyx s TYR 286 Cb 0.09 -3.74 1.36 0.00 -0.11 0.00 0.00 41.96 39.56 3hyx s TYR 286 CO 0.63 -0.96 1.75 0.87 -1.11 0.00 0.00 175.55 176.73 3hyx h LYS 287 N 7.42 0.00 -0.64 -0.62 1.79 -1.85 -0.24 116.57 122.43 3hyx h LYS 287 Ca 0.11 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.58 3hyx h LYS 287 Cb 0.99 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.64 3hyx h LYS 287 CO 0.80 0.00 0.00 0.27 -1.08 0.00 0.00 179.45 179.44 3hyx n ASN 288 N -2.42 4.57 -4.20 0.86 6.94 -1.26 -4.81 115.26 114.94 3hyx n ASN 288 Ca -0.02 -2.57 -0.31 0.00 -0.02 0.00 0.00 54.58 51.66 3hyx n ASN 288 Cb 0.12 -0.59 -0.17 0.00 -2.36 0.00 0.00 39.78 36.78 3hyx n ASN 288 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 3hyx s ILE 289 N -2.12 1.94 0.03 1.53 1.01 -0.10 0.17 121.20 123.65 3hyx s ILE 289 Ca 0.45 -0.95 0.04 0.00 0.00 0.00 0.00 60.65 60.19 3hyx s ILE 289 Cb 0.32 -1.68 -0.02 0.00 0.01 0.00 0.00 42.46 41.09 3hyx s ILE 289 CO 0.18 0.53 -0.12 -0.36 0.00 0.00 0.00 174.94 175.17 3hyx s PHE 290 N 0.35 1.02 -0.02 3.97 0.40 0.40 -0.21 117.98 123.88 3hyx s PHE 290 Ca -0.17 -0.33 0.05 0.00 -0.60 0.00 0.00 56.93 55.87 3hyx s PHE 290 Cb -0.17 -0.61 -0.03 0.00 0.51 0.00 0.00 43.02 42.72 3hyx s PHE 290 CO 0.08 0.00 -0.15 0.20 0.70 0.00 0.00 175.22 176.05 3hyx s GLY 291 N -1.02 1.53 -0.03 4.36 0.00 -0.96 -0.38 107.32 110.83 3hyx s GLY 291 Ca -0.00 -1.04 0.02 0.00 0.00 0.00 0.00 44.72 43.70 3hyx s GLY 291 CO 0.01 -0.85 -0.07 0.14 0.00 0.00 0.00 173.10 172.33 3hyx s VAL 292 N -0.78 0.63 0.00 1.40 1.01 0.23 -4.89 120.40 117.99 3hyx s VAL 292 Ca 0.12 -0.24 0.00 0.00 0.00 0.00 0.00 61.98 61.86 3hyx s VAL 292 Cb -0.11 -0.59 0.00 0.00 0.00 0.00 0.00 36.38 35.68 3hyx s VAL 292 CO 0.02 0.22 0.00 0.61 0.00 0.00 0.00 175.10 175.95 3hyx n GLY 293 N 3.55 -0.70 0.33 4.51 0.00 -1.26 -4.22 105.19 107.39 3hyx n GLY 293 Ca -0.20 -1.56 0.01 0.00 0.00 0.00 0.00 46.02 44.26 3hyx n GLY 293 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3hyx h VAL 294 N 0.00 1.17 -0.00 1.61 2.07 -1.88 -2.19 116.25 117.03 3hyx h VAL 294 Ca 0.00 -0.39 0.00 0.00 0.82 0.00 0.00 66.70 67.13 3hyx h VAL 294 Cb 0.00 0.33 -0.00 0.00 -1.52 0.00 0.00 31.29 30.10 3hyx h VAL 294 CO 0.00 0.18 0.31 1.62 0.02 0.00 0.00 177.57 179.71 3hyx h VAL 295 N 0.83 0.00 -3.68 2.57 3.04 -1.77 -3.43 116.25 113.81 3hyx h VAL 295 Ca 0.22 0.00 -0.51 0.00 -1.01 0.00 0.00 66.70 65.40 3hyx h VAL 295 Cb -0.02 0.69 -0.00 0.00 -2.01 0.00 0.00 31.29 29.94 3hyx h VAL 295 CO -0.04 0.00 0.43 0.42 -1.01 0.00 0.00 177.57 177.37 3hyx s THR 296 N -4.10 3.88 -0.33 3.17 -4.23 -0.83 -1.44 115.64 111.75 3hyx s THR 296 Ca -0.03 1.75 -0.27 0.00 -1.18 0.00 0.00 61.69 61.96 3hyx s THR 296 Cb 0.09 -4.12 0.01 0.00 1.34 0.00 0.00 72.50 69.83 3hyx s THR 296 CO 0.28 0.36 0.95 0.00 -0.54 0.00 0.00 174.62 175.68 3hyx s ALA 297 N -0.73 3.47 -0.12 3.99 0.00 -0.43 -4.78 121.76 123.17 3hyx s ALA 297 Ca 0.45 -0.29 0.00 0.00 0.00 0.00 0.00 51.96 52.13 3hyx s ALA 297 Cb -0.29 -3.54 0.02 0.00 0.00 0.00 0.00 23.12 19.32 3hyx s ALA 297 CO 0.35 -1.47 -0.12 0.42 0.00 0.00 0.00 175.76 174.95 3hyx s ILE 298 N 3.43 1.35 0.34 0.00 1.01 -1.26 -4.59 121.20 121.47 3hyx s ILE 298 Ca 0.40 -0.51 -0.28 0.00 0.00 0.00 0.00 60.65 60.25 3hyx s ILE 298 Cb -0.12 -1.29 -0.12 0.00 0.01 0.00 0.00 42.46 40.94 3hyx s ILE 298 CO 0.16 0.42 1.37 -0.81 0.00 0.00 0.00 174.94 176.08 3hyx n PRO 299 N 4.67 2.28 -1.53 2.79 -0.04 -1.26 -4.76 135.00 137.15 3hyx n PRO 299 Ca -0.16 0.80 -0.41 0.00 -0.04 0.00 0.00 63.50 63.69 3hyx n PRO 299 Cb 0.50 -2.44 0.02 0.00 -0.04 0.00 0.00 33.50 31.54 3hyx n PRO 299 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 3hyx n PRO 300 N 0.78 0.88 0.27 0.54 -0.04 -1.26 -4.86 135.00 131.31 3hyx n PRO 300 Ca 0.05 0.32 0.16 0.00 -0.04 0.00 0.00 63.50 63.99 3hyx n PRO 300 Cb 0.36 -1.78 0.67 0.00 -0.04 0.00 0.00 33.50 32.71 3hyx n PRO 300 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 3hyx h ILE 301 N 0.99 0.10 -1.75 0.52 2.04 -1.91 -3.44 117.51 114.06 3hyx h ILE 301 Ca -0.43 -0.59 0.08 0.00 1.00 0.00 0.00 64.86 64.93 3hyx h ILE 301 Cb 1.37 1.53 -0.22 0.00 -0.74 0.00 0.00 36.82 38.76 3hyx h ILE 301 CO 0.53 0.04 0.05 -0.70 0.00 0.00 0.00 178.15 178.07 3hyx s GLU 302 N -3.70 0.54 -0.69 2.37 2.12 -1.26 -5.01 118.70 113.06 3hyx s GLU 302 Ca 0.01 1.15 -0.26 0.00 0.36 0.00 0.00 54.97 56.22 3hyx s GLU 302 Cb 0.09 0.48 0.00 0.00 0.26 0.00 0.00 34.13 34.96 3hyx s GLU 302 CO 0.55 -0.15 1.62 0.21 -0.54 0.00 0.00 175.26 176.95 3hyx s LYS 303 N 2.25 2.88 0.24 4.30 2.47 -1.26 -4.82 119.74 125.80 3hyx s LYS 303 Ca -0.07 0.15 -0.12 0.00 -1.56 0.00 0.00 55.97 54.38 3hyx s LYS 303 Cb -0.08 -4.38 -0.08 0.00 -1.46 0.00 0.00 37.83 31.84 3hyx s LYS 303 CO -0.18 -2.52 0.60 0.95 0.16 0.00 0.00 175.35 174.36 3hyx s THR 304 N 7.64 4.85 0.30 3.43 -4.23 -1.26 -4.99 115.64 121.38 3hyx s THR 304 Ca 0.54 0.67 0.06 