#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qh5 s LYS 2 N 0.00 1.35 -0.14 2.12 1.02 -0.88 -4.95 119.74 118.25 1qh5 s LYS 2 Ca 0.00 -0.77 0.00 0.00 0.02 0.00 0.00 55.97 55.23 1qh5 s LYS 2 Cb 0.00 -1.37 0.02 0.00 -0.52 0.00 0.00 37.83 35.96 1qh5 s LYS 2 CO 0.00 0.36 -0.14 0.08 -0.92 0.00 0.00 175.35 174.73 1qh5 s VAL 3 N -0.62 1.56 -0.20 3.17 1.01 -1.26 -0.43 120.40 123.63 1qh5 s VAL 3 Ca 0.06 -0.63 -0.08 0.00 0.00 0.00 0.00 61.98 61.33 1qh5 s VAL 3 Cb -0.08 -1.46 -0.04 0.00 0.00 0.00 0.00 36.38 34.80 1qh5 s VAL 3 CO 0.00 0.46 0.08 -1.61 0.00 0.00 0.00 175.10 174.03 1qh5 s GLU 4 N 1.45 3.93 -0.18 2.72 0.41 0.04 -4.96 118.70 122.09 1qh5 s GLU 4 Ca 0.04 -0.36 -0.23 0.00 -0.41 0.00 0.00 54.97 54.01 1qh5 s GLU 4 Cb -0.13 -3.28 -0.02 0.00 -1.78 0.00 0.00 34.13 28.92 1qh5 s GLU 4 CO -0.10 0.15 0.75 0.08 -0.49 0.00 0.00 175.26 175.65 1qh5 s VAL 5 N 0.72 4.93 -0.37 2.63 1.01 -1.26 -1.55 120.40 126.50 1qh5 s VAL 5 Ca 0.04 1.45 0.02 0.00 0.00 0.00 0.00 61.98 63.49 1qh5 s VAL 5 Cb -0.13 -4.06 0.11 0.00 0.00 0.00 0.00 36.38 32.29 1qh5 s VAL 5 CO 0.02 0.06 0.11 -0.76 0.00 0.00 0.00 175.10 174.53 1qh5 s LEU 6 N 2.07 4.91 0.43 3.92 1.43 -0.00 -5.01 118.68 126.42 1qh5 s LEU 6 Ca 0.34 -2.17 -0.25 0.00 -1.03 0.00 0.00 54.13 51.02 1qh5 s LEU 6 Cb -0.16 -1.70 -0.10 0.00 0.03 0.00 0.00 46.19 44.27 1qh5 s LEU 6 CO 0.11 -0.42 1.21 -2.65 0.23 0.00 0.00 176.35 174.83 1qh5 n PRO 7 N 4.29 1.76 -3.94 1.29 -0.02 -1.26 -1.34 135.00 135.77 1qh5 n PRO 7 Ca 0.02 0.63 -0.09 0.00 -2.02 0.00 0.00 63.50 62.04 1qh5 n PRO 7 Cb 0.41 -2.30 -0.09 0.00 -0.02 0.00 0.00 33.50 31.50 1qh5 n PRO 7 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1qh5 s ALA 8 N -1.22 -0.02 0.00 3.55 0.00 -0.46 -4.86 121.76 118.75 1qh5 s ALA 8 Ca 0.62 -0.60 0.00 0.00 0.00 0.00 0.00 51.96 51.98 1qh5 s ALA 8 Cb -0.52 0.25 0.00 0.00 0.00 0.00 0.00 23.12 22.85 1qh5 s ALA 8 CO 0.57 -0.31 0.00 1.28 0.00 0.00 0.00 175.76 177.30 1qh5 n LEU 9 N 0.77 0.00 0.00 0.00 4.77 -1.26 -1.70 117.00 119.59 1qh5 n LEU 9 Ca -0.19 0.00 -0.21 0.00 -0.03 0.00 0.00 56.01 55.58 1qh5 n LEU 9 Cb 0.58 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.54 1qh5 n LEU 9 CO 0.23 0.00 -0.39 0.74 -1.33 0.00 0.00 177.39 176.64 1qh5 h THR 10 N 0.00 1.06 0.00 -5.08 2.02 -2.03 -3.44 112.91 105.45 1qh5 h THR 10 Ca 0.00 -2.39 -0.10 0.00 0.77 0.00 0.00 66.41 64.69 1qh5 h THR 10 Cb 0.00 2.73 -0.15 0.00 -1.74 0.00 0.00 68.15 68.99 1qh5 h THR 10 CO 0.00 0.68 -0.43 -0.90 0.37 0.00 0.00 175.52 175.24 1qh5 n ASP 11 N -3.97 -0.16 -4.93 4.18 5.68 -1.22 -5.04 116.55 111.08 1qh5 n ASP 11 Ca -0.24 -1.78 -0.25 0.00 -0.50 0.00 0.00 54.79 52.02 1qh5 n ASP 11 Cb 0.88 0.02 -0.01 0.00 -1.14 0.00 0.00 41.12 40.87 1qh5 n ASP 11 CO 0.00 0.00 0.00 0.20 -1.33 0.00 0.00 177.20 176.07 1qh5 s ASN 12 N -1.02 6.31 -0.07 -1.12 -0.87 -0.69 -0.87 114.94 116.61 1qh5 s ASN 12 Ca 0.08 0.54 0.02 0.00 -1.57 0.00 0.00 52.86 51.93 1qh5 s ASN 12 Cb 0.09 -2.07 0.01 0.00 -0.02 0.00 0.00 41.25 39.26 1qh5 s ASN 12 CO -0.04 -0.32 -0.13 -0.31 -2.57 0.00 0.00 177.10 173.73 1qh5 s TYR 13 N -2.34 1.58 0.19 2.20 2.02 -0.38 -1.35 117.35 119.26 1qh5 s TYR 13 Ca 0.41 -0.62 0.06 0.00 -0.37 0.00 0.00 57.07 56.55 1qh5 s TYR 13 Cb -0.10 -1.15 -0.04 0.00 -0.40 0.00 0.00 41.96 40.27 1qh5 s TYR 13 CO 0.36 -0.32 0.16 -1.64 -1.57 0.00 0.00 175.55 172.55 1qh5 s MET 14 N 0.73 2.94 -0.07 -0.62 -1.94 -0.45 -4.78 119.30 115.11 1qh5 s MET 14 Ca -0.13 -0.91 -0.00 0.00 -1.71 0.00 0.00 55.69 52.93 1qh5 s MET 14 Cb -0.16 -2.64 0.03 0.00 2.01 0.00 0.00 34.83 34.07 1qh5 s MET 14 CO 0.03 0.46 -0.02 0.71 -0.01 0.00 0.00 175.02 176.19 1qh5 s TYR 15 N -1.86 0.81 -0.38 -0.03 2.02 -1.02 -0.82 117.35 116.07 1qh5 s TYR 15 Ca 0.32 -0.26 -0.18 0.00 -0.37 0.00 0.00 57.07 56.57 1qh5 s TYR 15 Cb -0.09 -0.82 0.00 0.00 -0.40 0.00 0.00 41.96 40.65 1qh5 s TYR 15 CO 0.24 -0.31 0.52 -1.17 -1.57 0.00 0.00 175.55 173.26 1qh5 s LEU 16 N 1.62 4.45 -0.36 -1.29 2.96 -0.60 -0.71 118.68 124.75 1qh5 s LEU 16 Ca 0.00 -0.19 -0.11 0.00 -0.22 0.00 0.00 54.13 53.62 1qh5 s LEU 16 Cb -0.13 -2.57 0.02 0.00 0.50 0.00 0.00 46.19 44.01 1qh5 s LEU 16 CO -0.04 -0.54 0.19 -0.69 -1.32 0.00 0.00 176.35 173.95 1qh5 s VAL 17 N 2.42 4.55 -0.14 1.68 1.01 0.08 -0.78 120.40 129.21 1qh5 s VAL 17 Ca 0.18 -0.79 -0.05 0.00 0.00 0.00 0.00 61.98 61.32 1qh5 s VAL 17 Cb -0.15 -3.50 -0.04 0.00 0.00 0.00 0.00 36.38 32.69 1qh5 s VAL 17 CO 0.14 -0.18 0.04 -0.63 0.00 0.00 0.00 175.10 174.48 1qh5 s ILE 18 N 1.56 4.64 -0.31 2.22 1.01 0.43 -1.07 121.20 129.68 1qh5 s ILE 18 Ca 0.02 -0.10 -0.21 0.00 0.00 0.00 0.00 60.65 60.36 1qh5 s ILE 18 Cb -0.19 -3.03 -0.00 0.00 0.01 0.00 0.00 42.46 39.25 1qh5 s ILE 18 CO 0.06 0.54 0.67 -0.62 0.00 0.00 0.00 174.94 175.60 1qh5 s ASP 19 N -0.29 6.53 0.39 3.58 2.15 -0.10 -2.07 116.67 126.86 1qh5 s ASP 19 Ca 0.08 0.45 0.09 0.00 0.43 0.00 0.00 52.55 53.60 1qh5 s ASP 19 Cb -0.12 -2.35 0.79 0.00 -0.30 0.00 0.00 42.92 40.94 1qh5 s ASP 19 CO 0.02 -0.54 1.93 0.44 -0.17 0.00 0.00 175.17 176.85 1qh5 h ASP 20 N 8.21 0.25 -0.12 -0.34 3.32 -1.92 0.13 116.42 125.94 1qh5 h ASP 20 Ca -0.26 -0.05 -0.18 0.00 0.02 0.00 0.00 57.03 56.57 1qh5 h ASP 20 Cb 1.11 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 40.59 1qh5 h ASP 20 CO 0.83 0.38 -0.56 -0.33 -1.72 0.00 0.00 179.24 177.84 1qh5 h GLU 21 N 0.26 0.72 0.00 3.56 5.08 -1.96 -3.36 114.58 118.87 1qh5 h GLU 21 Ca 0.06 -0.46 0.00 0.00 -1.00 0.00 0.00 59.36 57.96 1qh5 h GLU 21 Cb 0.33 0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.63 1qh5 h GLU 21 CO 0.02 1.08 -0.95 0.25 -1.00 0.00 0.00 179.01 178.41 1qh5 n THR 22 N -3.98 0.00 -1.73 1.13 -2.24 -1.21 -5.00 114.28 101.25 1qh5 n THR 22 Ca -0.04 -0.20 -0.12 0.00 -2.27 0.00 0.00 64.05 61.41 1qh5 n THR 22 Cb 0.62 0.57 -0.03 0.00 -2.10 0.00 0.00 70.33 69.39 1qh5 n THR 22 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1qh5 n LYS 23 N -1.52 -0.91 -3.22 -0.78 5.02 0.43 -4.95 118.16 112.23 1qh5 n LYS 23 Ca -0.00 0.79 -0.33 0.00 -2.02 0.00 0.00 58.31 56.75 1qh5 n LYS 23 Cb 0.13 -4.89 -0.06 0.00 -0.02 0.00 0.00 35.03 30.19 1qh5 n LYS 23 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1qh5 s GLU 24 N -3.71 3.96 0.04 1.97 2.02 -1.25 -1.54 118.70 120.19 1qh5 s GLU 24 Ca 0.00 0.56 -0.01 0.00 0.02 0.00 0.00 54.97 55.54 1qh5 s GLU 24 Cb 0.00 -2.53 -0.03 0.00 0.10 0.00 0.00 34.13 31.67 1qh5 s GLU 24 CO 0.00 0.22 -0.03 0.00 0.02 0.00 0.00 175.26 175.48 1qh5 s ALA 25 N -1.90 0.39 0.23 5.21 0.00 -0.49 -0.92 121.76 124.28 1qh5 s ALA 25 Ca 0.51 -1.03 0.12 0.00 0.00 0.00 0.00 51.96 51.56 1qh5 s ALA 25 Cb -0.11 0.24 -0.05 0.00 0.00 0.00 0.00 23.12 23.20 1qh5 s ALA 25 CO 0.19 -0.31 -0.22 0.00 0.00 0.00 0.00 175.76 175.41 1qh5 s ALA 26 N -3.24 2.61 -0.08 0.00 0.00 -0.23 -1.34 121.76 119.48 1qh5 s ALA 26 Ca 0.01 -1.74 0.03 0.00 0.00 0.00 0.00 51.96 50.26 1qh5 s ALA 26 Cb 0.03 -0.30 0.01 0.00 0.00 0.00 0.00 23.12 22.86 1qh5 s ALA 26 CO -0.08 0.36 -0.16 -1.50 0.00 0.00 0.00 175.76 174.39 1qh5 s ILE 27 N -2.03 1.41 -0.23 0.00 1.10 -0.23 -0.74 121.20 120.48 1qh5 s ILE 27 Ca 0.24 -0.64 -0.12 0.00 -0.51 0.00 0.00 60.65 59.62 1qh5 s ILE 27 Cb -0.07 -1.26 -0.05 0.00 0.15 0.00 0.00 42.46 41.23 1qh5 s ILE 27 CO 0.12 0.42 0.23 -0.69 -2.11 0.00 0.00 174.94 172.91 1qh5 s VAL 28 N 0.59 5.31 -0.99 4.00 1.01 0.11 -0.67 120.40 129.76 1qh5 s VAL 28 Ca -0.16 0.33 -0.11 0.00 0.00 0.00 0.00 61.98 62.05 1qh5 s VAL 28 Cb -0.16 -3.57 -0.02 0.00 0.00 0.00 0.00 36.38 32.63 1qh5 s VAL 28 CO 0.05 0.32 0.77 0.47 0.00 0.00 0.00 175.10 176.71 1qh5 n ASP 29 N 4.35 -6.07 -3.32 3.32 8.00 -0.84 -2.42 116.55 119.56 1qh5 n ASP 29 Ca -0.13 -0.74 -0.39 0.00 0.71 0.00 0.00 54.79 54.24 1qh5 n ASP 29 Cb 0.52 -3.91 -0.03 0.00 -0.02 0.00 0.00 41.12 37.68 1qh5 n ASP 29 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 1qh5 n PRO 30 N -3.26 3.70 0.26 -0.24 -0.04 -1.24 -4.60 135.00 129.58 1qh5 n PRO 30 Ca -0.10 -2.22 0.12 0.00 -0.04 0.00 0.00 63.50 61.27 1qh5 n PRO 30 Cb 0.59 -2.81 0.68 0.00 -0.04 0.00 0.00 33.50 31.92 1qh5 n PRO 30 CO 0.00 0.00 0.00 -0.24 -0.04 0.00 0.00 175.50 175.22 1qh5 h VAL 31 N 3.02 0.55 -3.24 0.52 3.04 -1.83 -3.27 116.25 115.04 1qh5 h VAL 31 Ca 0.87 -0.65 -0.63 0.00 -1.01 0.00 0.00 66.70 65.28 1qh5 h VAL 31 Cb 0.29 1.43 -0.41 0.00 -2.01 0.00 0.00 31.29 30.59 1qh5 h VAL 31 CO 1.79 0.14 -0.63 -1.10 -1.01 0.00 0.00 177.57 176.76 1qh5 s GLN 32 N -4.07 2.04 0.46 4.17 -0.21 -1.26 -4.17 119.66 116.61 1qh5 s GLN 32 Ca -0.02 -2.77 0.12 0.00 0.02 0.00 0.00 55.36 52.71 1qh5 s GLN 32 Cb 0.12 -3.22 1.07 0.00 1.00 0.00 0.00 33.01 31.98 1qh5 s GLN 32 CO 0.59 -1.17 2.07 -1.35 -2.12 0.00 0.00 175.29 173.31 1qh5 h PRO 33 N 6.17 0.29 -0.14 2.91 0.11 -1.86 -2.59 132.00 136.90 1qh5 h PRO 33 