#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hqd n ASP 2 N 0.00 0.00 -0.87 0.00 5.68 -1.13 -5.04 116.55 115.19 1hqd n ASP 2 Ca 0.00 -0.00 0.02 0.00 -0.50 0.00 0.00 54.79 54.30 1hqd n ASP 2 Cb 0.00 0.00 0.17 0.00 -1.14 0.00 0.00 41.12 40.15 1hqd n ASP 2 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1hqd n ASN 3 N -0.00 2.12 -0.25 -1.12 3.02 -1.24 -1.37 115.26 116.42 1hqd n ASN 3 Ca 0.00 -3.76 0.08 0.00 -0.03 0.00 0.00 54.58 50.86 1hqd n ASN 3 Cb 0.00 -0.49 0.33 0.00 -0.61 0.00 0.00 39.78 39.01 1hqd n ASN 3 CO 0.00 0.00 0.00 0.22 -2.62 0.00 0.00 177.26 174.86 1hqd h TYR 4 N 1.18 0.87 -0.39 3.10 3.20 -1.84 -1.81 116.97 121.29 1hqd h TYR 4 Ca 0.04 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 61.86 1hqd h TYR 4 Cb 1.13 -0.28 -0.04 0.00 1.54 0.00 0.00 36.73 39.08 1hqd h TYR 4 CO 0.74 0.41 0.04 0.00 -1.64 0.00 0.00 178.16 177.71 1hqd n ALA 5 N -2.43 3.57 -2.39 1.82 0.00 0.08 -4.01 120.51 117.15 1hqd n ALA 5 Ca 0.14 -2.41 -0.38 0.00 0.00 0.00 0.00 53.44 50.78 1hqd n ALA 5 Cb 0.31 -0.85 -0.03 0.00 0.00 0.00 0.00 19.45 18.87 1hqd n ALA 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1hqd s ALA 6 N -2.92 2.48 0.41 0.00 0.00 -0.68 -3.79 121.76 117.25 1hqd s ALA 6 Ca 0.46 -1.52 -0.06 0.00 0.00 0.00 0.00 51.96 50.84 1hqd s ALA 6 Cb 0.38 -4.39 -0.05 0.00 0.00 0.00 0.00 23.12 19.06 1hqd s ALA 6 CO 0.09 -3.72 0.72 0.95 0.00 0.00 0.00 175.76 173.80 1hqd s THR 7 N 6.75 4.91 0.06 0.00 -4.23 -1.26 -4.77 115.64 117.10 1hqd s THR 7 Ca 0.49 0.23 -0.23 0.00 -1.18 0.00 0.00 61.69 61.01 1hqd s THR 7 Cb -0.06 -3.80 -0.14 0.00 1.34 0.00 0.00 72.50 69.83 1hqd s THR 7 CO 0.06 -0.64 1.55 -0.09 -0.54 0.00 0.00 174.62 174.96 1hqd h ARG 8 N 0.82 0.13 -5.87 3.99 2.43 -1.57 -3.44 114.38 110.86 1hqd h ARG 8 Ca -0.47 -0.03 -0.65 0.00 -0.81 0.00 0.00 59.98 58.02 1hqd h ARG 8 Cb 1.20 -0.02 -0.07 0.00 -0.42 0.00 0.00 29.97 30.66 1hqd h ARG 8 CO 0.63 0.31 -0.52 0.71 -1.51 0.00 0.00 179.97 179.58 1hqd s TYR 9 N -5.32 3.45 0.44 2.20 2.02 -1.26 -5.06 117.35 113.82 1hqd s TYR 9 Ca -0.14 0.31 -0.23 0.00 -0.37 0.00 0.00 57.07 56.63 1hqd s TYR 9 Cb 0.05 -1.80 -0.10 0.00 -0.40 0.00 0.00 41.96 39.71 1hqd s TYR 9 CO 0.69 0.62 0.97 -2.30 -1.57 0.00 0.00 175.55 173.96 1hqd n PRO 10 N 1.09 1.25 -3.82 -1.71 -0.02 -1.25 -4.46 135.00 126.08 1hqd n PRO 10 Ca -0.12 0.45 -0.36 0.00 -2.02 0.00 0.00 63.50 61.45 1hqd n PRO 10 Cb 0.53 -2.02 -0.07 0.00 -0.02 0.00 0.00 33.50 31.92 1hqd n PRO 10 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1hqd s ILE 11 N -1.32 5.46 -0.14 4.25 1.01 0.52 -0.54 121.20 130.44 1hqd s ILE 11 Ca 0.65 0.22 0.00 0.00 0.00 0.00 0.00 60.65 61.52 1hqd s ILE 11 Cb -0.54 -3.43 0.02 0.00 0.01 0.00 0.00 42.46 38.52 1hqd s ILE 11 CO 0.56 0.56 -0.13 -0.63 0.00 0.00 0.00 174.94 175.30 1hqd s ILE 12 N -0.57 1.46 0.01 2.92 1.01 -0.45 -0.32 121.20 125.25 1hqd s ILE 12 Ca 0.13 -0.57 -0.21 0.00 0.00 0.00 0.00 60.65 60.01 1hqd s ILE 12 Cb -0.12 -1.39 -0.06 0.00 0.01 0.00 0.00 42.46 40.91 1hqd s ILE 12 CO 0.02 0.44 0.60 -0.76 0.00 0.00 0.00 174.94 175.25 1hqd s LEU 13 N 1.51 4.43 -0.25 2.97 1.43 -0.65 -1.34 118.68 126.78 1hqd s LEU 13 Ca 0.05 1.19 0.02 0.00 -1.03 0.00 0.00 54.13 54.36 1hqd s LEU 13 Cb -0.13 -2.94 0.06 0.00 0.03 0.00 0.00 46.19 43.21 1hqd s LEU 13 CO -0.10 0.12 -0.08 -0.69 0.23 0.00 0.00 176.35 175.83 1hqd s VAL 14 N -0.30 1.83 0.89 -1.59 1.01 0.29 -1.97 120.40 