0.00 -1.18 0.00 0.00 61.69 61.77 3hyx s THR 304 Cb -0.10 -3.64 0.29 0.00 1.34 0.00 0.00 72.50 70.39 3hyx s THR 304 CO 0.16 -0.04 1.74 -0.65 -0.54 0.00 0.00 174.62 175.29 3hyx h PRO 305 N 2.67 0.57 -5.28 3.99 0.11 -1.94 -3.29 132.00 128.82 3hyx h PRO 305 Ca -0.47 -0.03 -0.61 0.00 0.11 0.00 0.00 66.00 65.00 3hyx h PRO 305 Cb 1.18 -0.13 -0.12 0.00 0.11 0.00 0.00 31.00 32.03 3hyx h PRO 305 CO 0.68 0.38 -0.37 0.42 -0.21 0.00 0.00 178.00 178.89 3hyx s ILE 306 N -5.85 5.30 -0.17 4.15 -1.09 -1.26 -5.04 121.20 117.24 3hyx s ILE 306 Ca -0.11 0.42 -0.36 0.00 -2.23 0.00 0.00 60.65 58.36 3hyx s ILE 306 Cb 0.25 -3.60 -0.13 0.00 -1.58 0.00 0.00 42.46 37.41 3hyx s ILE 306 CO 0.79 0.33 1.86 -2.65 -1.23 0.00 0.00 174.94 174.04 3hyx n PRO 307 N 4.16 1.77 -4.29 2.79 -0.02 -1.24 -4.85 135.00 133.31 3hyx n PRO 307 Ca -0.12 0.64 -0.19 0.00 -2.02 0.00 0.00 63.50 61.80 3hyx n PRO 307 Cb 0.52 -2.46 -0.11 0.00 -0.02 0.00 0.00 33.50 31.42 3hyx n PRO 307 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 3hyx s THR 308 N 4.18 1.57 0.11 3.45 -4.23 -1.26 0.45 115.64 119.90 3hyx s THR 308 Ca 0.96 -1.85 0.01 0.00 -1.18 0.00 0.00 61.69 59.62 3hyx s THR 308 Cb -0.83 -1.72 0.01 0.00 1.34 0.00 0.00 72.50 71.31 3hyx s THR 308 CO 0.56 -0.40 0.08 0.61 -0.54 0.00 0.00 174.62 174.93 3hyx n GLY 309 N 0.33 3.09 3.43 3.99 0.00 -0.74 -4.82 105.19 110.49 3hyx n GLY 309 Ca -0.14 -2.20 -0.33 0.00 0.00 0.00 0.00 46.02 43.35 3hyx n GLY 309 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hyx s VAL 310 N -0.64 3.48 0.60 1.61 0.11 -1.26 -4.43 120.40 119.87 3hyx s VAL 310 Ca 0.06 -0.51 -0.18 0.00 -2.93 0.00 0.00 61.98 58.42 3hyx s VAL 310 Cb -0.00 -2.50 -0.03 0.00 -1.53 0.00 0.00 36.38 32.31 3hyx s VAL 310 CO 0.04 0.51 1.19 -2.16 -3.33 0.00 0.00 175.10 171.34 3hyx s PRO 311 N 0.37 2.98 -0.38 1.54 0.04 -0.91 -4.90 135.00 133.73 3hyx s PRO 311 Ca -0.07 1.77 0.02 0.00 0.04 0.00 0.00 61.00 62.75 3hyx s PRO 311 Cb -0.15 -1.94 0.11 0.00 0.04 0.00 0.00 34.50 32.56 3hyx s PRO 311 CO 0.04 -1.18 0.12 0.15 0.04 0.00 0.00 177.00 176.17 3hyx s LYS 312 N -3.39 1.70 0.64 4.56 3.01 -1.26 -5.10 119.74 119.90 3hyx s LYS 312 Ca 0.76 -1.94 -0.11 0.00 -1.01 0.00 0.00 55.97 53.67 3hyx s LYS 312 Cb -0.29 -3.34 -0.02 0.00 -1.01 0.00 0.00 37.83 33.17 3hyx s LYS 312 CO 0.33 -1.00 1.03 0.95 0.51 0.00 0.00 175.35 177.17 3hyx s THR 313 N 0.85 4.30 0.31 2.17 -4.23 -1.26 -4.77 115.64 113.01 3hyx s THR 313 Ca 0.11 0.68 0.06 0.00 -1.18 0.00 0.00 61.69 61.36 3hyx s THR 313 Cb -0.21 -3.73 0.30 0.00 1.34 0.00 0.00 72.50 70.20 3hyx s THR 313 CO -0.06 -0.95 1.79 1.23 -0.54 0.00 0.00 174.62 176.09 3hyx h GLY 314 N -0.39 1.72 1.23 3.99 0.00 -1.96 0.79 103.07 108.44 3hyx h GLY 314 Ca -0.45 -0.36 -0.21 0.00 0.00 0.00 0.00 47.33 46.32 3hyx h GLY 314 CO 0.62 -0.03 -0.70 1.98 0.00 0.00 0.00 176.54 178.41 3hyx h MET 315 N 0.77 0.78 -0.68 4.80 1.85 -1.85 -0.30 114.93 120.30 3hyx h MET 315 Ca 0.56 -0.58 0.01 0.00 -0.61 0.00 0.00 59.70 59.08 3hyx h MET 315 Cb 0.87 0.11 -0.04 0.00 0.43 0.00 0.00 31.60 32.97 3hyx h MET 315 CO -0.35 1.20 0.44 0.52 -0.40 0.00 0.00 176.91 178.32 3hyx h MET 316 N 0.55 0.86 -0.26 0.39 2.07 -1.28 -1.63 114.93 115.64 3hyx h MET 316 Ca -0.03 -0.05 -0.16 0.00 -2.07 0.00 0.00 59.70 57.39 3hyx h MET 316 Cb 1.31 -0.19 -0.00 0.00 -1.87 0.00 0.00 31.60 30.85 3hyx h MET 316 CO 0.14 0.57 -0.44 0.82 1.07 0.00 0.00 176.91 179.07 3hyx h ILE 317 N 0.89 1.30 -0.92 -1.22 2.04 -0.83 -0.67 117.51 118.10 3hyx h ILE 317 Ca 0.26 -1.64 0.08 0.00 1.00 0.00 0.00 64.86 64.56 3hyx h ILE 317 Cb -0.06 1.69 -0.06 0.00 -0.74 0.00 0.00 36.82 37.64 3hyx h ILE 317 CO -0.07 0.53 0.60 -0.33 0.00 0.00 0.00 178.15 178.87 3hyx h GLU 318 N 0.51 0.97 -0.20 2.37 5.08 -0.83 -0.22 114.58 122.25 3hyx h GLU 318 Ca 0.02 -0.06 -0.10 0.00 -1.00 0.00 0.00 59.36 58.22 3hyx h GLU 318 Cb 1.04 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 30.07 3hyx h GLU 318 CO 0.10 0.64 -0.28 1.96 -1.00 0.00 0.00 179.01 180.43 3hyx h GLN 319 N 1.00 0.54 -0.36 2.33 4.20 -1.11 -1.95 115.11 119.76 3hyx h GLN 319 Ca 0.41 -0.32 0.07 0.00 0.06 0.00 0.00 58.65 58.88 3hyx h GLN 319 Cb 0.29 0.03 -0.07 0.00 0.30 0.00 0.00 27.48 28.03 3hyx h GLN 319 CO -0.17 0.91 -0.11 0.52 -0.67 0.00 0.00 178.83 179.31 3hyx h MET 320 N 0.20 -0.03 -0.53 1.46 2.86 -0.40 -1.44 114.93 117.05 3hyx h MET 320 Ca 0.02 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.63 3hyx h MET 320 Cb 0.86 0.01 -0.03 0.00 0.06 0.00 0.00 31.60 32.50 3hyx h MET 320 CO 0.07 -0.02 0.22 0.00 1.06 0.00 0.00 176.91 178.23 3hyx h ALA 321 N 1.30 1.38 -0.19 6.32 0.00 -0.95 0.24 119.26 127.36 3hyx h ALA 321 Ca 0.18 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 3hyx h ALA 321 Cb 0.30 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 3hyx h ALA 321 CO -0.39 0.47 -0.07 1.98 0.00 0.00 0.00 179.25 181.25 3hyx h MET 322 N 0.76 0.39 -0.44 0.00 -1.53 -0.91 -1.21 114.93 111.99 3hyx h MET 322 Ca 0.18 -0.16 -0.03 0.00 -3.44 0.00 0.00 59.70 56.26 3hyx h MET 322 Cb 0.14 -0.02 -0.02 0.00 -0.55 0.00 0.00 31.60 31.16 3hyx h MET 322 CO -0.02 0.66 0.17 0.00 0.14 0.00 0.00 176.91 177.86 3hyx h ALA 323 N 0.72 0.58 -0.41 0.39 0.00 -0.81 -2.41 119.26 117.32 3hyx h ALA 323 Ca 0.05 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 3hyx h ALA 323 Cb 0.53 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 3hyx h ALA 323 CO 0.02 0.20 0.06 0.28 0.00 0.00 0.00 179.25 179.80 3hyx h VAL 324 N 0.57 1.25 -0.15 0.00 2.07 -0.93 -0.82 116.25 118.23 3hyx h VAL 324 Ca 0.15 -0.89 0.05 0.00 0.82 0.00 0.00 66.70 66.82 3hyx h VAL 324 Cb 0.21 1.04 -0.05 0.00 -1.52 0.00 0.00 31.29 30.97 3hyx h VAL 324 CO -0.01 0.31 -0.19 0.00 0.02 0.00 0.00 177.57 177.70 3hyx h ALA 325 N 0.92 -0.12 -0.82 1.67 0.00 -1.10 -0.50 119.26 119.31 3hyx h ALA 325 Ca 0.12 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 3hyx h ALA 325 Cb 0.39 0.38 -0.04 0.00 0.00 0.00 0.00 17.79 18.52 3hyx h ALA 325 CO 0.01 -0.64 0.42 0.45 0.00 0.00 0.00 179.25 179.49 3hyx h HIS 326 N -0.23 1.15 -0.88 0.00 3.86 -1.32 -1.62 115.15 116.11 3hyx h HIS 326 Ca 0.11 -0.04 0.01 0.00 -1.16 0.00 0.00 60.37 59.28 3hyx h HIS 326 Cb 0.39 -0.36 -0.04 0.00 1.06 0.00 0.00 27.41 28.45 3hyx h HIS 326 CO -0.31 0.82 0.58 -0.91 0.86 0.00 0.00 177.93 178.97 3hyx h ASN 327 N 1.16 1.01 -0.03 2.45 -0.26 -0.51 0.14 115.58 119.54 3hyx h ASN 327 Ca 0.29 -0.03 -0.10 0.00 -0.56 0.00 0.00 56.30 55.90 3hyx h ASN 327 Cb 0.08 -0.25 0.01 0.00 -1.06 0.00 0.00 38.32 37.09 3hyx h ASN 327 CO -0.04 0.73 -0.39 0.40 -1.06 0.00 0.00 177.43 177.07 3hyx h ILE 328 N 1.19 1.46 -0.26 2.81 2.04 -0.77 -2.40 117.51 121.58 3hyx h ILE 328 Ca 0.32 -1.90 -0.03 0.00 1.00 0.00 0.00 64.86 64.25 3hyx h ILE 328 Cb -0.14 2.54 -0.01 0.00 -0.74 0.00 0.00 36.82 38.47 3hyx h ILE 328 CO -0.07 0.54 0.06 0.58 0.00 0.00 0.00 178.15 179.26 3hyx h VAL 329 N -0.24 1.22 -0.72 1.67 2.07 -1.20 -0.16 116.25 118.88 3hyx h VAL 329 Ca -0.04 -0.71 0.05 0.00 0.82 0.00 0.00 66.70 66.82 3hyx h VAL 329 Cb 1.09 1.19 -0.04 0.00 -1.52 0.00 0.00 31.29 32.00 3hyx h VAL 329 CO 0.08 0.23 0.48 0.78 0.02 0.00 0.00 177.57 179.15 3hyx h ASN 330 N 0.25 0.70 -0.26 0.57 4.21 -0.80 0.72 115.58 120.97 3hyx h ASN 330 Ca 0.08 -0.00 -0.14 0.00 1.21 0.00 0.00 56.30 57.45 3hyx h ASN 330 Cb 0.29 -0.15 -0.00 0.00 -1.12 0.00 0.00 38.32 37.33 3hyx h ASN 330 CO 0.00 0.47 -0.38 -0.78 -1.29 0.00 0.00 177.43 175.45 3hyx h ASP 331 N 0.81 0.78 -0.57 5.81 3.58 -1.03 0.89 116.42 126.69 3hyx h ASP 331 Ca 0.30 -0.51 0.04 0.00 0.42 0.00 0.00 57.03 57.28 3hyx h ASP 331 Cb 0.17 -0.22 -0.04 0.00 1.72 0.00 0.00 39.33 40.95 3hyx h ASP 331 CO -0.09 1.14 0.32 0.40 -2.88 0.00 0.00 179.24 178.13 3hyx h ILE 332 N 0.45 1.00 -0.13 2.25 2.04 -0.56 -2.76 117.51 119.80 3hyx h ILE 332 Ca 0.03 -0.21 0.00 0.00 1.00 0.00 0.00 64.86 65.67 3hyx h ILE 332 Cb 0.97 0.33 0.00 0.00 -0.74 0.00 0.00 36.82 37.38 3hyx h ILE 332 CO 0.09 0.11 0.00 0.54 0.00 0.00 0.00 178.15 178.89 3hyx n ARG 333 N -4.81 1.51 -3.25 2.37 1.74 0.20 -4.92 116.66 109.51 3hyx n ARG 333 Ca 0.05 -0.78 -0.23 0.00 -0.77 0.00 0.00 57.85 56.12 3hyx n ARG 333 Cb 0.12 -1.34 0.04 0.00 -1.02 0.00 0.00 32.46 30.26 3hyx n ARG 333 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3hyx n ASN 334 N 0.01 -5.93 -4.59 0.55 3.02 -0.50 -5.00 115.26 102.82 3hyx n ASN 334 Ca 0.15 -0.39 -0.39 0.00 -0.03 0.00 0.00 54.58 53.92 3hyx n ASN 334 Cb 0.24 -4.76 -0.10 0.00 -0.61 0.00 0.00 39.78 34.55 3hyx n ASN 334 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 3hyx s ASN 335 N -2.89 6.14 0.25 6.41 2.47 0.30 -4.98 114.94 122.64 3hyx s ASN 335 Ca 0.41 0.12 0.22 0.00 0.42 0.00 0.00 52.86 54.03 3hyx s ASN 335 Cb -0.18 -2.17 0.98 0.00 -1.45 0.00 0.00 41.25 38.43 3hyx s ASN 335 CO 0.50 -0.13 1.66 -0.81 -3.72 0.00 0.00 177.10 174.60 3hyx n PRO 336 N 5.21 0.16 -1.67 0.43 -0.04 -1.26 -4.27 135.00 133.56 3hyx n PRO 336 Ca -0.11 0.47 -0.43 0.00 -0.04 0.00 0.00 63.50 63.39 3hyx n PRO 336 Cb 0.51 -1.87 -0.03 0.00 -0.04 0.00 0.00 33.50 32.07 3hyx n PRO 336 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3hyx n ASP 337 N -2.18 4.05 -4.38 3.54 8.00 -1.26 -5.01 116.55 119.30 3hyx n ASP 337 Ca 0.01 0.94 -0.30 0.00 0.71 0.00 0.00 54.79 56.14 3hyx n ASP 337 Cb 0.17 -1.51 -0.14 0.00 -0.02 0.00 0.00 41.12 39.61 3hyx n ASP 337 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3hyx s LYS 338 N 3.89 1.87 -0.10 -1.24 3.01 -1.26 -4.80 119.74 121.11 3hyx s LYS 338 Ca 0.87 -1.08 0.04 0.00 -1.01 0.00 0.00 55.97 54.79 3hyx s LYS 338 Cb -0.48 -2.04 0.00 0.00 -1.01 0.00 0.00 37.83 34.30 3hyx s LYS 338 CO 0.42 0.52 -0.23 0.71 0.51 0.00 0.00 175.35 177.27 3hyx s TYR 339 N -0.86 2.47 0.03 3.18 2.02 -1.26 -0.27 117.35 122.65 3hyx s TYR 339 Ca 0.13 -1.00 -0.16 0.00 -0.37 0.00 