Ca 0.00 -0.02 -0.10 0.00 0.11 0.00 0.00 66.00 65.99 1qh5 h PRO 33 Cb 0.85 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.89 1qh5 h PRO 33 CO 0.67 0.19 -0.36 1.96 -0.21 0.00 0.00 178.00 180.26 1qh5 h GLN 34 N 0.30 0.28 -0.28 1.05 1.08 -1.94 -1.19 115.11 114.41 1qh5 h GLN 34 Ca 0.12 -0.12 -0.08 0.00 -1.45 0.00 0.00 58.65 57.13 1qh5 h GLN 34 Cb 0.13 -0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.53 1qh5 h GLN 34 CO -0.03 0.60 -0.16 0.87 -0.95 0.00 0.00 178.83 179.17 1qh5 h LYS 35 N 0.24 0.50 0.02 1.46 1.57 -1.90 0.32 116.57 118.78 1qh5 h LYS 35 Ca 0.03 -0.16 -0.00 0.00 -1.87 0.00 0.00 60.65 58.65 1qh5 h LYS 35 Cb 0.75 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.01 1qh5 h LYS 35 CO 0.06 0.65 -0.01 0.28 -0.57 0.00 0.00 179.45 179.85 1qh5 h VAL 36 N 0.45 1.18 -0.64 0.50 2.07 -1.26 -1.29 116.25 117.26 1qh5 h VAL 36 Ca 0.08 -0.61 -0.03 0.00 0.82 0.00 0.00 66.70 66.96 1qh5 h VAL 36 Cb 0.55 1.59 -0.03 0.00 -1.52 0.00 0.00 31.29 31.87 1qh5 h VAL 36 CO 0.04 0.16 0.27 0.58 0.02 0.00 0.00 177.57 178.63 1qh5 h VAL 37 N -0.29 1.23 -0.34 2.57 2.07 -1.04 -1.40 116.25 119.05 1qh5 h VAL 37 Ca -0.00 -0.71 0.04 0.00 0.82 0.00 0.00 66.70 66.85 1qh5 h VAL 37 Cb 0.28 0.51 -0.04 0.00 -1.52 0.00 0.00 31.29 30.52 1qh5 h VAL 37 CO 0.00 0.28 0.10 0.44 0.02 0.00 0.00 177.57 178.42 1qh5 h ASP 38 N 0.90 0.09 -0.44 0.57 3.32 -0.89 -1.53 116.42 118.43 1qh5 h ASP 38 Ca 0.21 0.04 -0.06 0.00 0.02 0.00 0.00 57.03 57.25 1qh5 h ASP 38 Cb 0.19 0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.76 1qh5 h ASP 38 CO -0.02 0.09 0.06 0.00 -1.72 0.00 0.00 179.24 177.65 1qh5 h ALA 39 N 1.23 1.16 -0.43 3.45 0.00 -0.97 -0.92 119.26 122.78 1qh5 h ALA 39 Ca 0.15 -0.23 -0.11 0.00 0.00 0.00 0.00 54.91 54.72 1qh5 h ALA 39 Cb 0.14 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1qh5 h ALA 39 CO -0.17 0.55 -0.17 0.00 0.00 0.00 0.00 179.25 179.45 1qh5 h ALA 40 N 1.31 0.89 -0.25 0.00 0.00 -1.01 -2.47 119.26 117.72 1qh5 h ALA 40 Ca 0.16 -0.35 -0.14 0.00 0.00 0.00 0.00 54.91 54.57 1qh5 h ALA 40 Cb 0.37 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1qh5 h ALA 40 CO 0.01 0.63 -0.43 0.00 0.00 0.00 0.00 179.25 179.46 1qh5 h ARG 41 N 0.72 0.62 -0.83 0.00 3.08 -0.97 -1.53 114.38 115.48 1qh5 h ARG 41 Ca 0.11 -0.33 0.01 0.00 0.07 0.00 0.00 59.98 59.84 1qh5 h ARG 41 Cb 0.69 0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.71 1qh5 h ARG 41 CO 0.05 0.93 0.55 -0.22 -1.07 0.00 0.00 179.97 180.21 1qh5 h LYS 42 N 0.51 1.08 -0.05 0.04 3.64 -1.03 -2.66 116.57 118.09 1qh5 h LYS 42 Ca 0.04 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1qh5 h LYS 42 Cb 0.95 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.53 1qh5 h LYS 42 CO 0.09 0.71 0.00 0.72 -2.27 0.00 0.00 179.45 178.70 1qh5 n HIS 43 N -4.52 0.04 -3.76 1.91 8.25 -0.94 -4.97 115.22 111.23 1qh5 n HIS 43 Ca 0.09 -0.02 -0.25 0.00 -0.26 0.00 0.00 57.72 57.27 1qh5 n HIS 43 Cb 0.02 0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.17 1qh5 n HIS 43 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1qh5 n GLY 44 N 1.20 -0.41 3.62 -1.41 0.00 -0.65 -5.00 105.19 102.53 1qh5 n GLY 44 Ca 0.18 0.17 -0.24 0.00 0.00 0.00 0.00 46.02 46.13 1qh5 n GLY 44 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1qh5 s VAL 45 N -3.45 3.34 -0.36 1.61 -7.23 -0.74 -5.03 120.40 108.53 1qh5 s VAL 45 Ca 0.35 -1.87 -0.12 0.00 -1.81 0.00 0.00 61.98 58.53 1qh5 s VAL 45 Cb -0.17 -2.75 0.00 0.00 0.56 0.00 0.00 36.38 34.02 1qh5 s VAL 45 CO 0.80 -0.31 0.23 -0.75 -0.31 0.00 0.00 175.10 174.77 1qh5 s LYS 46 N -3.44 3.19 -0.20 4.82 2.20 -0.59 -4.70 119.74 121.02 1qh5 s LYS 46 Ca 0.30 -0.85 -0.29 0.00 -0.36 0.00 0.00 55.97 54.77 1qh5 s LYS 46 Cb -0.07 -3.79 -0.01 0.00 -1.51 0.00 0.00 37.83 32.44 1qh5 s LYS 46 CO 0.18 -0.57 1.33 -1.17 -0.36 0.00 0.00 175.35 174.77 1qh5 s LEU 47 N 1.66 4.09 -0.01 5.43 2.96 -1.26 -1.39 118.68 130.16 1qh5 s LEU 47 Ca 0.05 1.61 0.04 0.00 -0.22 0.00 0.00 54.13 55.60 1qh5 s LEU 47 Cb -0.18 -3.54 -0.06 0.00 0.50 0.00 0.00 46.19 42.92 1qh5 s LEU 47 CO 0.09 -0.90 0.08 0.35 -1.32 0.00 0.00 176.35 174.65 1qh5 n THR 48 N 5.68 0.01 -3.86 3.68 -2.24 -0.45 -4.87 114.28 112.24 1qh5 n THR 48 Ca 0.15 -0.09 -0.12 0.00 -2.27 0.00 0.00 64.05 61.72 1qh5 n THR 48 Cb 0.45 0.34 -0.13 0.00 -2.10 0.00 0.00 70.33 68.89 1qh5 n THR 48 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1qh5 s THR 49 N -2.24 0.01 -0.15 4.28 2.01 -1.19 -2.19 115.64 116.17 1qh5 s THR 49 Ca -0.01 -0.08 -0.01 0.00 0.31 0.00 0.00 61.69 61.90 1qh5 s THR 49 Cb 0.02 -0.13 -0.01 0.00 0.01 0.00 0.00 72.50 72.40 1qh5 s THR 49 CO 0.15 -0.04 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.23 1qh5 s VAL 50 N -0.11 3.07 -0.31 3.82 1.01 -0.04 -1.07 120.40 126.78 1qh5 s VAL 50 Ca -0.01 -0.64 -0.04 0.00 0.00 0.00 0.00 61.98 61.28 1qh5 s VAL 50 Cb -0.01 -2.31 0.04 0.00 0.00 0.00 0.00 36.38 34.10 1qh5 s VAL 50 CO 0.00 0.51 0.05 -0.76 0.00 0.00 0.00 175.10 174.90 1qh5 s LEU 51 N 0.56 4.00 -0.23 3.92 1.43 0.16 -0.74 118.68 127.79 1qh5 s LEU 51 Ca -0.08 -1.11 -0.07 0.00 -1.03 0.00 0.00 54.13 51.85 1qh5 s LEU 51 Cb -0.15 -1.79 -0.03 0.00 0.03 0.00 0.00 46.19 44.24 1qh5 s LEU 51 CO 0.03 -0.27 0.05 -0.89 0.23 0.00 0.00 176.35 175.51 1qh5 s THR 52 N 1.35 4.26 0.19 5.49 2.01 -0.48 -1.98 115.64 126.48 1qh5 s THR 52 Ca -0.02 -0.20 -0.02 0.00 0.31 0.00 0.00 61.69 61.76 1qh5 s THR 52 Cb -0.19 -2.97 -0.08 0.00 0.01 0.00 0.00 72.50 69.27 1qh5 s THR 52 CO 0.01 0.37 1.47 0.71 -0.69 0.00 0.00 174.62 176.49 1qh5 h THR 53 N 5.44 1.35 -2.49 -0.82 1.35 -1.88 -3.41 112.91 112.45 1qh5 h THR 53 Ca -0.38 -1.98 0.15 0.00 -0.55 0.00 0.00 66.41 63.65 1qh5 h THR 53 Cb 1.17 1.97 -0.07 0.00 -1.73 0.00 0.00 68.15 69.50 1qh5 h THR 53 CO 0.60 0.60 0.45 -1.38 -0.25 0.00 0.00 175.52 175.54 1qh5 s HIS 54 N -3.78 -0.10 -0.72 4.73 -3.43 -1.26 -0.92 115.29 109.81 1qh5 s HIS 54 Ca -0.06 -0.26 0.26 0.00 -0.80 0.00 0.00 55.06 54.20 1qh5 s HIS 54 Cb 0.11 0.67 0.78 0.00 -1.43 0.00 0.00 32.58 32.71 1qh5 s HIS 54 CO 0.84 -0.94 1.76 -2.39 -2.00 0.00 0.00 174.74 172.01 1qh5 n HIS 55 N -0.50 0.95 -1.59 0.38 1.44 -1.26 -4.05 115.22 110.59 1qh5 n HIS 55 Ca -0.05 0.28 -0.45 0.00 -2.01 0.00 0.00 57.72 55.48 1qh5 n HIS 55 Cb 0.60 -0.94 -0.02 0.00 0.12 0.00 0.00 29.99 29.75 1qh5 n HIS 55 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 1qh5 n HIS 56 N -2.28 1.26 -0.27 -1.40 8.25 -1.26 -4.53 115.22 115.00 1qh5 n HIS 56 Ca 0.05 0.70 0.16 0.00 -0.26 0.00 0.00 57.72 58.37 1qh5 n HIS 56 Cb 0.43 -2.25 0.44 0.00 1.12 0.00 0.00 29.99 29.73 1qh5 n HIS 56 CO 0.00 0.00 0.00 2.35 0.64 0.00 0.00 176.34 179.33 1qh5 h TRP 57 N 2.29 0.71 0.00 4.41 7.01 -1.94 -0.05 115.95 128.37 1qh5 h TRP 57 Ca -0.40 0.02 0.00 0.00 2.11 0.00 0.00 58.89 60.62 1qh5 h TRP 57 Cb 1.34 -0.22 0.00 0.00 -2.10 0.00 0.00 29.16 28.18 1qh5 h TRP 57 CO 0.49 0.21 0.00 -0.40 -2.79 0.00 0.00 178.44 175.95 1qh5 n ASP 58 N -4.57 0.00 -0.05 2.65 5.75 -1.26 -0.54 116.55 118.54 1qh5 n ASP 58 Ca 0.19 0.48 -0.08 0.00 -0.01 0.00 0.00 54.79 55.38 1qh5 n ASP 58 Cb 0.60 -0.49 -0.04 0.00 -1.03 0.00 0.00 41.12 40.16 1qh5 n ASP 58 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 1qh5 n HIS 59 N -1.49 0.00 0.65 2.11 8.25 -0.15 -4.66 115.22 119.94 1qh5 n HIS 59 Ca 0.03 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.57 1qh5 n HIS 59 Cb 0.15 -0.37 0.03 0.00 1.12 0.00 0.00 29.99 30.92 1qh5 n HIS 59 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1qh5 n ALA 60 N -2.93 2.82 0.43 -1.41 0.00 -0.53 -3.62 120.51 115.26 1qh5 n ALA 60 Ca -0.18 -0.56 0.06 0.00 0.00 0.00 0.00 53.44 52.76 1qh5 n ALA 60 Cb 0.67 -0.52 0.28 0.00 0.00 0.00 0.00 19.45 19.88 1qh5 n ALA 60 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1qh5 n GLY 61 N 1.00 -0.95 0.43 0.00 0.00 0.30 -2.36 105.19 103.61 1qh5 n GLY 61 Ca 0.07 -0.04 0.09 0.00 0.00 0.00 0.00 46.02 46.15 1qh5 n GLY 61 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qh5 n GLY 62 N -0.20 0.01 0.11 -0.02 0.00 -1.26 -4.62 105.19 99.21 1qh5 n GLY 62 Ca 0.03 -0.53 -0.09 0.00 0.00 0.00 0.00 46.02 45.43 1qh5 n GLY 62 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1qh5 h ASN 63 N 2.10 0.00 -0.20 1.61 4.21 -1.67 -0.25 115.58 121.39 1qh5 h ASN 63 Ca 0.00 0.03 0.03 0.00 1.21 0.00 0.00 56.30 57.57 1qh5 h ASN 63 Cb 0.63 0.05 -0.03 0.00 -1.12 0.00 0.00 38.32 37.85 1qh5 h ASN 63 CO 0.00 0.03 0.02 -0.33 -1.29 0.00 0.00 177.43 175.86 1qh5 h GLU 64 N 0.12 0.08 -0.67 0.81 4.39 -1.81 -2.42 114.58 115.09 1qh5 h GLU 64 Ca 0.09 -0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.77 1qh5 h GLU 64 Cb 0.09 -0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 28.69 1qh5 h GLU 64 CO -0.13 0.06 0.35 -0.22 -1.16 0.00 0.00 179.01 177.91 