0.00 57.07 55.67 3hyx s TYR 339 Cb -0.10 -1.65 -0.06 0.00 -0.40 0.00 0.00 41.96 39.74 3hyx s TYR 339 CO 0.03 -0.40 0.45 0.00 -1.57 0.00 0.00 175.55 174.07 3hyx s ALA 340 N 0.35 3.67 0.41 3.71 0.00 0.37 -4.61 121.76 125.65 3hyx s ALA 340 Ca -0.18 -0.16 -0.23 0.00 0.00 0.00 0.00 51.96 51.39 3hyx s ALA 340 Cb -0.18 -2.45 -0.09 0.00 0.00 0.00 0.00 23.12 20.40 3hyx s ALA 340 CO 0.08 0.46 1.04 -1.25 0.00 0.00 0.00 175.76 176.10 3hyx s PRO 341 N -1.17 4.14 0.44 0.00 0.04 -1.26 -0.14 135.00 137.04 3hyx s PRO 341 Ca 0.26 1.46 0.14 0.00 0.04 0.00 0.00 61.00 62.90 3hyx s PRO 341 Cb -0.17 -2.47 0.99 0.00 0.04 0.00 0.00 34.50 32.89 3hyx s PRO 341 CO 0.15 -0.16 1.98 -0.09 0.04 0.00 0.00 177.00 178.93 3hyx h ARG 342 N 2.36 0.00 -6.05 4.56 9.65 -0.85 -3.46 114.38 120.59 3hyx h ARG 342 Ca -0.48 0.00 -0.41 0.00 -1.10 0.00 0.00 59.98 57.99 3hyx h ARG 342 Cb 1.21 0.00 0.06 0.00 -1.39 0.00 0.00 29.97 29.86 3hyx h ARG 342 CO 0.62 0.20 -0.83 1.28 2.80 0.00 0.00 179.97 184.03 3hyx n LEU 343 N -4.29 -3.20 -4.98 3.80 4.32 -1.26 -4.76 117.00 106.63 3hyx n LEU 343 Ca -0.02 -0.81 -0.21 0.00 -0.02 0.00 0.00 56.01 54.95 3hyx n LEU 343 Cb 0.26 -2.69 -0.00 0.00 -1.62 0.00 0.00 43.42 39.36 3hyx n LEU 343 CO 0.36 0.40 0.12 -0.94 -1.22 0.00 0.00 177.39 176.11 3hyx s SER 344 N -4.33 5.99 -0.04 -1.43 1.04 -1.26 -1.23 113.70 112.43 3hyx s SER 344 Ca 0.02 0.01 0.00 0.00 0.48 0.00 0.00 55.95 56.46 3hyx s SER 344 Cb -0.00 -1.43 0.03 0.00 0.10 0.00 0.00 66.02 64.71 3hyx s SER 344 CO 0.81 -0.46 -0.01 0.00 0.98 0.00 0.00 173.24 174.56 3hyx s ALA 345 N -2.27 0.47 -0.28 5.32 0.00 -0.45 -3.41 121.76 121.14 3hyx s ALA 345 Ca 0.44 0.06 -0.10 0.00 0.00 0.00 0.00 51.96 52.37 3hyx s ALA 345 Cb -0.10 -0.43 -0.03 0.00 0.00 0.00 0.00 23.12 22.56 3hyx s ALA 345 CO 0.33 -0.14 0.14 0.42 0.00 0.00 0.00 175.76 176.51 3hyx s ILE 346 N 1.20 4.82 -0.09 0.00 1.01 -1.26 -0.50 121.20 126.37 3hyx s ILE 346 Ca -0.07 -0.09 -0.00 0.00 0.00 0.00 0.00 60.65 60.49 3hyx s ILE 346 Cb -0.13 -3.33 0.02 0.00 0.01 0.00 0.00 42.46 39.03 3hyx s ILE 346 CO -0.02 0.23 -0.06 0.00 0.00 0.00 0.00 174.94 175.09 3hyx s ILE 348 N 1.55 3.21 -0.39 0.00 1.01 -1.26 -0.21 121.20 125.12 3hyx s ILE 348 Ca 0.01 -0.56 -0.14 0.00 0.00 0.00 0.00 60.65 59.97 3hyx s ILE 348 Cb -0.13 -2.43 0.02 0.00 0.01 0.00 0.00 42.46 39.92 3hyx s ILE 348 CO -0.05 0.45 0.26 0.00 0.00 0.00 0.00 174.94 175.61 3hyx s ALA 349 N 1.22 3.42 0.03 9.38 0.00 -0.37 -4.96 121.76 130.49 3hyx s ALA 349 Ca 0.03 -1.67 -0.30 0.00 0.00 0.00 0.00 51.96 50.01 3hyx s ALA 349 Cb -0.14 -2.77 -0.05 0.00 0.00 0.00 0.00 23.12 20.16 3hyx s ALA 349 CO -0.03 -1.36 1.14 0.34 0.00 0.00 0.00 175.76 175.85 3hyx s ASP 350 N 1.65 7.15 -0.28 0.00 -1.08 -1.26 -0.99 116.67 121.87 3hyx s ASP 350 Ca 0.04 1.90 0.09 0.00 -0.52 0.00 0.00 52.55 54.07 3hyx s ASP 350 Cb -0.19 -2.57 0.50 0.00 -1.46 0.00 0.00 42.92 39.19 3hyx s ASP 350 CO 0.09 -0.43 1.43 0.49 0.52 0.00 0.00 175.17 177.28 3hyx n PHE 351 N 4.05 0.94 0.00 -5.34 3.72 0.12 -4.48 117.46 116.47 3hyx n PHE 351 Ca 0.08 -1.56 0.00 0.00 -0.05 0.00 0.00 57.45 55.93 3hyx n PHE 351 Cb 0.48 -0.45 0.00 0.00 -0.94 0.00 0.00 39.48 38.56 3hyx n PHE 351 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3hyx n GLY 352 N -1.10 2.01 0.02 1.37 0.00 -1.26 -4.29 105.19 101.94 3hyx n GLY 352 Ca 0.31 -0.54 -0.00 0.00 0.00 0.00 0.00 46.02 45.79 3hyx n GLY 352 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3hyx n GLU 353 N 0.00 1.61 -4.09 1.61 0.28 -1.26 -5.02 120.64 113.77 3hyx n GLU 353 Ca 0.00 -0.04 -0.25 0.00 -0.16 0.00 0.00 57.16 56.71 3hyx n GLU 353 Cb 0.00 -1.21 -0.05 0.00 1.43 0.00 0.00 31.44 31.61 3hyx n GLU 353 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 3hyx n ASP 354 N -2.08 2.97 -3.47 -1.84 5.68 -1.26 -4.61 116.55 111.94 3hyx n ASP 354 Ca -0.08 -2.75 -0.10 0.00 -0.50 0.00 0.00 54.79 51.36 3hyx n ASP 354 Cb 0.53 0.32 -0.02 0.00 -1.14 0.00 0.00 41.12 40.81 3hyx n ASP 354 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3hyx s ALA 355 N -2.70 -1.68 -0.19 2.12 0.00 -1.00 0.14 121.76 118.45 3hyx s ALA 355 Ca 0.01 0.68 -0.08 0.00 0.00 0.00 0.00 51.96 52.57 3hyx s ALA 355 Cb 0.00 0.69 -0.04 0.00 0.00 0.00 0.00 23.12 23.77 3hyx s ALA 355 CO 0.01 -0.75 0.08 0.20 0.00 0.00 0.00 175.76 175.30 3hyx s GLY 356 N -2.65 1.93 -0.34 0.00 0.00 -0.16 -1.35 107.32 104.76 3hyx s GLY 356 Ca 0.03 -0.74 -0.13 0.00 0.00 0.00 0.00 44.72 43.88 3hyx s GLY 356 CO -0.11 0.08 0.24 -0.12 0.00 0.00 0.00 173.10 173.20 3hyx s PHE 357 N 0.40 3.23 -0.04 1.90 5.36 0.20 -1.23 117.98 127.79 3hyx s PHE 357 Ca 0.04 -0.25 0.03 0.00 -0.96 0.00 0.00 56.93 55.79 3hyx s PHE 357 Cb -0.12 -2.48 -0.03 0.00 -0.34 0.00 0.00 43.02 40.05 3hyx s PHE 357 CO -0.00 -0.38 -0.11 -0.06 -1.46 0.00 0.00 175.22 173.22 3hyx s PHE 358 N 1.71 2.81 -0.07 10.12 0.08 0.70 -0.87 117.98 132.47 3hyx s PHE 358 Ca 0.06 -0.08 -0.03 0.00 0.12 0.00 0.00 56.93 57.00 3hyx s PHE 358 Cb -0.17 -1.64 0.04 0.00 -0.57 0.00 0.00 43.02 40.67 3hyx s PHE 358 CO 0.10 0.27 0.13 0.12 -0.10 0.00 0.00 175.22 175.75 3hyx s PHE 359 N -0.82 -0.12 -0.10 0.36 2.19 0.18 -0.15 117.98 119.52 3hyx s PHE 359 Ca 0.13 0.50 0.02 0.00 0.33 0.00 0.00 56.93 57.91 3hyx s PHE 359 Cb -0.11 -0.27 0.01 0.00 -1.31 0.00 0.00 43.02 41.34 3hyx s PHE 359 CO 0.02 -0.23 -0.18 0.00 1.83 0.00 0.00 175.22 176.67 3hyx s ALA 360 N 2.02 1.81 -0.30 11.12 0.00 0.34 -0.45 121.76 136.30 3hyx s ALA 360 Ca 0.01 -0.79 0.00 0.00 0.00 0.00 0.00 51.96 51.19 3hyx s ALA 360 Cb -0.12 -0.81 0.09 0.00 0.00 0.00 0.00 23.12 22.28 3hyx s ALA 360 CO -0.05 0.03 0.06 0.34 0.00 0.00 0.00 175.76 176.14 3hyx s ASP 361 N 0.78 4.10 0.86 0.00 2.15 -0.67 -1.34 116.67 122.56 3hyx s ASP 361 Ca -0.10 -1.63 -0.05 0.00 0.43 0.00 0.00 52.55 51.19 3hyx s ASP 361 Cb -0.16 -1.08 0.08 0.00 -0.30 0.00 0.00 42.92 41.47 3hyx s ASP 361 CO 0.01 -0.37 0.51 -2.65 -0.17 0.00 0.00 175.17 172.50 3hyx n PRO 362 N 4.69 -0.29 0.06 4.34 -0.02 -1.26 0.70 135.00 143.22 3hyx n PRO 362 Ca -0.03 -0.93 -0.13 0.00 -2.02 0.00 0.00 63.50 60.40 3hyx n PRO 362 Cb 0.43 -0.48 -0.09 0.00 -0.02 0.00 0.00 33.50 33.34 3hyx n PRO 362 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3hyx h VAL 363 N -1.07 1.04 -2.98 -1.45 2.07 -1.23 -3.43 116.25 109.20 3hyx h VAL 363 Ca -0.17 -0.81 -0.57 0.00 0.82 0.00 0.00 66.70 65.98 3hyx h VAL 363 Cb 0.49 1.54 -0.04 0.00 -1.52 0.00 0.00 31.29 31.76 3hyx h VAL 363 CO 0.13 0.19 0.94 -0.63 0.02 0.00 0.00 177.57 178.22 3hyx s ILE 364 N -4.56 4.19 0.84 4.57 1.01 -1.26 -4.97 121.20 121.02 3hyx s ILE 364 Ca -0.15 1.40 -0.12 0.00 0.00 0.00 0.00 60.65 61.79 3hyx s ILE 364 Cb 0.02 -4.03 0.10 0.00 0.01 0.00 0.00 42.46 38.57 3hyx s ILE 364 CO 0.61 -0.26 1.16 -2.84 0.00 0.00 0.00 174.94 173.60 3hyx s PRO 365 N 3.80 1.53 0.56 2.79 0.02 -1.26 -4.69 135.00 137.75 3hyx s PRO 365 Ca 0.56 1.55 -0.16 0.00 0.02 0.00 0.00 61.00 62.98 3hyx s PRO 365 Cb -0.20 -1.78 -0.06 0.00 0.02 0.00 0.00 34.50 32.48 3hyx s PRO 365 CO 0.19 -2.26 1.02 -1.25 -0.33 0.00 0.00 177.00 174.36 3hyx s PRO 366 N -4.48 3.67 0.08 5.54 0.04 -1.26 -5.10 135.00 133.50 3hyx s PRO 366 Ca 0.68 1.02 0.02 0.00 0.04 0.00 0.00 61.00 62.77 3hyx s PRO 366 Cb -0.24 -2.09 -0.04 0.00 0.04 0.00 0.00 34.50 32.17 3hyx s PRO 366 CO 0.54 -0.51 0.12 1.03 0.04 0.00 0.00 177.00 178.22 3hyx s ARG 367 N -4.20 3.02 -0.02 4.56 0.52 -1.26 -4.57 118.95 116.99 3hyx s ARG 367 Ca 0.60 -0.64 -0.20 0.00 -0.52 0.00 0.00 55.73 54.97 3hyx s ARG 367 Cb -0.12 -2.80 -0.33 0.00 0.52 0.00 0.00 34.95 32.22 3hyx s ARG 367 CO 0.36 0.57 0.92 1.49 0.02 0.00 0.00 175.30 178.66 3hyx h GLU 368 N 3.16 0.37 -2.80 3.54 4.57 -0.05 -3.47 114.58 119.90 3hyx h GLU 368 Ca -0.46 -0.64 0.04 0.00 -1.18 0.00 0.00 59.36 57.11 3hyx h GLU 368 Cb 1.17 0.24 -0.11 0.00 -0.16 0.00 0.00 28.75 29.88 3hyx h GLU 368 CO 0.68 1.31 0.29 -0.98 -1.18 0.00 0.00 179.01 179.13 3hyx s ARG 369 N -2.48 1.26 0.02 1.92 1.70 -1.14 -5.06 118.95 115.18 3hyx s ARG 369 Ca -0.12 -0.54 -0.01 0.00 -0.47 0.00 0.00 55.73 54.59 3hyx s ARG 369 Cb 0.02 0.53 -0.02 0.00 -0.57 0.00 0.00 34.95 34.91 3hyx s ARG 369 CO 0.87 -0.56 -0.01 0.14 -1.08 0.00 0.00 175.30 174.65 3hyx s VAL 370 N -3.61 0.12 -0.10 4.99 -7.23 -1.26 -1.67 120.40 111.64 3hyx s VAL 370 Ca 0.04 -0.97 0.02 0.00 -1.81 0.00 0.00 61.98 59.26 3hyx s VAL 370 Cb -0.02 -0.40 0.02 0.00 0.56 0.00 0.00 36.38 36.54 3hyx s VAL 370 CO -0.08 -0.53 -0.13 -0.63 -0.31 0.00 0.00 175.10 173.42 3hyx s ILE 371 N -1.69 1.33 -0.32 -0.62 1.01 0.40 -4.97 121.20 116.34 3hyx s ILE 371 Ca -0.14 -0.55 0.00 0.00 0.00 0.00 0.00 60.65 59.96 3hyx s ILE 371 Cb -0.08 -1.23 0.10 0.00 0.01 0.00 0.00 42.46 41.26 3hyx s ILE 371 CO -0.02 0.41 0.10 0.42 0.00 0.00 0.00 174.94 175.85 3hyx s THR 372 N 0.97 1.09 0.37 2.92 -4.23 -1.25 0.52 115.64 116.02 3hyx s THR 372 Ca -0.08 -1.60 0.07 0.00 -1.18 0.00 0.00 61.69 58.91 3hyx s THR 372 Cb -0.15 -1.82 -0.07 0.00 1.34 0.00 0.00 72.50 71.80 3hyx s THR 372 CO -0.01 -0.68 -0.02 -0.54 -0.54 0.00 0.00 174.62 172.83 3hyx s LYS 373 N 1.45 1.83 0.01 3.99 1.02 -0.05 -4.98 119.74 123.01 3hyx s LYS 373 Ca 0.10 -2.00 -0.02 0.00 0.02 0.00 0.00 55.97 54.08 3hyx s LYS 373 Cb -0.18 -1.49 -0.01 0.00 -0.52 0.00 0.00 37.83 35.63 3hyx s LYS 373 CO -0.21 -0.01 0.02 1.41 -0.92 0.00 0.00 175.35 175.63 3hyx s MET 374 N -3.71 0.32 0.00 1.68 1.75 -1.26 0.63 119.30 118.70 3hyx s MET 374 Ca 0.34 -0.48 0.00 0.00 -1.25 0.00 0.00 55.69 54.30 3hyx s MET 374 Cb 0.07 0.12 0.00 0.00 2.84 0.00 0.00 34.83 37.86 3hyx s MET 374 CO 0.17 -0.06 0.00 0.41 -0.65 0.00 0.00 175.02 174.89 3hyx n GLY 375 N 1.74 2.08 0.36 2.11 0.00 -0.45 -4.97 105.19 106.05 3hyx n GLY 375 Ca -0.22 -1.08 -0.08 0.00 0.00 0.00 0.00 46.02 44.63 3hyx n GLY 375 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hyx