1qh5 h LYS 65 N 0.09 0.95 -0.64 2.33 1.63 -1.80 -3.10 116.57 116.02 1qh5 h LYS 65 Ca 0.09 -0.12 -0.04 0.00 -0.85 0.00 0.00 60.65 59.73 1qh5 h LYS 65 Cb 0.10 -0.18 -0.03 0.00 -0.60 0.00 0.00 32.23 31.53 1qh5 h LYS 65 CO -0.14 0.73 0.23 1.25 -3.45 0.00 0.00 179.45 178.06 1qh5 h LEU 66 N 0.92 0.88 -0.41 5.20 5.85 -0.76 -1.74 115.31 125.24 1qh5 h LEU 66 Ca 0.23 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.82 1qh5 h LEU 66 Cb 0.07 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 40.87 1qh5 h LEU 66 CO -0.03 0.80 0.00 0.52 -0.34 0.00 0.00 178.44 179.39 1qh5 n VAL 67 N -4.29 0.81 -0.02 1.05 0.31 -0.93 -0.65 118.33 114.60 1qh5 n VAL 67 Ca 0.05 0.17 -0.06 0.00 -0.01 0.00 0.00 64.34 64.50 1qh5 n VAL 67 Cb 0.19 -1.03 -0.13 0.00 -0.91 0.00 0.00 33.84 31.96 1qh5 n VAL 67 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1qh5 n LYS 68 N -2.01 0.64 0.06 5.55 4.76 -0.73 -4.25 118.16 122.19 1qh5 n LYS 68 Ca 0.03 0.19 -0.21 0.00 -2.87 0.00 0.00 58.31 55.46 1qh5 n LYS 68 Cb 0.24 -1.73 -0.13 0.00 -1.84 0.00 0.00 35.03 31.57 1qh5 n LYS 68 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 1qh5 h LEU 69 N 0.00 0.74 -8.38 -0.35 3.38 -0.60 -3.45 115.31 106.65 1qh5 h LEU 69 Ca -0.30 -0.83 -0.68 0.00 0.09 0.00 0.00 57.88 56.16 1qh5 h LEU 69 Cb 1.91 -0.23 -0.32 0.00 0.09 0.00 0.00 40.66 42.10 1qh5 h LEU 69 CO 0.06 1.49 -0.88 -1.61 0.09 0.00 0.00 178.44 177.59 1qh5 s GLU 70 N -2.94 2.95 0.25 1.13 0.41 0.17 -5.11 118.70 115.57 1qh5 s GLU 70 Ca -0.11 -0.88 -0.03 0.00 -0.41 0.00 0.00 54.97 53.54 1qh5 s GLU 70 Cb 0.04 -2.28 -0.05 0.00 -1.78 0.00 0.00 34.13 30.07 1qh5 s GLU 70 CO 0.89 0.22 0.48 -1.12 -0.49 0.00 0.00 175.26 175.24 1qh5 s SER 71 N 0.23 6.41 -0.02 -0.19 0.01 -1.26 -4.41 113.70 114.47 1qh5 s SER 71 Ca -0.16 0.55 0.00 0.00 1.31 0.00 0.00 55.95 57.66 1qh5 s SER 71 Cb -0.17 -2.07 0.00 0.00 0.21 0.00 0.00 66.02 63.98 1qh5 s SER 71 CO 0.08 -0.13 0.00 0.61 0.41 0.00 0.00 173.24 174.21 1qh5 n GLY 72 N -0.86 0.47 3.77 3.44 0.00 -1.26 -5.03 105.19 105.72 1qh5 n GLY 72 Ca -0.03 -0.14 -0.38 0.00 0.00 0.00 0.00 46.02 45.46 1qh5 n GLY 72 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1qh5 s LEU 73 N -0.05 4.23 -0.31 0.99 1.43 -1.26 -4.96 118.68 118.75 1qh5 s LEU 73 Ca 0.00 2.30 -0.12 0.00 -1.03 0.00 0.00 54.13 55.27 1qh5 s LEU 73 Cb 0.00 -3.99 -0.03 0.00 0.03 0.00 0.00 46.19 42.20 1qh5 s LEU 73 CO 0.00 -0.58 0.23 -0.54 0.23 0.00 0.00 176.35 175.70 1qh5 s LYS 74 N -2.21 3.70 -0.35 1.70 1.02 -0.93 -4.99 119.74 117.67 1qh5 s LYS 74 Ca 0.55 -0.47 -0.10 0.00 0.02 0.00 0.00 55.97 55.97 1qh5 s LYS 74 Cb -0.30 -3.74 0.02 0.00 -0.52 0.00 0.00 37.83 33.29 1qh5 s LYS 74 CO 0.37 -0.34 0.19 0.08 -0.92 0.00 0.00 175.35 174.74 1qh5 s VAL 75 N 1.77 4.57 0.05 3.17 1.01 -1.26 -0.86 120.40 128.86 1qh5 s VAL 75 Ca 0.07 -0.72 -0.04 0.00 0.00 0.00 0.00 61.98 61.28 1qh5 s VAL 75 Cb -0.17 -3.48 -0.05 0.00 0.00 0.00 0.00 36.38 32.68 1qh5 s VAL 75 CO 0.11 -0.14 0.28 -0.31 0.00 0.00 0.00 175.10 175.04 1qh5 s TYR 76 N 1.57 3.54 -0.14 5.22 1.51 0.08 -1.43 117.35 127.70 1qh5 s TYR 76 Ca 0.03 0.48 -0.34 0.00 -1.01 0.00 0.00 57.07 56.23 1qh5 s TYR 76 Cb -0.18 -1.93 0.14 0.00 -0.11 0.00 0.00 41.96 39.87 1qh5 s TYR 76 CO 0.06 0.57 1.33 0.20 -1.11 0.00 0.00 175.55 176.60 1qh5 s GLY 77 N -2.07 -0.36 -0.13 0.71 0.00 -1.14 -1.38 107.32 102.95 1qh5 s GLY 77 Ca 0.32 1.28 0.15 0.00 0.00 0.00 0.00 44.72 46.47 1qh5 s GLY 77 CO 0.21 0.36 1.35 0.61 0.00 0.00 0.00 173.10 175.63 1qh5 n GLY 78 N -0.28 3.75 3.00 0.20 0.00 -1.26 -0.97 105.19 109.62 1qh5 n GLY 78 Ca -0.03 -0.85 -0.13 0.00 0.00 0.00 0.00 46.02 45.00 1qh5 n GLY 78 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1qh5 s ASP 79 N -1.74 -0.17 0.36 1.61 -1.08 -1.26 -4.70 116.67 109.69 1qh5 s ASP 79 Ca 0.36 0.36 0.26 0.00 -0.52 0.00 0.00 52.55 53.01 1qh5 s ASP 79 Cb 0.27 0.29 1.27 0.00 -1.46 0.00 0.00 42.92 43.30 1qh5 s ASP 79 CO 0.10 -0.12 1.78 0.44 0.52 0.00 0.00 175.17 177.89 1qh5 h ASP 80 N 6.74 0.00 0.55 -0.34 3.32 -1.97 -1.79 116.42 122.93 1qh5 h ASP 80 Ca -0.36 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.69 1qh5 h ASP 80 Cb 1.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.71 1qh5 h ASP 80 CO 0.41 0.00 0.00 0.54 -1.72 0.00 0.00 179.24 178.47 1qh5 n ARG 81 N -2.41 0.25 -2.49 3.56 1.74 -1.26 -4.84 116.66 111.21 1qh5 n ARG 81 Ca -0.00 0.07 -0.42 0.00 -0.77 0.00 0.00 57.85 56.73 1qh5 n ARG 81 Cb 0.12 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.03 1qh5 n ARG 81 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1qh5 s ILE 82 N -2.69 4.26 0.35 0.55 1.01 -0.68 -4.92 121.20 119.09 1qh5 s ILE 82 Ca 0.20 1.61 -0.28 0.00 0.00 0.00 0.00 60.65 62.17 1qh5 s ILE 82 Cb 0.16 -4.03 -0.11 0.00 0.01 0.00 0.00 42.46 38.49 1qh5 s ILE 82 CO 0.38 0.10 1.43 -0.83 0.00 0.00 0.00 174.94 176.02 1qh5 s GLY 83 N 1.14 2.89 -2.02 6.18 0.00 -1.26 -3.27 107.32 110.98 1qh5 s GLY 83 Ca 0.57 1.46 0.00 0.00 0.00 0.00 0.00 44.72 46.74 1qh5 s GLY 83 CO 0.27 2.16 0.00 0.00 0.00 0.00 0.00 173.10 175.53 1qh5 n ALA 84 N 0.75 -0.44 -1.72 3.20 0.00 -1.26 -4.59 120.51 116.46 1qh5 n ALA 84 Ca 0.01 0.27 -0.42 0.00 0.00 0.00 0.00 53.44 53.29 1qh5 n ALA 84 Cb 0.40 -2.09 -0.03 0.00 0.00 0.00 0.00 19.45 17.73 1qh5 n ALA 84 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1qh5 n LEU 85 N -2.62 3.95 -0.02 0.00 7.94 -1.20 -4.68 117.00 120.37 1qh5 n LEU 85 Ca -0.22 1.08 -0.02 0.00 -1.11 0.00 0.00 56.01 55.74 1qh5 n LEU 85 Cb 0.68 -1.56 -0.02 0.00 0.53 0.00 0.00 43.42 43.05 1qh5 n LEU 85 CO 0.30 0.12 -0.60 0.35 -1.11 0.00 0.00 177.39 176.46 1qh5 n THR 86 N 3.65 0.21 -3.84 1.96 -2.24 -0.51 -4.97 114.28 108.54 1qh5 n THR 86 Ca 0.15 -0.12 -0.30 0.00 -2.27 0.00 0.00 64.05 61.51 1qh5 n THR 86 Cb 0.34 -0.87 -0.15 0.00 -2.10 0.00 0.00 70.33 67.55 1qh5 n THR 86 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1qh5 s HIS 87 N -2.07 2.29 -0.20 4.78 3.76 -0.62 -4.94 115.29 118.29 1qh5 s HIS 87 Ca -0.02 -1.99 -0.29 0.00 -0.15 0.00 0.00 55.06 52.60 1qh5 s HIS 87 Cb 0.01 -1.94 0.00 0.00 1.11 0.00 0.00 32.58 31.76 1qh5 s HIS 87 CO 0.12 -0.86 1.10 0.21 -0.85 0.00 0.00 174.74 174.46 1qh5 s LYS 88 N 1.42 4.27 0.38 1.40 2.20 -1.26 -2.87 119.74 125.27 1qh5 s LYS 88 Ca 0.07 1.45 0.08 0.00 -0.36 0.00 0.00 55.97 57.21 1qh5 s LYS 88 Cb -0.18 -3.66 -0.06 0.00 -1.51 0.00 0.00 37.83 32.42 1qh5 s LYS 88 CO -0.17 -0.62 0.03 0.96 -0.36 0.00 0.00 175.35 175.20 1qh5 s ILE 89 N 3.13 2.32 0.22 5.43 -5.25 -0.15 -4.97 121.20 121.94 1qh5 s ILE 89 Ca 0.48 -1.96 0.04 0.00 -0.99 0.00 0.00 60.65 58.21 1qh5 s ILE 89 Cb -0.17 -2.87 -0.01 0.00 2.95 0.00 0.00 42.46 42.35 1qh5 s ILE 89 CO 0.10 -0.10 0.13 0.35 -1.79 0.00 0.00 174.94 173.63 1qh5 n THR 90 N -0.99 0.00 -1.67 8.37 -2.24 -1.26 -4.27 114.28 112.22 1qh5 n THR 90 Ca -0.04 -1.45 -0.48 0.00 -2.27 0.00 0.00 64.05 59.82 1qh5 n THR 90 Cb 0.64 0.63 -0.05 0.00 -2.10 0.00 0.00 70.33 69.46 1qh5 n THR 90 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 1qh5 n HIS 91 N -0.46 2.28 -0.97 4.78 -0.00 -1.26 -1.64 115.22 117.96 1qh5 n HIS 91 Ca 0.01 0.13 0.00 0.00 0.46 0.00 0.00 57.72 58.32 1qh5 n HIS 91 Cb 0.37 -2.61 0.00 0.00 -0.12 0.00 0.00 29.99 27.63 1qh5 n HIS 91 CO 0.00 0.00 0.00 1.28 0.46 0.00 0.00 176.34 178.08 1qh5 n LEU 92 N 5.26 0.18 -4.69 0.27 4.77 0.48 -4.95 117.00 118.32 1qh5 n LEU 92 Ca 0.20 0.00 -0.39 0.00 -0.03 0.00 0.00 56.01 55.79 1qh5 n LEU 92 Cb 0.29 -0.65 0.04 0.00 -2.33 0.00 0.00 43.42 40.76 1qh5 n LEU 92 CO 0.69 -0.15 0.81 -1.20 -1.33 0.00 0.00 177.39 176.21 1qh5 n SER 93 N -0.12 2.01 -4.23 -1.43 7.64 -0.65 -4.67 113.62 112.17 1qh5 n SER 93 Ca 0.00 0.96 -0.20 0.00 1.01 0.00 0.00 58.87 60.65 1qh5 n SER 93 Cb 0.06 -1.49 -0.12 0.00 -1.01 0.00 0.00 64.21 61.65 1qh5 n SER 93 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1qh5 s THR 94 N -1.33 1.35 0.23 0.44 -4.23 -1.26 -0.91 115.64 109.93 1qh5 s THR 94 Ca 0.70 -1.53 -0.16 0.00 -1.18 0.00 0.00 61.69 59.52 1qh5 s THR 94 Cb -0.45 -1.37 0.01 0.00 1.34 0.00 0.00 72.50 72.03 1qh5 s THR 94 CO 0.51 -0.26 0.52 -1.48 -0.54 0.00 0.00 174.62 173.37 1qh5 s LEU 95 N -2.07 0.18 0.10 4.79 2.34 -0.85 -5.02 118.68 118.15 1qh5 s LEU 95 Ca 0.04 -0.71 0.10 0.00 0.06 0.00 0.00 54.13 53.62 1qh5 s LEU 95 Cb -0.08 2.02 -0.04 0.00 -0.56 0.00 0.00 46.19 47.54 1qh5 s LEU 95 CO 0.03 -1.13 -0.23 -1.10 -1.06 0.00 0.00 176.35 172.87 1qh5 s GLN 96 N -3.95 1.66 -0.45 1.48 -1.52 -1.26 -1.09 119.66 114.53 1qh5 s GLN 96 Ca 0.15 -1.22 0.03 0.00 -1.95 0.00 0.00 55.36 52.37 1qh5 s GLN 96 Cb -0.01 -2.02 0.13 0.00 -0.22 0.00 0.00 33.01 30.89 1qh5 s GLN 96 CO 0.04 0.48 0.23 0.08 -0.25 0.00 0.00 175.29 175.86 1qh5 s VAL 97 N -1.04 1.80 0.00 1.09 1.01 -0.40 -4.98 120.40 117.88 1qh5 s VAL 97 Ca 0.15 -2.73 