h LYS 376 N 0.00 -0.26 -1.29 1.61 1.57 -1.85 -2.46 116.57 113.89 3hyx h LYS 376 Ca 0.00 0.02 0.37 0.00 -1.87 0.00 0.00 60.65 59.17 3hyx h LYS 376 Cb 0.00 0.06 -0.05 0.00 0.08 0.00 0.00 32.23 32.32 3hyx h LYS 376 CO 0.00 -0.17 0.93 0.11 -0.57 0.00 0.00 179.45 179.74 3hyx h TRP 377 N -0.27 0.02 -0.04 -1.35 5.08 -1.94 0.40 115.95 117.86 3hyx h TRP 377 Ca 0.17 0.00 -0.20 0.00 1.08 0.00 0.00 58.89 59.94 3hyx h TRP 377 Cb 0.56 -0.01 -0.00 0.00 -3.00 0.00 0.00 29.16 26.71 3hyx h TRP 377 CO -0.57 -0.00 -0.81 0.00 -1.28 0.00 0.00 178.44 175.77 3hyx h ALA 378 N 1.36 0.53 -0.31 0.11 0.00 -1.75 -1.24 119.26 117.96 3hyx h ALA 378 Ca 0.62 -0.66 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 3hyx h ALA 378 Cb 2.46 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 20.18 3hyx h ALA 378 CO -0.02 0.81 0.00 1.25 0.00 0.00 0.00 179.25 181.29 3hyx h HIS 379 N 0.22 0.59 -0.47 0.00 -0.00 -0.25 -2.08 115.15 113.15 3hyx h HIS 379 Ca -0.05 -0.10 -0.07 0.00 -0.00 0.00 0.00 60.37 60.16 3hyx h HIS 379 Cb 1.41 -0.15 -0.02 0.00 -0.00 0.00 0.00 27.41 28.65 3hyx h HIS 379 CO 0.04 0.67 0.02 1.88 -0.00 0.00 0.00 177.93 180.55 3hyx h TYR 380 N 0.33 0.81 0.00 5.26 0.05 -1.47 -2.03 116.97 119.92 3hyx h TYR 380 Ca 0.09 -0.10 -0.04 0.00 0.05 0.00 0.00 58.73 58.72 3hyx h TYR 380 Cb 0.43 -0.23 -0.01 0.00 1.01 0.00 0.00 36.73 37.94 3hyx h TYR 380 CO 0.04 0.74 -0.21 0.35 -1.05 0.00 0.00 178.16 178.03 3hyx h PHE 381 N 0.72 0.00 -0.08 4.88 3.57 -1.10 -0.92 116.94 124.01 3hyx h PHE 381 Ca 0.15 0.00 -0.14 0.00 3.53 0.00 0.00 57.97 61.51 3hyx h PHE 381 Cb 0.41 0.00 0.01 0.00 2.79 0.00 0.00 35.95 39.16 3hyx h PHE 381 CO 0.02 0.21 -0.48 -0.22 -2.23 0.00 0.00 178.31 175.61 3hyx h LYS 382 N 0.00 0.47 -0.50 1.11 1.63 -0.69 -1.64 116.57 116.94 3hyx h LYS 382 Ca -0.00 -0.39 -0.00 0.00 -0.85 0.00 0.00 60.65 59.40 3hyx h LYS 382 Cb 0.51 0.09 -0.02 0.00 -0.60 0.00 0.00 32.23 32.21 3hyx h LYS 382 CO 0.03 1.03 0.30 1.15 -3.45 0.00 0.00 179.45 178.51 3hyx h THR 383 N 0.03 1.15 -0.01 1.00 2.02 -1.10 -2.57 112.91 113.43 3hyx h THR 383 Ca -0.04 -0.34 -0.13 0.00 0.77 0.00 0.00 66.41 66.67 3hyx h THR 383 Cb 1.13 0.48 -0.02 0.00 -1.74 0.00 0.00 68.15 68.01 3hyx h THR 383 CO 0.10 0.16 -0.62 0.00 0.37 0.00 0.00 175.52 175.52 3hyx h ALA 384 N 1.14 0.96 -0.08 6.16 0.00 -1.21 -2.79 119.26 123.44 3hyx h ALA 384 Ca 0.18 -0.56 -0.19 0.00 0.00 0.00 0.00 54.91 54.34 3hyx h ALA 384 Cb -0.01 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 3hyx h ALA 384 CO -0.03 0.77 -0.75 0.35 0.00 0.00 0.00 179.25 179.59 3hyx h PHE 385 N 0.02 0.61 0.42 0.00 3.57 -1.20 -1.93 116.94 118.43 3hyx h PHE 385 Ca -0.01 -0.27 -0.01 0.00 3.53 0.00 0.00 57.97 61.21 3hyx h PHE 385 Cb 1.10 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 39.72 3hyx h PHE 385 CO 0.00 1.04 -0.43 1.49 -2.23 0.00 0.00 178.31 178.19 3hyx h GLU 386 N 0.30 -0.83 -0.72 1.11 4.81 -1.30 0.51 114.58 118.46 3hyx h GLU 386 Ca -0.04 0.06 0.12 0.00 -0.13 0.00 0.00 59.36 59.37 3hyx h GLU 386 Cb 1.33 0.19 -0.08 0.00 0.63 0.00 0.00 28.75 30.82 3hyx h GLU 386 CO 0.13 -0.56 0.31 0.87 -0.73 0.00 0.00 179.01 179.04 3hyx h LYS 387 N -0.87 0.49 0.15 1.92 1.79 -1.50 -0.25 116.57 118.30 3hyx h LYS 387 Ca -0.04 -0.03 -0.00 0.00 -2.18 0.00 0.00 60.65 58.40 3hyx h LYS 387 Cb 0.77 -0.11 -0.01 0.00 -1.58 0.00 0.00 32.23 31.30 3hyx h LYS 387 CO -0.07 0.32 -0.12 -0.92 -1.08 0.00 0.00 179.45 177.59 3hyx h TYR 388 N 0.50 -0.30 -0.57 -1.35 3.20 -0.93 -1.97 116.97 115.55 3hyx h TYR 388 Ca 0.37 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.24 3hyx h TYR 388 Cb 0.49 0.11 -0.03 0.00 1.54 0.00 0.00 36.73 38.85 3hyx h TYR 388 CO -0.14 -0.18 0.34 0.35 -1.64 0.00 0.00 178.16 176.88 3hyx h PHE 389 N -0.28 0.76 -0.58 -3.82 3.04 0.90 -1.41 116.94 115.55 3hyx h PHE 389 Ca -0.01 -0.01 0.04 0.00 3.98 0.00 0.00 57.97 61.98 3hyx h PHE 389 Cb 0.25 -0.25 -0.05 0.00 2.56 0.00 0.00 35.95 38.46 3hyx h PHE 389 CO -0.11 0.53 0.32 -0.07 -2.02 0.00 0.00 178.31 176.97 3hyx h LEU 390 N 0.77 0.49 -0.71 0.59 -0.00 -1.01 -0.89 115.31 114.55 3hyx h LEU 390 Ca 0.20 0.02 0.11 0.00 -0.00 0.00 0.00 57.88 58.21 3hyx h LEU 390 Cb -0.00 -0.08 -0.08 0.00 -0.00 0.00 0.00 40.66 40.50 3hyx h LEU 390 CO -0.04 0.33 0.33 -0.25 -0.00 0.00 0.00 178.44 178.81 3hyx h TRP 391 N 0.62 0.58 -0.21 1.13 7.01 -0.85 -1.14 115.95 123.10 3hyx h TRP 391 Ca 0.25 0.03 0.04 0.00 2.11 0.00 0.00 58.89 61.32 3hyx h TRP 391 Cb 0.12 -0.15 -0.04 0.00 -2.10 0.00 0.00 29.16 26.99 3hyx h TRP 391 CO -0.08 0.17 -0.03 0.87 -2.79 0.00 0.00 178.44 176.57 3hyx h LYS 392 N 0.54 0.02 -0.93 2.65 1.57 -0.12 -1.14 116.57 119.15 3hyx h LYS 392 Ca 0.36 -0.00 0.01 0.00 -1.87 0.00 0.00 60.65 59.15 3hyx h LYS 392 Cb 0.44 -0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.70 3hyx h LYS 392 CO -0.31 0.01 0.61 0.28 -0.57 0.00 0.00 179.45 179.48 3hyx h VAL 393 N 0.02 1.24 