0.00 0.00 0.00 0.00 0.00 61.98 59.40 1qh5 s VAL 97 Cb -0.10 -2.27 0.00 0.00 0.00 0.00 0.00 36.38 34.01 1qh5 s VAL 97 CO 0.07 -0.84 0.00 0.61 0.00 0.00 0.00 175.10 174.94 1qh5 n GLY 98 N 3.51 2.58 0.02 4.51 0.00 -1.26 -1.01 105.19 113.55 1qh5 n GLY 98 Ca 0.07 -0.28 0.13 0.00 0.00 0.00 0.00 46.02 45.93 1qh5 n GLY 98 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1qh5 n SER 99 N 5.86 0.29 -4.77 1.61 3.41 -1.26 -4.88 113.62 113.87 1qh5 n SER 99 Ca 0.00 0.33 -0.38 0.00 -0.26 0.00 0.00 58.87 58.55 1qh5 n SER 99 Cb 0.00 -0.34 -0.05 0.00 -0.26 0.00 0.00 64.21 63.56 1qh5 n SER 99 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1qh5 s LEU 100 N -3.33 4.42 -0.14 1.04 1.43 -0.18 -4.64 118.68 117.28 1qh5 s LEU 100 Ca 0.12 2.03 -0.10 0.00 -1.03 0.00 0.00 54.13 55.15 1qh5 s LEU 100 Cb 0.17 -3.85 -0.05 0.00 0.03 0.00 0.00 46.19 42.49 1qh5 s LEU 100 CO 0.59 -0.13 0.20 0.21 0.23 0.00 0.00 176.35 177.45 1qh5 s ASN 101 N -1.30 6.40 -0.13 2.29 3.84 -0.37 -1.28 114.94 124.39 1qh5 s ASN 101 Ca 0.48 0.47 0.02 0.00 0.21 0.00 0.00 52.86 54.04 1qh5 s ASN 101 Cb -0.25 -2.12 0.00 0.00 -0.55 0.00 0.00 41.25 38.33 1qh5 s ASN 101 CO 0.31 0.26 -0.20 -0.69 -2.79 0.00 0.00 177.10 173.99 1qh5 s VAL 102 N -0.27 2.29 -0.18 -5.21 1.01 -0.25 -1.04 120.40 116.75 1qh5 s VAL 102 Ca 0.14 -0.92 -0.01 0.00 0.00 0.00 0.00 61.98 61.20 1qh5 s VAL 102 Cb -0.12 -1.92 0.00 0.00 0.00 0.00 0.00 36.38 34.34 1qh5 s VAL 102 CO 0.03 0.54 -0.12 -0.75 0.00 0.00 0.00 175.10 174.80 1qh5 s LYS 103 N 0.60 3.23 -0.04 2.72 2.20 -0.18 -2.02 119.74 126.26 1qh5 s LYS 103 Ca -0.11 -0.72 -0.24 0.00 -0.36 0.00 0.00 55.97 54.54 1qh5 s LYS 103 Cb -0.16 -2.76 -0.04 0.00 -1.51 0.00 0.00 37.83 33.36 1qh5 s LYS 103 CO 0.03 -0.10 0.75 0.00 -0.36 0.00 0.00 175.35 175.66 1qh5 s LEU 105 N 0.69 2.53 -0.12 0.00 1.43 0.06 -0.39 118.68 122.88 1qh5 s LEU 105 Ca 0.40 -0.64 -0.30 0.00 -1.03 0.00 0.00 54.13 52.56 1qh5 s LEU 105 Cb -0.19 -1.58 -0.01 0.00 0.03 0.00 0.00 46.19 44.44 1qh5 s LEU 105 CO 0.20 -0.03 1.09 0.00 0.23 0.00 0.00 176.35 177.84 1qh5 s ALA 106 N 1.34 3.50 -0.50 4.21 0.00 -1.26 -1.02 121.76 128.03 1qh5 s ALA 106 Ca 0.04 0.42 0.08 0.00 0.00 0.00 0.00 51.96 52.50 1qh5 s ALA 106 Cb -0.14 -3.50 0.32 0.00 0.00 0.00 0.00 23.12 19.81 1qh5 s ALA 106 CO -0.09 -0.78 0.81 0.25 0.00 0.00 0.00 175.76 175.95 1qh5 n THR 107 N 4.77 1.54 -2.00 0.00 -2.24 -0.64 -4.95 114.28 110.76 1qh5 n THR 107 Ca 0.10 -5.05 -0.42 0.00 -2.27 0.00 0.00 64.05 56.42 1qh5 n THR 107 Cb 0.47 -1.18 -0.02 0.00 -2.10 0.00 0.00 70.33 67.49 1qh5 n THR 107 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1qh5 s PRO 108 N -2.76 4.25 0.00 -0.78 0.04 -1.26 -4.60 135.00 129.89 1qh5 s PRO 108 Ca 0.43 2.31 0.00 0.00 0.04 0.00 0.00 61.00 63.79 1qh5 s PRO 108 Cb 0.27 -3.12 0.00 0.00 0.04 0.00 0.00 34.50 31.69 1qh5 s PRO 108 CO -0.10 -0.46 0.00 0.00 0.04 0.00 0.00 177.00 176.48 1qh5 h HIS 110 N 0.00 0.31 -3.49 0.00 -0.00 -1.81 -1.97 115.15 108.19 1qh5 h HIS 110 Ca 0.00 0.02 -0.34 0.00 -0.00 0.00 0.00 60.37 60.06 1qh5 h HIS 110 Cb 0.00 -0.07 -0.16 0.00 -0.00 0.00 0.00 27.41 27.19 1qh5 h HIS 110 CO 0.00 0.10 -0.72 0.95 -0.00 0.00 0.00 177.93 178.26 1qh5 s THR 111 N -6.13 1.14 -0.20 6.26 -4.23 -1.26 -2.87 115.64 108.35 1qh5 s THR 111 Ca -0.13 -1.93 0.29 0.00 -1.18 0.00 0.00 61.69 58.74 1qh5 s THR 111 Cb 0.14 -1.70 0.35 0.00 1.34 0.00 0.00 72.50 72.63 1qh5 s THR 111 CO 0.73 -0.66 1.83 0.77 -0.54 0.00 0.00 174.62 176.75 1qh5 h SER 112 N 3.04 0.00 -0.37 3.99 4.64 -1.79 -3.14 113.55 119.91 1qh5 h SER 112 Ca -0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 1qh5 h SER 112 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1qh5 h SER 112 CO 0.60 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.17 1qh5 n GLY 113 N 0.38 3.63 3.74 -0.77 0.00 -1.26 -4.58 105.19 106.33 1qh5 n GLY 113 Ca 0.02 -0.98 -0.41 0.00 0.00 0.00 0.00 46.02 44.65 1qh5 n GLY 113 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1qh5 s HIS 114 N -2.70 3.13 -0.06 1.61 5.65 -1.19 -4.16 115.29 117.58 1qh5 s HIS 114 Ca 0.46 1.08 0.04 0.00 0.25 0.00 0.00 55.06 56.88 1qh5 s HIS 114 Cb 0.36 -3.73 0.00 0.00 -1.18 0.00 0.00 32.58 28.03 1qh5 s HIS 114 CO 0.12 -2.37 -0.18 0.42 -0.65 0.00 0.00 174.74 172.08 1qh5 s ILE 115 N 0.18 1.50 -0.07 0.89 -1.09 -0.10 -1.62 121.20 120.89 1qh5 s ILE 115 Ca 0.59 -0.73 -0.04 0.00 -2.23 0.00 0.00 60.65 58.23 1qh5 s ILE 115 Cb -0.39 -1.30 -0.04 0.00 -1.58 0.00 0.00 42.46 39.15 1qh5 s ILE 115 CO 0.40 0.43 0.13 0.00 -1.23 0.00 0.00 174.94 174.67 1qh5 s TYR 117 N -1.13 3.08 -0.36 0.00 2.02 -0.58 -0.76 117.35 119.63 1qh5 s TYR 117 Ca 0.20 -1.23 -0.17 0.00 -0.37 0.00 0.00 57.07 55.50 1qh5 s TYR 117 Cb -0.12 -2.14 -0.00 0.00 -0.40 0.00 0.00 41.96 39.29 1qh5 s TYR 117 CO 0.10 -0.64 0.45 0.12 -1.57 0.00 0.00 175.55 174.01 1qh5 s PHE 118 N 1.42 3.19 -0.15 2.71 5.36 -0.13 -1.26 117.98 129.12 1qh5 s PHE 118 Ca 0.02 0.03 -0.02 0.00 -0.96 0.00 0.00 56.93 56.00 1qh5 s PHE 118 Cb -0.16 -2.83 -0.02 0.00 -0.34 0.00 0.00 43.02 39.66 1qh5 s PHE 118 CO -0.02 -0.52 -0.08 0.08 -1.46 0.00 0.00 175.22 173.22 1qh5 s VAL 119 N 2.23 3.48 0.27 3.12 1.01 0.36 -1.01 120.40 129.86 1qh5 s VAL 119 Ca 0.15 -0.50 -0.03 0.00 0.00 0.00 0.00 61.98 61.60 1qh5 s VAL 119 Cb -0.16 -2.50 -0.02 0.00 0.00 0.00 0.00 36.38 33.70 1qh5 s VAL 119 CO 0.13 0.51 0.32 -0.94 0.00 0.00 0.00 175.10 175.11 1qh5 s SER 120 N 0.39 0.52 -0.33 3.32 1.04 -0.21 -1.67 113.70 116.76 1qh5 s SER 120 Ca -0.07 -1.37 0.02 0.00 0.48 0.00 0.00 55.95 55.01 1qh5 s SER 120 Cb -0.15 0.52 0.09 0.00 0.10 0.00 0.00 66.02 66.58 1qh5 s SER 120 CO 0.04 -1.05 0.03 -0.75 0.98 0.00 0.00 173.24 172.49 1qh5 s LYS 121 N -3.75 1.87 -0.03 4.02 2.20 -1.26 -1.23 119.74 121.56 1qh5 s LYS 121 Ca 0.33 -1.66 -0.36 0.00 -0.36 0.00 0.00 55.97 53.92 1qh5 s LYS 121 Cb 0.03 -3.19 -0.14 0.00 -1.51 0.00 0.00 37.83 33.02 1qh5 s LYS 121 CO 0.16 -0.83 1.65 -2.30 -0.36 0.00 0.00 175.35 173.67 1qh5 n PRO 122 N 4.40 1.72 -0.89 4.03 -0.02 -1.26 -0.97 135.00 142.01 1qh5 n PRO 122 Ca -0.04 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 1qh5 n PRO 122 Cb 0.42 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 1qh5 n PRO 122 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1qh5 n GLY 123 N 3.68 0.63 3.95 -1.23 0.00 -1.26 -5.01 105.19 105.95 1qh5 n GLY 123 Ca 0.21 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.95 1qh5 n GLY 123 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1qh5 s GLY 124 N -2.00 1.76 0.00 -0.02 0.00 -0.14 -5.03 107.32 101.89 1qh5 s GLY 124 Ca 0.00 -1.30 0.06 0.00 0.00 0.00 0.00 44.72 43.48 1qh5 s GLY 124 CO 0.00 -0.63 0.59 -1.14 0.00 0.00 0.00 173.10 171.92 1qh5 n SER 125 N -3.42 1.23 -4.86 1.64 3.41 -1.26 -5.01 113.62 105.35 1qh5 n SER 125 Ca 0.14 -1.11 -0.32 0.00 -0.26 0.00 0.00 58.87 57.32 1qh5 n SER 125 Cb 0.60 0.22 -0.06 0.00 -0.26 0.00 0.00 64.21 64.71 1qh5 n SER 125 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1qh5 s GLU 126 N -0.73 3.94 0.49 4.33 2.02 -1.26 -5.04 118.70 122.45 1qh5 s GLU 126 Ca 0.06 0.57 -0.22 0.00 0.02 0.00 0.00 54.97 55.40 1qh5 s GLU 126 Cb 0.05 -2.46 -0.07 0.00 0.10 0.00 0.00 34.13 31.75 1qh5 s GLU 126 CO 0.11 0.16 1.21 -2.14 0.02 0.00 0.00 175.26 174.61 1qh5 s PRO 127 N -3.06 3.57 0.88 0.39 0.02 -1.26 -4.82 135.00 130.72 1qh5 s PRO 127 Ca 0.53 1.86 -0.13 0.00 0.02 0.00 0.00 61.00 63.28 1qh5 s PRO 127 Cb -0.10 -2.33 0.12 0.00 0.02 0.00 0.00 34.50 32.20 1qh5 s PRO 127 CO 0.20 -0.73 1.17 -1.25 -0.33 0.00 0.00 177.00 176.06 1qh5 s PRO 128 N -2.80 1.41 0.05 5.54 0.04 -1.26 -4.91 135.00 133.08 1qh5 s PRO 128 Ca 0.66 0.14 0.04 0.00 0.04 0.00 0.00 61.00 61.89 1qh5 s PRO 128 Cb -0.31 -1.88 -0.02 0.00 0.04 0.00 0.00 34.50 32.32 1qh5 s PRO 128 CO 0.37 -1.98 -0.12 0.00 0.04 0.00 0.00 177.00 175.31 1qh5 s ALA 129 N -3.46 0.96 -0.06 8.56 0.00 -0.67 -1.58 121.76 125.52 1qh5 s ALA 129 Ca 0.64 -0.86 0.01 0.00 0.00 0.00 0.00 51.96 51.75 1qh5 s ALA 129 Cb -0.12 -0.08 0.02 0.00 0.00 0.00 0.00 23.12 22.94 1qh5 s ALA 129 CO 0.51 0.12 -0.07 0.54 0.00 0.00 0.00 175.76 176.87 1qh5 s VAL 130 N -1.15 0.78 -0.45 0.00 0.11 0.40 -0.49 120.40 119.59 1qh5 s VAL 130 Ca -0.03 -0.23 -0.15 0.00 -2.93 0.00 0.00 61.98 58.63 1qh5 s VAL 130 Cb -0.09 -0.78 0.06 0.00 -1.53 0.00 0.00 36.38 34.04 1qh5 s VAL 130 CO 0.01 0.29 0.36 -0.36 -3.33 0.00 0.00 175.10 172.08 1qh5 s PHE 131 N 1.07 3.25 -2.34 1.54 0.08 -0.39 -1.33 117.98 119.86 1qh5 s PHE 131 Ca -0.08 -0.86 0.21 0.00 0.12 0.00 0.00 56.93 56.32 1qh5 s PHE 131 Cb -0.14 -3.01 0.35 0.00 -0.57 0.00 0.00 43.02 39.65 1qh5 s PHE 131 CO -0.01 -0.74 1.32 0.25 -0.10 0.00 0.00 175.22 175.94 1qh5 n THR 132 N 5.18 0.43 -0.21 0.64 -2.24 -0.89 -1.53 114.28 115.67 1qh5 n THR 132 Ca -0.12 -0.71 0.00 0.00 -2.27 0.00 0.00 64.05 60.95 1qh5 n THR 132 Cb 0.44 1.05 0.00 0.00 -2.10 0.00 0.00 70.33 69.72 1qh5 n THR 132 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1qh5 n GLY 133 N 1.34 2.99 1.53 3.38 0.00 -1.26 -1.53 105.19 111.64 1qh5 n GLY 133 Ca 0.17 -0.06 -0.00 0.00 0.00 0.00 0.00 46.02 46.13 1qh5 n GLY 133 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1qh5 n ASP 134 N 2.65 4.28 -0.06 1.61 9.92 -1.26 -0.24 116.55 133.46 1qh5 n ASP 134 Ca 0.00 -3.22 -0.02 0.00 -0.53 0.00 0.00 54.79 51.02 1qh5 n ASP 134 Cb 0.00 -0.66 -0.01 0.00 -0.64 0.00 0.00 41.12 39.81 1qh5 n ASP 134 CO 0.00 0.00 0.00 0.74 0.13 0.00 0.00 177.20 178.07 1qh5 h THR 135 N 2.27 0.00 -3.21 -3.53 2.02 -1.65 -2.49 112.91 106.32 1qh5 h THR 135 Ca 0.16 -1.00 -0.67 0.00 0.77 0.00 0.00 66.41 65.67 1qh5 h THR 135 Cb 1.94 0.01 -0.32 0.00 -1.74 0.00 0.00 68.15 68.04 1qh5 h THR 135 CO 0.51 0.00 -0.80 -0.22 0.37 0.00 0.00 175.52 175.38 1qh5 s LEU 136 N -8.40 2.45 0.45 2.58 2.96 -1.23 -2.40 118.68 115.09 1qh5 s LEU 136 Ca -0.07 -0.53 0.07 0.00 -0.22 0.00 0.00 54.13 53.38 1qh5 s LEU 136 Cb 0.01 -1.58 -0.01 0.00 0.50 0.00 0.00 46.19 45.11 1qh5 s LEU 136 CO 0.10 0.01 0.40 -0.36 -1.32 0.00 0.00 176.35 175.18 1qh5 s PHE 137 N 1.29 2.46 -0.28 5.38 0.08 -0.80 -4.64 117.98 121.47 1qh5 s PHE 137 Ca 0.04 -0.56 -0.29 0.00 0.12 0.00 0.00 56.93 56.24 1qh5 s PHE 137 Cb -0.14 -2.13 -0.02 0.00 -0.57 0.00 0.00 43.02 40.16 1qh5 s PHE 137 CO -0.08 -0.23 1.76 0.08 -0.10 0.00 0.00 175.22 176.66 1qh5 s VAL 138 N -2.54 3.52 -0.81 -0.44 1.01 -1.26 -2.49 120.40 117.38 1qh5 s VAL 138 Ca 0.46 0.55 0.00 0.00 0.00 0.00 0.00 61.98 62.99 1qh5 s VAL 138 Cb -0.03 -3.62 0.00 0.00 0.00 0.00 0.00 36.38 32.73 1qh5 s VAL 138 CO 0.27 -0.34 0.00 0.00 0.00 0.00 0.00 175.10 175.03 1qh5 n ALA 139 N 9.62 -0.12 -3.00 5.51 0.00 -1.26 -4.46 120.51 126.79 1qh5 n ALA 139 Ca 0.22 0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.78 1qh5 n ALA 139 Cb 0.46 -1.24 0.00 0.00 0.00 0.00 0.00 19.45 18.67 1qh5 n ALA 139 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1qh5 n GLY 140 N -1.06 3.40 3.60 0.00 0.00 -1.04 -4.44 105.19 105.65 1qh5 n GLY 140 Ca -0.08 -1.10 -0.09 0.00 0.00 0.00 0.00 46.02 44.75 1qh5 n GLY 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qh5 s GLY 142 N -2.87 2.03 0.59 0.00 0.00 -0.94 -4.85 107.32 101.29 1qh5 s GLY 142 Ca 0.08 0.40 -0.19 0.00 0.00 0.00 0.00 44.72 45.02 1qh5 s GLY 142 CO -0.02 0.73 1.19 0.54 0.00 0.00 0.00 173.10 175.54 1qh5 s LYS 143 N -4.29 3.01 -1.41 2.90 1.02 -1.26 -4.86 119.74 114.84 1qh5 s LYS 143 Ca 0.64 1.76 -0.07 0.00 0.02 0.00 0.00 55.97 58.32 1qh5 s LYS 143 Cb -0.18 -1.94 0.06 0.00 -0.52 0.00 0.00 37.83 35.25 1qh5 s LYS 143 CO 0.43 -1.16 2.52 1.19 -0.92 0.00 0.00 175.35 177.41 1qh5 n PHE 144 N -1.61 2.59 -0.09 3.18 3.72 -1.26 -4.24 117.46 119.75 1qh5 n PHE 144 Ca 0.13 -2.90 -0.01 0.00 -0.05 0.00 0.00 57.45 54.62 1qh5 n PHE 144 Cb 0.50 -2.05 0.26 0.00 -0.94 0.00 0.00 39.48 37.25 1qh5 n PHE 144 CO 0.00 0.00 0.00 1.88 -0.05 0.00 0.00 176.76 178.59 1qh5 h TYR 145 N 4.82 0.74 0.00 1.38 0.05 -1.69 -3.18 116.97 119.08 1qh5 h TYR 145 Ca 0.73 -0.04 -0.05 0.00 0.05 0.00 0.00 58.73 59.42 1qh5 h TYR 145 Cb 0.32 -0.23 -0.11 0.00 1.01 0.00 0.00 36.73 37.72 1qh5 h TYR 145 CO 1.66 0.60 -0.59 0.39 -1.05 0.00 0.00 178.16 179.17 1qh5 n GLU 146 N -4.33 0.98 -3.81 4.88 1.02 -0.96 -5.02 120.64 113.40 1qh5 n GLU 146 Ca 0.04 -2.67 -0.09 0.00 -0.02 0.00 0.00 57.16 54.42 1qh5 n GLU 146 Cb 0.17 -1.06 0.02 0.00 -0.02 0.00 0.00 31.44 30.56 1qh5 n GLU 146 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1qh5 s GLY 147 N -2.68 0.41 0.44 0.62 0.00 -0.78 -4.42 107.32 100.92 1qh5 s GLY 147 Ca 0.33 -0.78 0.07 0.00 0.00 0.00 0.00 44.72 44.34 1qh5 s GLY 147 CO -0.08 -0.33 0.26 -0.51 0.00 0.00 0.00 173.10 172.44 1qh5 s THR 148 N -2.26 2.22 0.25 0.90 -4.23 -1.26 -4.85 115.64 106.41 1qh5 s THR 148 Ca 0.16 -1.59 -0.04 0.00 -1.18 0.00 0.00 61.69 59.05 1qh5 s THR 148 Cb -0.05 -2.81 0.15 0.00 1.34 0.00 0.00 72.50 71.14 1qh5 s THR 148 CO 0.12 0.00 1.80 0.00 -0.54 0.00 0.00 174.62 176.00 1qh5 h ALA 149 N 1.20 1.14 -0.99 3.99 0.00 -1.95 -2.09 119.26 120.56 1qh5 h ALA 149 Ca -0.41 -0.21 0.01 0.00 0.00 0.00 0.00 54.91 54.30 1qh5 h ALA 149 Cb 1.27 -0.25 -0.05 0.00 0.00 0.00 0.00 17.79 18.76 1qh5 h ALA 149 CO 0.65 0.59 0.66 0.22 0.00 0.00 0.00 179.25 181.37 1qh5 h ASP 150 N 0.93 1.14 -0.64 0.00 3.58 -1.97 -1.02 116.42 118.44 1qh5 h ASP 150 Ca 0.20 -0.03 -0.08 0.00 0.42 0.00 0.00 57.03 57.55 1qh5 h ASP 150 Cb 0.28 -0.28 -0.03 0.00 1.72 0.00 0.00 39.33 41.03 1qh5 h ASP 150 CO -0.01 0.82 0.08 -0.33 -2.88 0.00 0.00 179.24 176.93 1qh5 h GLU 151 N 1.34 1.08 -0.28 0.28 5.08 -1.76 -1.22 114.58 119.10 1qh5 h GLU 151 Ca 0.37 -0.29 -0.12 0.00 -1.00 0.00 0.00 59.36 58.32 1qh5 h GLU 151 Cb -0.14 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 28.97 1qh5 h GLU 151 CO -0.08 1.00 -0.31 1.98 -1.00 0.00 0.00 179.01 180.59 1qh5 h MET 152 N 1.00 0.59 -0.53 2.33 4.05 -1.07 -0.33 114.93 120.97 1qh5 h MET 152 Ca 0.19 -0.26 0.00 0.00 -0.28 0.00 0.00 59.70 59.36 1qh5 h MET 152 Cb 0.46 -0.02 -0.03 0.00 -0.80 0.00 0.00 31.60 31.22 1qh5 h MET 152 CO 0.02 0.83 0.34 0.00 0.23 0.00 0.00 176.91 178.33 1qh5 h LYS 154 N 0.72 0.55 -0.32 0.00 1.57 -0.93 0.55 116.57 118.71 1qh5 h LYS 154 Ca 0.19 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.90 1qh5 h LYS 154 Cb -0.07 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.12 1qh5 h LYS 154 CO -0.04 0.47 0.18 0.00 -0.57 0.00 0.00 179.45 179.49 1qh5 h ALA 155 N 1.05 0.41 0.08 3.86 0.00 -0.81 -1.10 119.26 122.75 1qh5 h ALA 155 Ca 0.14 -0.06 -0.20 0.00 0.00 0.00 0.00 54.91 54.78 1qh5 h ALA 155 Cb 0.09 -0.13 0.02 0.00 0.00 0.00 0.00 17.79 17.77 1qh5 h ALA 155 CO -0.02 -0.08 -0.84 -0.07 0.00 0.00 0.00 179.25 178.24 1qh5 h LEU 156 N 0.40 0.60 0.00 0.00 3.38 -1.00 -0.58 115.31 118.11 1qh5 h LEU 156 Ca 0.11 -0.84 -0.30 0.00 0.09 0.00 0.00 57.88 56.94 1qh5 h LEU 156 Cb 0.04 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.54 1qh5 h LEU 156 CO -0.02 1.38 -1.75 0.18 0.09 0.00 0.00 178.44 178.32 1qh5 n LEU 157 N -4.08 0.82 -0.11 1.67 4.77 0.18 -0.52 117.00 119.74 1qh5 n LEU 157 Ca -0.12 0.39 -0.15 0.00 -0.03 0.00 0.00 56.01 56.09 1qh5 n LEU 157 Cb 0.81 0.19 -0.10 0.00 -2.33 0.00 0.00 43.42 41.99 1qh5 n LEU 157 CO 0.50 0.40 -1.19 -0.62 -1.33 0.00 0.00 177.39 175.15 1qh5 n GLU 158 N -3.03 0.52 -0.03 3.23 1.02 -0.63 -3.95 120.64 117.76 1qh5 n GLU 158 Ca -0.18 0.13 -0.02 0.00 -0.02 0.00 0.00 57.16 57.07 1qh5 n GLU 158 Cb 1.06 -1.41 -0.01 0.00 -0.02 0.00 0.00 31.44 31.06 1qh5 n GLU 158 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1qh5 h VAL 159 N -0.06 0.00 -0.24 2.62 2.07 -1.29 -3.34 116.25 116.02 1qh5 h VAL 159 Ca -0.48 -0.56 -0.19 0.00 0.82 0.00 0.00 66.70 66.30 1qh5 h VAL 159 Cb 1.71 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.48 1qh5 h VAL 159 CO -0.09 0.00 -0.61 -0.07 0.02 0.00 0.00 177.57 176.82 1qh5 h LEU 160 N -0.56 0.93 -2.65 2.57 3.38 -1.25 -3.29 115.31 114.43 1qh5 h LEU 160 Ca 0.00 -0.52 -0.00 0.00 0.09 0.00 0.00 57.88 57.44 1qh5 h LEU 160 Cb 0.17 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.65 1qh5 h LEU 160 CO 0.00 1.32 -0.00 1.23 0.09 0.00 0.00 178.44 181.07 1qh5 h GLY 161 N 0.71 0.00 -1.33 0.83 0.00 -0.93 -2.30 103.07 100.06 1qh5 h GLY 161 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1qh5 h GLY 161 CO 0.13 0.00 0.00 0.54 0.00 0.00 0.00 176.54 177.21 1qh5 n ARG 162 N -3.54 2.00 -1.42 4.80 1.74 -1.24 -4.91 116.66 114.09 1qh5 n ARG 162 Ca -0.03 -1.50 -0.30 0.00 -0.77 0.00 0.00 57.85 55.25 1qh5 n ARG 162 Cb 0.08 -1.44 0.11 0.00 -1.02 0.00 0.00 32.46 30.20 1qh5 n ARG 162 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1qh5 s LEU 163 N -1.57 2.38 0.53 0.55 1.43 -0.87 -4.96 118.68 116.18 1qh5 s LEU 163 Ca 0.34 1.32 -0.22 0.00 -1.03 0.00 0.00 54.13 54.54 1qh5 s LEU 163 Cb 0.19 -3.82 -0.06 0.00 0.03 0.00 0.00 46.19 42.53 1qh5 s LEU 163 CO 0.28 -2.31 1.27 -2.65 0.23 0.00 0.00 176.35 173.18 1qh5 n PRO 164 N -3.65 1.59 0.15 1.29 -0.02 -1.26 -4.88 135.00 128.22 1qh5 n PRO 164 Ca 0.07 0.58 0.07 0.00 -2.02 0.00 0.00 63.50 62.20 1qh5 n PRO 164 Cb 0.56 -2.46 0.56 0.00 -0.02 0.00 0.00 33.50 32.14 1qh5 n PRO 164 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1qh5 h PRO 165 N 1.38 0.20 -0.00 0.52 0.13 -1.93 -1.42 132.00 130.88 1qh5 h PRO 165 Ca -0.50 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1qh5 h PRO 165 Cb 1.31 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1qh5 h PRO 165 CO 0.56 0.13 -0.00 -0.40 -0.23 0.00 0.00 178.00 178.06 1qh5 n ASP 166 N -4.51 0.47 -4.69 1.44 5.75 -1.26 -1.58 116.55 112.16 1qh5 n ASP 166 Ca -0.00 -1.12 -0.44 0.00 -0.01 0.00 0.00 54.79 53.22 1qh5 n ASP 166 Cb 0.10 -0.01 -0.04 0.00 -1.03 0.00 0.00 41.12 40.15 1qh5 n ASP 166 CO 0.00 0.00 0.00 0.41 -0.11 0.00 0.00 177.20 177.50 1qh5 n THR 167 N -0.65 0.04 -2.71 2.12 -1.04 -0.54 -4.65 114.28 106.85 1qh5 n THR 167 Ca 0.22 -0.01 -0.42 0.00 -2.04 0.00 0.00 64.05 61.81 1qh5 n THR 167 Cb 0.19 -1.80 -0.04 0.00 -1.82 0.00 0.00 70.33 66.86 1qh5 n THR 167 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 1qh5 s ARG 168 N 1.24 4.62 -0.25 -2.82 3.00 -0.61 -2.22 118.95 121.91 1qh5 s ARG 168 Ca 0.78 1.44 -0.09 0.00 0.00 0.00 0.00 55.73 57.86 1qh5 s ARG 168 Cb -0.58 -3.42 -0.04 0.00 0.00 0.00 0.00 34.95 30.91 1qh5 s ARG 168 CO 0.35 0.06 0.11 0.08 0.00 0.00 0.00 175.30 175.90 1qh5 s VAL 169 N 0.60 4.68 -0.33 3.52 1.01 0.12 -0.46 120.40 129.55 1qh5 s VAL 169 Ca 0.50 -0.05 0.03 0.00 0.00 0.00 0.00 61.98 62.47 1qh5 s VAL 169 Cb -0.22 -3.20 0.10 0.00 0.00 0.00 0.00 36.38 33.06 1qh5 s VAL 169 CO 0.29 0.32 0.04 -0.31 0.00 0.00 0.00 175.10 175.44 1qh5 s TYR 170 N 1.53 3.52 0.55 5.22 2.02 -0.44 -2.11 117.35 127.64 1qh5 s TYR 170 Ca 0.06 -2.83 0.06 0.00 -0.37 0.00 0.00 57.07 53.99 1qh5 s TYR 170 Cb -0.15 -2.73 0.06 0.00 -0.40 0.00 0.00 41.96 38.74 1qh5 s TYR 170 CO 0.06 -0.94 0.76 0.00 -1.57 0.00 0.00 175.55 173.86 1qh5 h GLY 172 N 0.17 0.18 -3.39 0.00 0.00 -0.87 -3.42 103.07 95.73 1qh5 h GLY 172 Ca -0.36 -0.27 -0.30 0.00 0.00 0.00 0.00 47.33 46.40 1qh5 h GLY 172 CO 0.44 0.24 -0.72 0.30 0.00 0.00 0.00 176.54 176.80 1qh5 s HIS 173 N -3.41 1.05 -1.23 5.60 3.76 -1.26 -1.25 115.29 118.56 1qh5 s HIS 173 Ca -0.03 -0.73 -0.12 0.00 -0.15 0.00 0.00 55.06 54.03 1qh5 s HIS 173 Cb 0.11 -0.57 0.17 0.00 1.11 0.00 0.00 32.58 33.40 1qh5 s HIS 173 CO 0.81 -0.02 1.54 -1.91 -0.85 0.00 0.00 174.74 174.31 1qh5 n GLU 174 N 0.30 3.44 -0.18 1.40 4.07 -0.05 -4.70 120.64 124.92 1qh5 n GLU 174 Ca -0.14 -3.79 0.06 0.00 -0.06 0.00 0.00 57.16 53.23 1qh5 n GLU 174 Cb 0.59 -3.00 0.14 0.00 -0.06 0.00 0.00 31.44 29.11 1qh5 n GLU 174 CO 0.00 0.00 0.00 0.66 -0.06 0.00 0.00 177.13 177.73 1qh5 n TYR 175 N 5.14 0.36 -0.20 4.31 4.01 -1.26 -4.87 117.16 124.65 1qh5 n TYR 175 Ca 0.37 -0.73 -0.06 0.00 -0.16 0.00 0.00 57.90 57.33 1qh5 n TYR 175 Cb 0.41 -0.14 0.04 0.00 -0.31 0.00 0.00 39.34 39.34 1qh5 n TYR 175 CO 0.00 0.00 0.00 1.15 -0.46 0.00 0.00 176.86 177.55 1qh5 h THR 176 N 0.94 1.11 -0.16 -0.72 2.02 -1.84 -0.61 112.91 113.66 1qh5 h THR 176 Ca 0.00 -0.25 -0.02 0.00 0.77 0.00 0.00 66.41 66.91 1qh5 h THR 176 Cb 0.93 0.31 -0.01 0.00 -1.74 0.00 0.00 68.15 67.65 1qh5 h THR 176 CO 0.06 0.13 0.01 0.40 0.37 0.00 0.00 175.52 176.49 1qh5 h ILE 177 N 0.73 1.25 -0.38 3.11 2.04 -1.90 -1.31 117.51 121.04 1qh5 h ILE 177 Ca 0.22 -0.81 -0.10 0.00 1.00 0.00 0.00 64.86 65.16 1qh5 h ILE 177 Cb -0.04 1.48 -0.02 0.00 -0.74 0.00 0.00 36.82 37.51 1qh5 h ILE 177 CO -0.07 0.24 -0.18 0.78 0.00 0.00 0.00 178.15 178.92 1qh5 h ASN 178 N 0.02 0.71 -0.68 1.72 -0.26 -1.92 -0.83 115.58 114.34 1qh5 h ASN 178 Ca 0.04 -0.23 -0.01 0.00 -0.56 0.00 0.00 56.30 55.55 1qh5 h ASN 178 Cb 0.36 -0.19 -0.03 0.00 -1.06 0.00 0.00 38.32 37.39 1qh5 h ASN 178 CO 0.01 0.89 0.40 0.78 -1.06 0.00 0.00 177.43 178.45 1qh5 h ASN 179 N 0.63 0.83 0.48 5.81 2.35 -0.82 -2.19 115.58 122.67 1qh5 h ASN 179 Ca 0.10 -0.07 -0.14 0.00 -0.55 0.00 0.00 56.30 55.64 1qh5 h ASN 179 Cb 0.65 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.80 1qh5 h ASN 179 CO 0.05 0.65 -0.62 -0.07 -1.65 0.00 0.00 177.43 175.79 1qh5 h LEU 180 N 0.93 0.15 -0.83 1.61 3.38 -0.76 -1.08 115.31 118.72 1qh5 h LEU 180 Ca 0.24 -0.09 -0.05 0.00 0.09 0.00 0.00 57.88 58.07 1qh5 h LEU 180 Cb -0.02 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 1qh5 h LEU 180 CO -0.04 0.73 0.28 0.11 0.09 0.00 0.00 178.44 179.61 1qh5 h LYS 181 N 0.10 1.15 -0.31 1.13 1.57 -0.86 -0.18 116.57 119.17 1qh5 h LYS 181 Ca -0.01 -0.22 -0.08 0.00 -1.87 0.00 0.00 60.65 58.48 1qh5 h LYS 181 Cb 1.11 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 33.23 1qh5 h LYS 181 CO 0.09 0.95 -0.11 0.35 -0.57 0.00 0.00 179.45 180.16 1qh5 h PHE 182 N 1.12 0.70 -0.98 -1.35 3.57 -1.15 -2.91 116.94 115.94 1qh5 h PHE 182 Ca 0.25 -0.16 0.06 0.00 3.53 0.00 0.00 57.97 61.65 1qh5 h PHE 182 Cb 0.24 -0.17 -0.06 0.00 2.79 0.00 0.00 35.95 38.75 1qh5 h PHE 182 CO 0.02 0.82 0.64 0.00 -2.23 0.00 0.00 178.31 177.56 1qh5 h ALA 183 N 0.78 1.42 -0.23 2.41 0.00 -0.90 -2.04 119.26 120.70 1qh5 h ALA 183 Ca 0.07 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 1qh5 h ALA 183 Cb 0.61 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1qh5 h ALA 183 CO 0.04 0.44 -0.10 -0.09 0.00 0.00 0.00 179.25 179.54 1qh5 h ARG 184 N 1.16 0.36 -0.19 0.00 2.43 -0.94 -0.73 114.38 116.47 1qh5 h ARG 184 Ca 0.42 -0.09 -0.05 0.00 -0.81 0.00 0.00 59.98 59.46 1qh5 h ARG 184 Cb 0.16 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.65 1qh5 h ARG 184 CO -0.16 0.47 -0.06 1.25 -1.51 0.00 0.00 179.97 179.96 1qh5 h HIS 185 N 0.34 0.44 -0.46 2.20 2.76 -1.19 -2.46 115.15 116.78 1qh5 h HIS 185 Ca 0.07 -0.10 -0.03 0.00 -2.20 0.00 0.00 60.37 58.11 1qh5 h HIS 185 Cb 0.39 -0.10 -0.02 0.00 1.55 0.00 0.00 27.41 29.22 1qh5 h HIS 185 CO 0.01 0.66 0.18 0.28 -1.30 0.00 0.00 177.93 177.75 1qh5 h VAL 186 N 0.10 1.21 -2.66 5.26 2.07 -0.96 -3.37 116.25 117.90 1qh5 h VAL 186 Ca 0.05 -0.65 -0.60 0.00 0.82 0.00 0.00 66.70 66.31 1qh5 h VAL 186 Cb 0.53 0.78 -0.40 0.00 -1.52 0.00 0.00 31.29 30.67 1qh5 h VAL 186 CO 0.02 0.24 -0.76 -0.62 0.02 0.00 0.00 177.57 176.48 1qh5 n GLU 187 N -4.58 1.24 0.22 1.57 1.02 -0.32 -4.85 120.64 114.94 1qh5 n GLU 187 Ca 0.01 -3.95 0.17 0.00 -0.02 0.00 0.00 57.16 53.37 1qh5 n GLU 187 Cb 0.16 -1.99 0.85 0.00 -0.02 0.00 0.00 31.44 30.44 1qh5 n GLU 187 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 1qh5 h PRO 188 N 5.25 0.00 -0.62 3.49 0.11 -1.62 -2.52 132.00 136.09 1qh5 h PRO 188 Ca 0.19 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.30 1qh5 h PRO 188 Cb 0.81 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.92 1qh5 h PRO 188 CO 0.59 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.79 1qh5 n GLY 189 N -1.38 2.01 3.51 -0.55 0.00 -1.26 -4.89 105.19 102.64 1qh5 n GLY 189 Ca 0.01 -0.68 -0.43 0.00 0.00 0.00 0.00 46.02 44.92 1qh5 n GLY 189 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1qh5 s ASN 190 N -0.94 6.28 0.35 1.61 3.84 -0.95 -4.95 114.94 120.18 1qh5 s ASN 190 Ca 0.42 -0.38 0.16 0.00 0.21 0.00 0.00 52.86 53.27 1qh5 s ASN 190 Cb 0.23 -2.28 0.61 0.00 -0.55 0.00 0.00 41.25 39.26 1qh5 s ASN 190 CO 0.25 -0.66 1.71 0.00 -2.79 0.00 0.00 177.10 175.62 1qh5 h ALA 191 N 8.75 1.03 -0.61 1.71 0.00 -1.90 -2.98 119.26 125.25 1qh5 h ALA 191 Ca -0.26 -0.40 -0.05 0.00 0.00 0.00 0.00 54.91 54.19 1qh5 h ALA 191 Cb 1.11 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 1qh5 h ALA 191 CO 0.84 0.55 0.16 0.00 0.00 0.00 0.00 179.25 180.80 1qh5 h ALA 192 N 1.56 1.13 -0.10 0.00 0.00 -1.92 -1.14 119.26 118.79 1qh5 h ALA 192 Ca -0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1qh5 h ALA 192 Cb 0.92 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 1qh5 h ALA 192 CO 0.06 0.59 0.06 0.82 0.00 0.00 0.00 179.25 180.78 1qh5 h ILE 193 N 0.91 1.03 -0.55 0.00 2.04 -1.80 -1.49 117.51 117.65 1qh5 h ILE 193 Ca 0.20 -0.06 -0.03 0.00 1.00 0.00 0.00 64.86 65.97 1qh5 h ILE 193 Cb 0.31 0.90 -0.02 0.00 -0.74 0.00 0.00 36.82 37.26 1qh5 h ILE 193 CO -0.00 0.03 0.24 0.03 0.00 0.00 0.00 178.15 178.45 1qh5 h ARG 194 N 0.12 0.80 -0.23 2.37 3.08 -1.42 -0.49 114.38 118.61 1qh5 h ARG 194 Ca 0.04 -0.13 -0.18 0.00 0.07 0.00 0.00 59.98 59.77 1qh5 h ARG 194 Cb -0.01 -0.14 -0.00 0.00 0.08 0.00 0.00 29.97 29.90 1qh5 h ARG 194 CO -0.01 0.68 -0.57 0.93 -1.07 0.00 0.00 179.97 179.93 1qh5 h GLU 195 N 0.74 0.73 -0.31 0.04 4.39 -1.19 -2.09 114.58 116.89 1qh5 h GLU 195 Ca 0.18 -0.47 -0.08 0.00 0.34 0.00 0.00 59.36 59.33 1qh5 h GLU 195 Cb 0.16 0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.85 1qh5 h GLU 195 CO -0.02 1.10 -0.13 -0.22 -1.16 0.00 0.00 179.01 178.57 1qh5 h LYS 196 N 0.55 0.53 -0.63 2.33 1.63 -1.06 -2.15 116.57 117.77 1qh5 h LYS 196 Ca 0.00 -0.16 -0.09 0.00 -0.85 0.00 0.00 60.65 59.56 1qh5 h LYS 196 Cb 1.16 -0.05 -0.02 0.00 -0.60 0.00 0.00 32.23 32.71 1qh5 h LYS 196 CO 0.12 0.66 0.06 1.25 -3.45 0.00 0.00 179.45 178.09 1qh5 h LEU 197 N 0.49 1.04 -0.34 5.20 5.85 -0.92 -0.28 115.31 126.35 1qh5 h LEU 197 Ca 0.09 -0.28 -0.03 0.00 0.84 0.00 0.00 57.88 58.49 1qh5 h LEU 197 Cb 0.52 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 1qh5 h LEU 197 CO 0.03 1.06 0.08 0.00 -0.34 0.00 0.00 178.44 179.27 1qh5 h ALA 198 N 1.02 0.45 -0.72 1.25 0.00 -1.11 -1.54 119.26 118.61 1qh5 h ALA 198 Ca 0.19 