0.00 0.50 2.07 -0.90 -2.48 116.25 116.71 3hyx h VAL 393 Ca 0.10 -0.44 -0.04 0.00 0.82 0.00 0.00 66.70 67.13 3hyx h VAL 393 Cb 0.14 -0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 29.78 3hyx h VAL 393 CO -0.20 0.23 -0.21 0.03 0.02 0.00 0.00 177.57 177.44 3hyx h ARG 394 N 1.26 0.00 -0.39 1.57 3.08 -0.76 -3.25 114.38 115.89 3hyx h ARG 394 Ca 0.34 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.39 3hyx h ARG 394 Cb -0.14 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.91 3hyx h ARG 394 CO -0.07 0.21 0.00 0.09 -1.07 0.00 0.00 179.97 179.13 3hyx n ASN 395 N -3.31 3.24 -1.90 7.04 4.13 -0.47 -5.00 115.26 118.98 3hyx n ASN 395 Ca 0.01 -2.15 -0.15 0.00 1.68 0.00 0.00 54.58 53.97 3hyx n ASN 395 Cb 0.46 -0.31 0.01 0.00 -1.54 0.00 0.00 39.78 38.39 3hyx n ASN 395 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3hyx n GLY 396 N 0.52 -0.18 2.87 7.41 0.00 -0.96 -4.99 105.19 109.87 3hyx n GLY 396 Ca 0.15 -0.22 -0.11 0.00 0.00 0.00 0.00 46.02 45.84 3hyx n GLY 396 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3hyx s ASN 397 N -2.59 0.58 0.08 1.61 3.84 -1.09 -4.95 114.94 112.42 3hyx s ASN 397 Ca 0.11 -0.01 0.26 0.00 0.21 0.00 0.00 52.86 53.43 3hyx s ASN 397 Cb -0.05 0.94 0.64 0.00 -0.55 0.00 0.00 41.25 42.23 3hyx s ASN 397 CO 0.14 -0.32 1.54 -0.38 -2.79 0.00 0.00 177.10 175.29 3hyx n ILE 398 N 5.35 0.23 -2.99 -5.21 2.08 -1.26 -4.47 119.36 113.08 3hyx n ILE 398 Ca -0.03 -0.15 -0.19 0.00 0.56 0.00 0.00 62.75 62.94 3hyx n ILE 398 Cb 0.50 -0.17 -0.02 0.00 -0.75 0.00 0.00 39.64 39.20 3hyx n ILE 398 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 3hyx n ALA 399 N -1.67 3.06 -1.73 -1.39 0.00 -1.26 -5.08 120.51 112.44 3hyx n ALA 399 Ca 0.05 -3.71 -0.37 0.00 0.00 0.00 0.00 53.44 49.41 3hyx n ALA 399 Cb 0.39 -0.86 0.06 0.00 0.00 0.00 0.00 19.45 19.04 3hyx n ALA 399 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3hyx s PRO 400 N -2.86 2.65 0.24 0.00 0.04 -1.26 -4.88 135.00 128.92 3hyx s PRO 400 Ca 0.40 2.07 -0.06 0.00 0.04 0.00 0.00 61.00 63.45 3hyx s PRO 400 Cb 0.36 -1.90 0.29 0.00 0.04 0.00 0.00 34.50 33.28 3hyx s PRO 400 CO -0.08 -1.52 1.88 0.66 0.04 0.00 0.00 177.00 177.98 3hyx h SER 401 N 0.68 0.96 -0.08 6.66 4.64 -2.00 -2.63 113.55 121.78 3hyx h SER 401 Ca -0.51 -0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.79 3hyx h SER 401 Cb 1.33 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 63.20 3hyx h SER 401 CO 0.54 0.65 0.01 2.19 -0.87 0.00 0.00 176.83 179.35 3hyx h PHE 402 N 1.11 0.21 -0.60 4.77 -0.00 -2.00 -2.69 116.94 117.74 3hyx h PHE 402 Ca 0.36 -0.01 -0.00 0.00 -0.00 0.00 0.00 57.97 58.32 3hyx h PHE 402 Cb 0.02 -0.07 -0.03 0.00 -0.00 0.00 0.00 35.95 35.88 3hyx h PHE 402 CO -0.02 0.21 0.37 1.49 -0.00 0.00 0.00 178.31 180.36 3hyx h GLU 403 N 0.21 0.81 -0.32 6.09 4.81 -1.83 0.79 114.58 125.15 3hyx h GLU 403 Ca 0.05 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 59.20 3hyx h GLU 403 Cb 0.13 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.32 3hyx h GLU 403 CO 0.00 0.57 0.14 1.49 -0.73 0.00 0.00 179.01 180.48 3hyx h GLU 404 N 0.81 0.46 -0.89 1.92 4.81 -1.58 -1.94 114.58 118.17 3hyx h GLU 404 Ca 0.22 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.38 3hyx h GLU 404 Cb -0.04 -0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.22 3hyx h GLU 404 CO -0.04 0.45 0.57 0.87 -0.73 0.00 0.00 179.01 180.13 3hyx h LYS 405 N 0.37 1.18 0.23 1.92 1.57 -1.35 -0.46 116.57 120.03 3hyx h LYS 405 Ca 0.11 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 3hyx h LYS 405 Cb 0.14 -0.26 0.00 0.00 0.08 0.00 0.00 32.23 32.20 3hyx h LYS 405 CO -0.01 0.80 -0.11 0.28 -0.57 0.00 0.00 179.45 179.84 3hyx h VAL 406 N 1.21 0.78 -0.02 0.50 2.07 -0.64 -1.28 116.25 118.87 3hyx h VAL 406 Ca 0.32 -0.04 -0.01 0.00 0.82 0.00 0.00 66.70 67.80 3hyx h VAL 406 Cb -0.11 0.80 -0.00 0.00 -1.52 0.00 0.00 31.29 30.46 3hyx h VAL 406 CO -0.07 0.01 -0.04 -0.07 0.02 0.00 0.00 177.57 177.42 3hyx h LEU 407 N -0.33 0.02 -0.35 2.57 3.38 -1.07 -1.51 115.31 118.02 3hyx h LEU 407 Ca -0.03 -0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.79 3hyx h LEU 407 Cb 0.25 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 3hyx h LEU 407 CO 0.05 0.07 -0.34 -0.08 0.09 0.00 0.00 178.44 178.23 3hyx h GLU 408 N 0.03 0.84 -0.11 1.13 4.81 -0.83 -1.62 114.58 118.83 3hyx h GLU 408 Ca 0.01 -0.45 -0.18 0.00 -0.13 0.00 0.00 59.36 58.61 3hyx h GLU 408 Cb 0.09 0.02 0.01 0.00 0.63 0.00 0.00 28.75 29.49 3hyx h GLU 408 CO 0.01 1.08 -0.63 0.82 -0.73 0.00 0.00 179.01 179.56 3hyx h ILE 409 N 0.63 1.33 0.12 2.32 2.04 -0.58 -1.10 117.51 122.28 3hyx h ILE 409 Ca 0.06 -1.90 -0.31 0.00 1.00 0.00 0.00 64.86 63.71 3hyx h ILE 409 Cb 0.93 2.14 -0.01 0.00 -0.74 0.00 0.00 36.82 39.14 3hyx h ILE 409 CO 0.09 0.58 -1.52 -0.26 0.00 0.00 0.00 178.15 177.04 3hyx h PHE 410 N 0.28 0.47 0.00 1.37 0.04 -1.39 -3.40 116.94 114.30 3hyx h PHE 410 Ca -0.05 -0.34 0.00 0.00 2.80 0.00 0.00 57.97 60.38 3hyx h PHE 410 Cb 1.27 -0.02 0.00 0.00 2.20 0.00 0.00 35.95 39.40 3hyx h PHE 410 CO 0.10 1.39 0.00 1.28 -0.60 0.00 0.00 178.31 180.48 3hyx n LEU 411 N -3.46 0.86 -3.45 1.54 4.77 -0.62 -5.01 117.00 111.63 3hyx n LEU 411 Ca -0.16 -0.92 -0.25 0.00 -0.03 0.00 0.00 56.01 54.64 3hyx n LEU 411 Cb 1.04 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 42.16 3hyx n LEU 411 CO 0.51 0.21 0.04 0.29 -1.33 0.00 0.00 177.39 177.11 3hyx n LYS 412 N -0.12 -4.84 -4.03 3.23 5.02 -0.42 -4.97 118.16 112.03 3hyx n LYS 412 Ca 0.00 0.67 -0.32 0.00 -2.02 0.00 0.00 58.31 56.64 3hyx n LYS 412 Cb 0.00 -5.51 -0.06 0.00 -0.02 0.00 0.00 35.03 29.45 3hyx n LYS 412 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3hyx s VAL 413 N -3.14 4.86 -0.09 -0.18 0.11 -1.19 -4.97 120.40 115.80 3hyx s VAL 413 Ca 0.47 -0.47 0.02 0.00 -2.93 0.00 0.00 61.98 59.06 3hyx s VAL 413 Cb -0.23 -3.28 0.01 0.00 -1.53 0.00 0.00 36.38 31.35 3hyx s VAL 413 CO 0.58 0.25 -0.14 -1.00 -3.33 0.00 0.00 175.10 171.46 3hyx s HIS 414 N -1.31 1.73 0.23 1.54 3.76 -1.26 -3.90 115.29 116.09 3hyx s HIS 414 Ca 0.27 -0.73 0.01 0.00 -0.15 0.00 0.00 55.06 54.46 3hyx s HIS 414 Cb -0.12 -1.26 0.25 0.00 1.11 0.00 0.00 32.58 32.55 3hyx s HIS 414 CO 0.19 -0.38 1.58 -1.35 -0.85 0.00 0.00 174.74 173.93 3hyx h PRO 415 N 7.20 0.41 -4.55 8.40 0.11 -1.96 -3.42 132.00 138.18 3hyx h PRO 415 Ca -0.30 -0.24 -0.32 0.00 0.11 0.00 0.00 66.00 65.26 3hyx h PRO 415 Cb 1.18 0.02 -0.25 0.00 0.11 0.00 0.00 31.00 32.06 3hyx h PRO 415 CO 0.47 0.81 -0.75 0.96 -0.21 0.00 0.00 178.00 179.29 3hyx s ILE 416 N -4.03 0.56 0.16 4.15 -4.36 -1.26 -0.23 121.20 116.19 3hyx s ILE 416 Ca -0.06 -0.67 0.09 0.00 -0.26 0.00 0.00 60.65 59.74 3hyx s ILE 416 Cb 0.12 -0.54 -0.04 0.00 1.25 0.00 0.00 42.46 43.25 3hyx s ILE 416 CO 0.81 -0.10 -0.10 -1.61 0.24 0.00 0.00 174.94 174.18 3hyx s GLU 417 N -0.84 2.05 -0.09 0.37 2.02 0.80 -4.91 118.70 118.10 3hyx s GLU 417 Ca -0.03 -1.22 -0.30 0.00 0.02 0.00 0.00 54.97 53.44 3hyx s GLU 417 Cb -0.06 -2.18 -0.03 0.00 0.10 0.00 0.00 34.13 31.96 3hyx s GLU 417 CO 0.00 0.45 1.25 -1.17 0.02 0.00 0.00 175.26 175.81 3hyx s LEU 418 N -2.68 4.25 -0.32 1.80 2.96 -1.26 -0.48 118.68 122.94 3hyx s LEU 418 Ca 0.24 1.80 -0.17 0.00 -0.22 0.00 0.00 54.13 55.78 3hyx s LEU 418 Cb -0.09 -3.55 -0.02 0.00 0.50 0.00 0.00 46.19 43.03 3hyx s LEU 418 CO 0.15 -0.67 0.45 0.00 -1.32 0.00 0.00 176.35 174.96 3hyx h LYS 420 N 8.34 1.22 -1.77 0.00 1.57 -1.90 -3.41 116.57 120.61 3hyx h LYS 420 Ca -0.29 -0.10 -0.04 0.00 -1.87 0.00 0.00 60.65 58.35 3hyx h LYS 420 Cb 1.14 -0.26 -0.26 0.00 0.08 0.00 0.00 32.23 32.93 3hyx h LYS 420 CO 0.72 0.84 -0.35 0.34 -0.57 0.00 0.00 179.45 180.43 3hyx s ASP 421 N -6.10 -0.50 0.48 0.86 2.15 -1.26 -5.06 116.67 107.24 3hyx s ASP 421 Ca -0.13 0.74 0.18 0.00 0.43 0.00 0.00 52.55 53.77 3hyx s ASP 421 Cb 0.17 1.62 1.20 0.00 -0.30 0.00 0.00 42.92 45.60 3hyx s ASP 421 CO 0.81 -0.26 2.05 0.00 -0.17 0.00 0.00 175.17 177.60 3hyx s GLU 423 N -4.63 2.51 0.00 0.00 2.12 -1.26 -1.82 118.70 115.61 3hyx s GLU 423 Ca -0.04 0.57 0.00 0.00 0.36 0.00 0.00 54.97 55.86 3hyx s GLU 423 Cb 0.15 -4.53 0.00 0.00 0.26 0.00 0.00 34.13 30.01 3hyx s GLU 423 CO 0.66 -2.97 0.00 0.41 -0.54 0.00 0.00 175.26 172.82 3hyx n GLY 424 N 5.96 2.27 3.70 -1.50 0.00 -1.26 -4.98 105.19 109.38 3hyx n GLY 424 Ca 0.26 -0.92 -0.43 0.00 0.00 0.00 0.00 46.02 44.94 3hyx n GLY 424 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hyx n ALA 425 N -0.80 1.35 -1.75 4.61 0.00 -1.26 -2.21 120.51 120.45 3hyx n ALA 425 Ca 0.00 0.36 -0.42 0.00 0.00 0.00 0.00 53.44 53.39 3hyx n ALA 425 Cb 0.00 -2.26 -0.01 0.00 0.00 0.00 0.00 19.45 17.18 3hyx n ALA 425 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 3hyx n PRO 426 N 0.62 2.61 0.00 0.00 -0.04 -1.25 -1.82 135.00 135.13 3hyx n PRO 426 Ca 0.05 0.92 0.00 0.00 -0.04 0.00 0.00 63.50 64.43 3hyx n PRO 426 Cb 0.36 -2.66 0.00 0.00 -0.04 0.00 0.00 33.50 31.16 3hyx n PRO 426 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3hyx n GLY 427 N 1.30 3.17 3.79 0.55 0.00 -1.26 -4.70 105.19 108.03 3hyx n GLY 427 Ca 0.05 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.72 3hyx n GLY 427 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3hyx s SER 428 N -0.29 6.25 -0.10 1.61 1.04 -0.75 -4.97 113.70 116.49 3hyx s SER 428 Ca 0.00 2.04 -0.30 0.00 0.48 0.00 0.00 55.95 58.17 3hyx s SER 428 Cb 0.00 -2.57 -0.03 0.00 0.10 0.00 0.00 66.02 63.52 3hyx s SER 428 CO 0.00 -0.85 1.22 -0.13 0.98 0.00 0.00 173.24 174.46 3hyx s ARG 429 N -3.09 4.31 0.00 4.02 1.81 -1.26 -4.97 118.95 119.77 3hyx s ARG 429 Ca 0.67 1.67 0.28 0.00 -1.72 0.00 0.00 55.73 56.62 3hyx s ARG 429 Cb -0.20 -3.63 1.03 0.00 -0.45 0.00 0.00 34.95 31.70 3hyx s ARG 429 CO 0.24 -0.54 1.73 0.00 -0.68 0.00 0.00 175.30 176.05