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.95 1qh5 h ALA 198 Cb 0.49 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.10 1qh5 h ALA 198 CO 0.02 0.12 0.45 2.35 0.00 0.00 0.00 179.25 182.20 1qh5 h TRP 199 N 0.40 0.85 -0.44 0.00 7.01 -1.19 -2.57 115.95 120.01 1qh5 h TRP 199 Ca 0.11 0.02 -0.13 0.00 2.11 0.00 0.00 58.89 61.00 1qh5 h TRP 199 Cb 0.30 -0.28 -0.01 0.00 -2.10 0.00 0.00 29.16 27.07 1qh5 h TRP 199 CO 0.02 0.49 -0.26 0.00 -2.79 0.00 0.00 178.44 175.90 1qh5 h ALA 200 N 1.31 0.72 -0.37 2.65 0.00 -0.86 -1.34 119.26 121.37 1qh5 h ALA 200 Ca 0.29 -0.40 -0.09 0.00 0.00 0.00 0.00 54.91 54.71 1qh5 h ALA 200 Cb 0.02 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1qh5 h ALA 200 CO -0.11 0.67 -0.14 0.87 0.00 0.00 0.00 179.25 180.54 1qh5 h LYS 201 N 0.79 0.66 -0.39 0.00 1.57 -1.22 -1.34 116.57 116.65 1qh5 h LYS 201 Ca 0.10 -0.22 -0.06 0.00 -1.87 0.00 0.00 60.65 58.59 1qh5 h LYS 201 Cb 0.82 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.06 1qh5 h LYS 201 CO 0.07 0.78 0.00 1.49 -0.57 0.00 0.00 179.45 181.22 1qh5 h GLU 202 N 0.60 0.69 -0.82 3.15 4.57 -1.00 -1.38 114.58 120.39 1qh5 h GLU 202 Ca 0.10 -0.22 -0.03 0.00 -1.18 0.00 0.00 59.36 58.03 1qh5 h GLU 202 Cb 0.58 -0.06 -0.04 0.00 -0.16 0.00 0.00 28.75 29.07 1qh5 h GLU 202 CO 0.04 0.78 0.38 0.87 -1.18 0.00 0.00 179.01 179.90 1qh5 h LYS 203 N 0.52 1.18 -0.67 1.92 1.79 -1.02 -2.18 116.57 118.11 1qh5 h LYS 203 Ca 0.11 -0.18 -0.07 0.00 -2.18 0.00 0.00 60.65 58.34 1qh5 h LYS 203 Cb 0.47 -0.21 -0.03 0.00 -1.58 0.00 0.00 32.23 30.88 1qh5 h LYS 203 CO 0.02 0.91 0.15 -0.92 -1.08 0.00 0.00 179.45 178.54 1qh5 h TYR 204 N 1.17 1.12 -0.67 -1.35 3.20 -1.10 -1.31 116.97 118.02 1qh5 h TYR 204 Ca 0.28 -0.13 -0.04 0.00 3.14 0.00 0.00 58.73 61.98 1qh5 h TYR 204 Cb 0.13 -0.32 -0.03 0.00 1.54 0.00 0.00 36.73 38.05 1qh5 h TYR 204 CO 0.02 0.92 0.24 1.03 -1.64 0.00 0.00 178.16 178.72 1qh5 h SER 205 N 1.01 0.92 -0.10 -2.11 0.87 -0.65 -2.73 113.55 110.76 1qh5 h SER 205 Ca 0.21 -0.14 0.00 0.00 -1.23 0.00 0.00 61.79 60.63 1qh5 h SER 205 Cb 0.37 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 62.09 1qh5 h SER 205 CO 0.00 0.84 0.00 2.30 -0.53 0.00 0.00 176.83 179.45 1qh5 n ILE 206 N -4.29 0.12 -1.46 2.23 -5.35 -0.90 -4.96 119.36 104.75 1qh5 n ILE 206 Ca 0.06 -0.38 -0.01 0.00 -0.27 0.00 0.00 62.75 62.14 1qh5 n ILE 206 Cb 0.19 0.72 -0.00 0.00 -1.74 0.00 0.00 39.64 38.81 1qh5 n ILE 206 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1qh5 n GLY 207 N 1.24 0.41 3.71 3.28 0.00 -0.70 -5.06 105.19 108.07 1qh5 n GLY 207 Ca 0.17 -0.95 -0.33 0.00 0.00 0.00 0.00 46.02 44.92 1qh5 n GLY 207 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1qh5 s GLU 208 N -2.95 2.85 0.80 1.61 2.02 -0.58 -5.02 118.70 117.42 1qh5 s GLU 208 Ca 0.00 -0.58 -0.12 0.00 0.02 0.00 0.00 54.97 54.29 1qh5 s GLU 208 Cb 0.00 -2.71 0.08 0.00 0.10 0.00 0.00 34.13 31.59 1qh5 s GLU 208 CO 0.00 0.63 1.14 -2.14 0.02 0.00 0.00 175.26 174.91 1qh5 s PRO 209 N -1.61 1.87 0.00 0.39 0.02 -1.26 -4.25 135.00 130.16 1qh5 s PRO 209 Ca 0.20 1.47 0.23 0.00 0.02 0.00 0.00 61.00 62.93 1qh5 s PRO 209 Cb -0.12 -1.83 0.53 0.00 0.02 0.00 0.00 34.50 33.10 1qh5 s PRO 209 CO 0.11 -1.98 1.45 0.25 -0.33 0.00 0.00 177.00 176.50 1qh5 n THR 210 N -3.44 0.27 -3.99 0.99 -2.24 -1.26 -4.89 114.28 99.72 1qh5 n THR 210 Ca 0.11 -0.54 -0.27 0.00 -2.27 0.00 0.00 64.05 61.08 1qh5 n THR 210 Cb 0.52 0.88 -0.04 0.00 -2.10 0.00 0.00 70.33 69.58 1qh5 n THR 210 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1qh5 s VAL 211 N -1.73 5.01 0.61 2.28 -7.23 -1.26 -4.33 120.40 113.75 1qh5 s VAL 211 Ca 0.35 -0.77 -0.09 0.00 -1.81 0.00 0.00 61.98 59.65 1qh5 s VAL 211 Cb 0.21 -3.54 -0.02 0.00 0.56 0.00 0.00 36.38 33.59 1qh5 s VAL 211 CO 0.30 -0.04 0.99 -2.16 -0.31 0.00 0.00 175.10 173.87 1qh5 s PRO 212 N -3.01 3.31 0.00 4.82 0.04 -1.26 -5.08 135.00 133.82 1qh5 s PRO 212 Ca 0.33 0.48 0.00 0.00 0.04 0.00 0.00 61.00 61.85 1qh5 s PRO 212 Cb -0.11 -2.14 0.00 0.00 0.04 0.00 0.00 34.50 32.29 1qh5 s PRO 212 CO 0.26 -0.64 0.00 -1.13 0.04 0.00 0.00 177.00 175.53 1qh5 n SER 213 N -2.71 0.61 -4.21 6.66 3.41 -0.90 -4.86 113.62 111.63 1qh5 n SER 213 Ca 0.05 -0.60 -0.16 0.00 -0.26 0.00 0.00 58.87 57.91 1qh5 n SER 213 Cb 0.55 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.40 1qh5 n SER 213 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1qh5 s THR 214 N 0.92 1.11 0.23 6.66 -4.23 -1.26 -0.70 115.64 118.37 1qh5 s THR 214 Ca 0.00 -1.69 -0.07 0.00 -1.18 0.00 0.00 61.69 58.75 1qh5 s THR 214 Cb 0.00 -1.45 0.20 0.00 1.34 0.00 0.00 72.50 72.59 1qh5 s THR 214 CO 0.00 -0.51 1.86 -0.07 -0.54 0.00 0.00 174.62 175.36 1qh5 h LEU 215 N 3.51 0.85 -0.82 4.79 3.38 -1.39 -1.38 115.31 124.24 1qh5 h LEU 215 Ca -0.38 0.00 0.04 0.00 0.09 0.00 0.00 57.88 57.63 1qh5 h LEU 215 Cb 1.19 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.71 1qh5 h LEU 215 CO 0.52 0.57 0.52 0.00 0.09 0.00 0.00 178.44 180.14 1qh5 h ALA 216 N 1.36 1.09 -0.61 1.53 0.00 -1.60 -1.74 119.26 119.29 1qh5 h ALA 216 Ca 0.34 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.17 1qh5 h ALA 216 Cb 0.07 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1qh5 h ALA 216 CO -0.14 0.32 0.15 0.93 0.00 0.00 0.00 179.25 180.52 1qh5 h GLU 217 N 1.00 0.97 -0.78 0.00 5.08 -1.70 -2.84 114.58 116.31 1qh5 h GLU 217 Ca 0.33 -0.23 0.07 0.00 -1.00 0.00 0.00 59.36 58.53 1qh5 h GLU 217 Cb 0.05 -0.13 -0.05 0.00 0.50 0.00 0.00 28.75 29.12 1qh5 h GLU 217 CO -0.13 0.88 0.51 0.93 -1.00 0.00 0.00 179.01 180.21 1qh5 h GLU 218 N 0.88 0.80 0.00 2.33 4.39 -0.51 -0.34 114.58 122.13 1qh5 h GLU 218 Ca 0.19 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.84 1qh5 h GLU 218 Cb 0.35 -0.18 0.00 0.00 -0.10 0.00 0.00 28.75 28.82 1qh5 h GLU 218 CO 0.00 0.53 0.00 0.74 -1.16 0.00 0.00 179.01 179.12 1qh5 h PHE 219 N 0.82 0.00 0.00 4.33 0.04 -1.09 -1.30 116.94 119.74 1qh5 h PHE 219 Ca 0.34 0.00 -0.24 0.00 2.80 0.00 0.00 57.97 60.87 1qh5 h PHE 219 Cb 0.28 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.39 1qh5 h PHE 219 CO -0.00 0.00 -1.40 1.79 -0.60 0.00 0.00 178.31 178.10 1qh5 h THR 220 N 0.00 1.08 0.00 -1.55 1.35 -1.04 -3.44 112.91 109.31 1qh5 h THR 220 Ca 0.00 -2.83 0.00 0.00 -0.55 0.00 0.00 66.41 63.03 1qh5 h THR 220 Cb 0.32 2.51 0.00 0.00 -1.73 0.00 0.00 68.15 69.25 1qh5 h THR 220 CO 0.00 0.61 0.00 0.00 -0.25 0.00 0.00 175.52 175.88 1qh5 n TYR 221 N -3.13 0.00 -3.26 4.73 0.18 -1.13 -4.69 117.16 109.86 1qh5 n TYR 221 Ca -0.10 0.00 -0.42 0.00 1.88 0.00 0.00 57.90 59.26 1qh5 n TYR 221 Cb 0.98 0.00 -0.08 0.00 -0.38 0.00 0.00 39.34 39.86 1qh5 n TYR 221 CO 0.00 0.00 0.00 1.21 -2.08 0.00 0.00 176.86 175.99 1qh5 s ASN 222 N -0.17 6.28 0.40 9.48 3.84 -0.50 -4.89 114.94 129.39 1qh5 s ASN 222 Ca 0.00 -0.21 0.09 0.00 0.21 0.00 0.00 52.86 52.95 1qh5 s ASN 222 Cb 0.00 -2.26 0.88 0.00 -0.55 0.00 0.00 41.25 39.32 1qh5 s ASN 222 CO 0.00 -0.51 2.01 1.55 -2.79 0.00 0.00 177.10 177.35 1qh5 h PRO 223 N 8.56 0.55 -0.03 0.43 0.13 -1.88 -1.71 132.00 138.04 1qh5 h PRO 223 Ca -0.28 -0.03 -0.16 0.00 -0.87 0.00 0.00 66.00 64.66 1qh5 h PRO 223 Cb 1.12 -0.12 -0.01 0.00 0.13 0.00 0.00 31.00 32.11 1qh5 h PRO 223 CO 0.78 0.36 -0.70 0.74 -0.23 0.00 0.00 178.00 178.96 1qh5 h PHE 224 N 0.56 0.19 0.00 1.56 0.04 -1.91 -2.58 116.94 114.80 1qh5 h PHE 224 Ca 0.23 -0.09 0.00 0.00 2.80 0.00 0.00 57.97 60.92 1qh5 h PHE 224 Cb 0.21 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 38.33 1qh5 h PHE 224 CO -0.00 0.79 0.00 0.52 -0.60 0.00 0.00 178.31 179.02 1qh5 h MET 225 N 0.10 0.00 -0.60 1.51 2.86 -1.68 -3.29 114.93 113.82 1qh5 h MET 225 Ca -0.02 0.00 -0.20 0.00 -2.06 0.00 0.00 59.70 57.42 1qh5 h MET 225 Cb 1.24 0.00 -0.12 0.00 0.06 0.00 0.00 31.60 32.77 1qh5 h MET 225 CO 0.10 0.00 0.20 0.54 1.06 0.00 0.00 176.91 178.81 1qh5 n ARG 226 N -2.80 3.05 0.00 1.72 1.74 -0.72 -4.64 116.66 115.01 1qh5 n ARG 226 Ca 0.03 -3.06 0.06 0.00 -0.77 0.00 0.00 57.85 54.10 1qh5 n ARG 226 Cb 0.38 -2.07 0.25 0.00 -1.02 0.00 0.00 32.46 30.00 1qh5 n ARG 226 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 1qh5 n VAL 227 N -0.53 1.16 1.18 1.55 0.24 -1.17 -1.23 118.33 119.54 1qh5 n VAL 227 Ca 0.38 0.29 0.12 0.00 -2.04 0.00 0.00 64.34 63.09 1qh5 n VAL 227 Cb 1.26 -1.09 0.27 0.00 -1.47 0.00 0.00 33.84 32.80 1qh5 n VAL 227 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1qh5 n ARG 228 N -1.48 0.96 -2.84 7.34 1.74 -1.26 -4.20 116.66 116.92 1qh5 n ARG 228 Ca 0.03 -0.65 -0.41 0.00 -0.77 0.00 0.00 57.85 56.05 1qh5 n ARG 228 Cb 0.13 -1.49 -0.04 0.00 -1.02 0.00 0.00 32.46 30.05 1qh5 n ARG 228 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1qh5 s GLU 229 N -2.49 4.50 0.47 5.56 0.41 -0.36 -4.97 118.70 121.82 1qh5 s GLU 229 Ca 0.23 1.21 0.22 0.00 -0.41 0.00 0.00 54.97 56.22 1qh5 s GLU 229 Cb 0.19 -3.46 1.24 0.00 -1.78 0.00 0.00 34.13 30.32 1qh5 s GLU 229 CO 0.53 -0.03 1.90 0.87 -0.49 0.00 0.00 175.26 178.04 1qh5 h LYS 230 N 6.82 0.22 -0.47 1.61 1.57 -1.91 -1.83 116.57 122.57 1qh5 h LYS 230 Ca -0.40 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.34 1qh5 h LYS 230 Cb 1.21 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 33.45 1qh5 h LYS 230 CO 0.76 0.14 0.19 1.79 -0.57 0.00 0.00 179.45 181.76 1qh5 h THR 231 N 0.22 1.21 -0.42 -0.16 1.35 -1.93 0.14 112.91 113.32 1qh5 h THR 231 Ca 0.40 -0.63 -0.13 0.00 -0.55 0.00 0.00 66.41 65.50 1qh5 h THR 231 Cb 1.24 0.75 -0.01 0.00 -1.73 0.00 0.00 68.15 68.40 1qh5 h THR 231 CO -0.09 0.24 -0.24 0.58 -0.25 0.00 0.00 175.52 175.75 1qh5 h VAL 232 N 0.61 1.27 -0.40 6.82 2.07 -1.67 -1.17 116.25 123.79 1qh5 h VAL 232 Ca 0.16 -1.40 -0.01 0.00 0.82 0.00 0.00 66.70 66.27 1qh5 h VAL 232 Cb 0.19 1.26 -0.02 0.00 -1.52 0.00 0.00 31.29 31.20 1qh5 h VAL 232 CO -0.01 0.47 0.21 1.56 0.02 0.00 0.00 177.57 179.82 1qh5 h GLN 233 N 0.74 0.56 -0.46 1.57 4.20 -1.19 -1.35 115.11 119.18 1qh5 h GLN 233 Ca 0.09 -0.07 -0.05 0.00 0.06 0.00 0.00 58.65 58.68 1qh5 h GLN 233 Cb 0.82 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.47 1qh5 h GLN 233 CO 0.07 0.46 0.08 1.96 -0.67 0.00 0.00 178.83 180.73 1qh5 h GLN 234 N 0.51 0.71 -0.56 1.46 4.20 -0.62 0.33 115.11 121.14 1qh5 h GLN 234 Ca 0.14 -0.15 -0.02 0.00 0.06 0.00 0.00 58.65 58.68 1qh5 h GLN 234 Cb 0.07 -0.11 -0.03 0.00 0.30 0.00 0.00 27.48 27.72 1qh5 h GLN 234 CO -0.02 0.67 0.27 1.25 -0.67 0.00 0.00 178.83 180.33 1qh5 h HIS 235 N 0.68 0.81 0.00 2.96 2.76 -0.85 -2.78 115.15 118.74 1qh5 h HIS 235 Ca 0.15 -0.04 -0.02 0.00 -2.20 0.00 0.00 60.37 58.26 1qh5 h HIS 235 Cb 0.31 -0.25 -0.00 0.00 1.55 0.00 0.00 27.41 29.02 1qh5 h HIS 235 CO 0.02 0.62 -0.09 0.00 -1.30 0.00 0.00 177.93 177.18 1qh5 h ALA 236 N 1.11 0.97 -0.45 5.26 0.00 -0.71 -3.47 119.26 121.96 1qh5 h ALA 236 Ca 0.19 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1qh5 h ALA 236 Cb 0.11 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1qh5 h ALA 236 CO -0.02 0.11 -0.02 0.41 0.00 0.00 0.00 179.25 179.72 1qh5 n GLY 237 N 0.67 0.52 3.33 0.00 0.00 0.11 -5.01 105.19 104.81 1qh5 n GLY 237 Ca 0.02 -0.79 -0.17 0.00 0.00 0.00 0.00 46.02 45.08 1qh5 n GLY 237 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1qh5 s GLU 238 N -4.36 1.39 -0.08 1.61 0.41 -0.55 -5.03 118.70 112.09 1qh5 s GLU 238 Ca 0.01 -1.73 0.11 0.00 -0.41 0.00 0.00 54.97 52.95 1qh5 s GLU 238 Cb -0.00 -0.49 0.17 0.00 -1.78 0.00 0.00 34.13 32.03 1qh5 s GLU 238 CO 0.01 -0.19 1.09 0.25 -0.49 0.00 0.00 175.26 175.93 1qh5 n THR 239 N -0.46 1.08 -3.76 3.63 -2.24 -1.26 -4.31 114.28 106.97 1qh5 n THR 239 Ca -0.03 -1.32 -0.10 0.00 -2.27 0.00 0.00 64.05 60.32 1qh5 n THR 239 Cb 0.65 0.08 -0.07 0.00 -2.10 0.00 0.00 70.33 68.90 1qh5 n THR 239 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1qh5 s ASP 240 N -2.09 -0.08 0.32 3.42 -4.77 -1.26 -5.08 116.67 107.13 1qh5 s ASP 240 Ca 0.19 -0.36 0.02 0.00 -3.30 0.00 0.00 52.55 49.10 1qh5 s ASP 240 Cb 0.17 0.38 0.53 0.00 -1.09 0.00 0.00 42.92 42.90 1qh5 s ASP 240 CO 0.01 -0.70 1.86 -0.65 0.70 0.00 0.00 175.17 176.39 1qh5 h PRO 241 N 2.89 0.64 -0.03 2.11 0.11 -1.97 -2.59 132.00 133.17 1qh5 h PRO 241 Ca -0.33 -0.13 -0.01 0.00 0.11 0.00 0.00 66.00 65.64 1qh5 h PRO 241 Cb 1.21 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 1qh5 h PRO 241 CO 0.49 0.62 -0.03 0.28 -0.21 0.00 0.00 178.00 179.16 1qh5 h VAL 242 N 0.62 1.38 -0.54 3.15 2.07 -1.91 -0.49 116.25 120.53 1qh5 h VAL 242 Ca 0.14 -1.18 -0.05 0.00 0.82 0.00 0.00 66.70 66.43 1qh5 h VAL 242 Cb 0.30 2.12 -0.02 0.00 -1.52 0.00 0.00 31.29 32.17 1qh5 h VAL 242 CO 0.00 0.31 0.13 0.71 0.02 0.00 0.00 177.57 178.74 1qh5 h THR 243 N -0.40 1.23 0.05 2.57 1.35 -1.97 -1.45 112.91 114.29 1qh5 h THR 243 Ca 0.00 -0.82 -0.00 0.00 -0.55 0.00 0.00 66.41 65.04 1qh5 h THR 243 Cb 0.52 0.68 -0.00 0.00 -1.73 0.00 0.00 68.15 67.62 1qh5 h THR 243 CO 0.01 0.31 -0.04 0.74 -0.25 0.00 0.00 175.52 176.29 1qh5 h THR 244 N 0.80 0.92 -0.62 6.82 2.02 -1.48 -1.34 112.91 120.03 1qh5 h THR 244 Ca 0.17 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.42 1qh5 h THR 244 Cb 0.30 0.92 -0.06 0.00 -1.74 0.00 0.00 68.15 67.57 1qh5 h THR 244 CO -0.00 0.00 0.31 -0.03 0.37 0.00 0.00 175.52 176.17 1qh5 h MET 245 N -0.09 0.55 -0.65 6.66 -1.53 -0.84 0.57 114.93 119.61 1qh5 h MET 245 Ca -0.00 -0.03 0.01 0.00 -3.44 0.00 0.00 59.70 56.23 1qh5 h MET 245 Cb 0.08 -0.12 -0.03 0.00 -0.55 0.00 0.00 31.60 30.97 1qh5 h MET 245 CO 0.00 0.36 0.42 -0.09 0.14 0.00 0.00 176.91 177.75 1qh5 h ARG 246 N 0.57 0.85 -0.34 0.39 2.43 -1.12 -0.83 114.38 116.32 1qh5 h ARG 246 Ca 0.29 -0.05 -0.12 0.00 -0.81 0.00 0.00 59.98 59.29 1qh5 h ARG 246 Cb 0.25 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 1qh5 h ARG 246 CO -0.22 0.57 -0.24 0.00 -1.51 0.00 0.00 179.97 178.57 1qh5 h ALA 247 N 1.23 0.49 -0.24 2.80 0.00 -0.74 -2.10 119.26 120.70 1qh5 h ALA 247 Ca 0.24 -0.38 -0.12 0.00 0.00 0.00 0.00 54.91 54.64 1qh5 h ALA 247 Cb -0.09 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1qh5 h ALA 247 CO -0.05 0.47 -0.35 0.28 0.00 0.00 0.00 179.25 179.60 1qh5 h VAL 248 N 0.54 1.29 -0.28 0.00 2.07 -0.70 -1.32 116.25 117.84 1qh5 h VAL 248 Ca 0.07 -1.46 -0.17 0.00 0.82 0.00 0.00 66.70 65.95 1qh5 h VAL 248 Cb 0.80 1.49 -0.00 0.00 -1.52 0.00 0.00 31.29 32.06 1qh5 h VAL 248 CO 0.06 0.46 -0.50 -0.09 0.02 0.00 0.00 177.57 177.53 1qh5 h ARG 249 N 0.43 0.78 -0.76 1.57 9.65 -1.10 -1.22 114.38 123.73 1qh5 h ARG 249 Ca 0.05 -0.47 -0.05 0.00 -1.10 0.00 0.00 59.98 58.41 1qh5 h ARG 249 Cb 0.82 0.04 -0.03 0.00 -1.39 0.00 0.00 29.97 29.40 1qh5 h ARG 249 CO 0.07 1.10 0.27 0.00 2.80 0.00 0.00 179.97 184.20 1qh5 h ARG 250 N 0.62 1.16 -0.11 0.20 3.08 -1.22 -2.09 114.38 116.03 1qh5 h ARG 250 Ca 0.03 -0.23 -0.01 0.00 0.07 0.00 0.00 59.98 59.84 1qh5 h ARG 250 Cb 1.08 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 30.94 1qh5 h ARG 250 CO 0.11 0.97 0.05 1.49 -1.07 0.00 0.00 179.97 181.51 1qh5 h GLU 251 N 1.12 0.16 -0.69 0.04 4.81 -1.05 -2.98 114.58 115.99 1qh5 h GLU 251 Ca 0.25 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.45 1qh5 h GLU 251 Cb 0.26 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.58 1qh5 h GLU 251 CO -0.01 0.25 0.42 -0.22 -0.73 0.00 0.00 179.01 178.71 1qh5 h LYS 252 N 0.03 0.93 -0.14 1.92 3.64 -1.10 -1.79 116.57 120.05 1qh5 h LYS 252 Ca 0.04 -0.08 0.04 0.00 -1.27 0.00 0.00 60.65 59.38 1qh5 h LYS 252 Cb 0.15 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 31.76 1qh5 h LYS 252 CO -0.00 0.65 0.10 -0.44 -2.27 0.00 0.00 179.45 177.48 1qh5 h ASP 253 N 0.95 0.02 -0.02 4.20 3.32 -1.23 -2.40 116.42 121.26 1qh5 h ASP 253 Ca 0.25 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.30 1qh5 h ASP 253 Cb -0.05 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.50 1qh5 h ASP 253 CO -0.05 0.01 -0.02 0.00 -1.72 0.00 0.00 179.24 177.47 1qh5 n GLN 254 N -4.50 1.78 -2.20 3.56 6.02 -0.75 -5.03 117.38 116.25 1qh5 n GLN 254 Ca 0.00 -1.66 -0.42 0.00 -0.01 0.00 0.00 57.00 54.91 1qh5 n GLN 254 Cb 0.21 -1.38 -0.03 0.00 1.02 0.00 0.00 30.24 30.06 1qh5 n GLN 254 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 177.06 176.17 1qh5 s PHE 255 N -1.69 3.26 -0.26 1.08 5.36 -0.77 -5.01 117.98 119.95 1qh5 s PHE 255 Ca 0.23 1.05 -0.18 0.00 -0.96 0.00 0.00 56.93 57.07 1qh5 s PHE 255 Cb 0.17 -3.64 -0.03 0.00 -0.34 0.00 0.00 43.02 39.18 1qh5 s PHE 255 CO 0.26 -2.16 0.51 0.21 -1.46 0.00 0.00 175.22 172.58 1qh5 s LYS 256 N 0.78 4.06 0.05 10.12 2.20 -1.26 -5.02 119.74 130.66 1qh5 s LYS 256 Ca 0.62 0.30 -0.31 0.00 -0.36 0.00 0.00 55.97 56.23 1qh5 s LYS 256 Cb -0.36 -3.66 -0.07 0.00 -1.51 0.00 0.00 37.83 32.23 1qh5 s LYS 256 CO 0.32 -0.36 1.55 -1.64 -0.36 0.00 0.00 175.35 174.87 1qh5 s MET 257 N 2.31 4.23 0.83 4.03 -1.94 -1.26 -5.01 119.30 122.49 1qh5 s MET 257 Ca 0.21 2.20 -0.11 0.00 -1.71 0.00 0.00 55.69 56.28 1qh5 s MET 257 Cb -0.16 -3.56 0.09 0.00 2.01 0.00 0.00 34.83 33.22 1qh5 s MET 257 CO 0.09 -0.66 1.12 -2.14 -0.01 0.00 0.00 175.02 173.42 1qh5 s PRO 258 N 2.43 1.74 0.00 2.03 0.02 -1.26 -4.95 135.00 135.01 1qh5 s PRO 258 Ca 0.70 1.36 0.15 0.00 0.02 0.00 0.00 61.00 63.23 1qh5 s PRO 258 Cb -0.37 -1.82 0.49 0.00 0.02 0.00 0.00 34.50 32.82 1qh5 s PRO 258 CO 0.30 -2.06 1.38 -2.13 -0.33 0.00 0.00 177.00 174.16 1qh5 n ARG 259 N -3.77 1.81 0.00 5.54 3.00 -1.26 -5.13 116.66 116.85 1qh5 n ARG 259 Ca 0.10 -1.24 0.00 0.00 -0.00 0.00 0.00 57.85 56.71 1qh5 n ARG 259 Cb 0.52 -1.33 0.00 0.00 0.00 0.00 0.00 32.46 31.65 1qh5 n ARG 259 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38