120.56 1hqd s VAL 14 Ca 0.31 -1.42 -0.12 0.00 0.00 0.00 0.00 61.98 60.75 1hqd s VAL 14 Cb -0.19 -2.03 0.13 0.00 0.00 0.00 0.00 36.38 34.29 1hqd s VAL 14 CO 0.18 -0.07 1.09 -1.38 0.00 0.00 0.00 175.10 174.92 1hqd s HIS 15 N 1.26 2.34 0.00 5.22 -3.43 -1.26 -1.08 115.29 118.34 1hqd s HIS 15 Ca -0.07 1.24 0.00 0.00 -0.80 0.00 0.00 55.06 55.43 1hqd s HIS 15 Cb -0.19 -3.16 0.00 0.00 -1.43 0.00 0.00 32.58 27.79 1hqd s HIS 15 CO -0.06 -2.37 0.00 0.41 -2.00 0.00 0.00 174.74 170.73 1hqd n GLY 16 N -1.19 2.45 3.76 -1.38 0.00 -1.15 -3.24 105.19 104.44 1hqd n GLY 16 Ca 0.07 -2.00 -0.40 0.00 0.00 0.00 0.00 46.02 43.69 1hqd n GLY 16 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1hqd n LEU 17 N 0.00 5.05 0.00 0.99 0.00 -1.26 -1.78 117.00 120.00 1hqd n LEU 17 Ca 0.00 1.13 0.00 0.00 0.00 0.00 0.00 56.01 57.14 1hqd n LEU 17 Cb 0.00 -1.60 0.00 0.00 0.00 0.00 0.00 43.42 41.82 1hqd n LEU 17 CO 0.00 -0.14 0.00 0.35 0.00 0.00 0.00 177.39 177.60 1hqd n THR 18 N -0.14 0.00 -1.61 1.96 -2.24 0.14 -4.99 114.28 107.39 1hqd n THR 18 Ca 0.05 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.53 1hqd n THR 18 Cb 0.41 0.00 0.17 0.00 -2.10 0.00 0.00 70.33 68.81 1hqd n THR 18 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1hqd s GLY 19 N -1.81 1.65 -0.01 3.38 0.00 -0.73 -4.86 107.32 104.94 1hqd s GLY 19 Ca 0.00 -0.88 -0.30 0.00 0.00 0.00 0.00 44.72 43.54 1hqd s GLY 19 CO 0.00 -0.18 1.10 -1.08 0.00 0.00 0.00 173.10 172.94 1hqd s THR 20 N -3.47 0.00 0.25 0.90 -1.32 -1.26 -3.54 115.64 107.20 1hqd s THR 20 Ca 0.69 -0.23 -0.04 0.00 -1.21 0.00 0.00 61.69 60.91 1hqd s THR 20 Cb -0.09 -1.53 0.13 0.00 -1.51 0.00 0.00 72.50 69.49 1hqd s THR 20 CO 0.53 0.00 1.77 -2.24 -2.21 0.00 0.00 174.62 172.47 1hqd h ASP 21 N 2.00 0.86 -2.65 8.08 2.03 -1.90 -3.38 116.42 121.47 1hqd h ASP 21 Ca -0.22 -0.19 -0.39 0.00 -0.73 0.00 0.00 57.03 55.50 1hqd h ASP 21 Cb 1.21 -0.23 -0.37 0.00 -0.83 0.00 0.00 39.33 39.11 1hqd h ASP 21 CO 0.27 0.87 -0.69 -0.75 -1.03 0.00 0.00 179.24 177.91 1hqd s LYS 22 N -5.15 0.18 0.06 4.15 2.20 -1.26 -2.27 119.74 117.65 1hqd s LYS 22 Ca -0.10 -0.06 -0.34 0.00 -0.36 0.00 0.00 55.97 55.11 1hqd s LYS 22 Cb 0.15 -1.27 -0.14 0.00 -1.51 0.00 0.00 37.83 35.06 1hqd s LYS 22 CO 0.82 -0.78 1.65 0.66 -0.36 0.00 0.00 175.35 177.34 1hqd n TYR 23 N 5.30 2.21 -2.31 4.03 4.01 0.33 -0.20 117.16 130.53 1hqd n TYR 23 Ca -0.05 0.23 -0.11 0.00 -0.16 0.00 0.00 57.90 57.81 1hqd n TYR 23 Cb 0.48 -2.56 -0.01 0.00 -0.31 0.00 0.00 39.34 36.94 1hqd n TYR 23 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1hqd n ALA 24 N 4.38 -0.73 -0.93 -0.72 0.00 0.07 0.75 120.51 123.33 1hqd n ALA 24 Ca 0.19 0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.73 1hqd n ALA 24 Cb 0.27 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.39 1hqd n ALA 24 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hqd n GLY 25 N -0.69 0.04 0.66 0.00 0.00 0.72 -4.75 105.19 101.17 1hqd n GLY 25 Ca -0.12 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.87 1hqd n GLY 25 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1hqd n VAL 26 N -2.06 1.08 -3.01 1.61 0.31 0.23 -5.00 118.33 111.49 1hqd n VAL 26 Ca 0.00 0.28 -0.42 0.00 -0.01 0.00 0.00 64.34 64.19 1hqd n VAL 26 Cb 0.40 -1.75 -0.06 0.00 -0.91 0.00 0.00 33.84 31.52 1hqd n VAL 26 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 1hqd s LEU 27 N -6.89 4.14 0.17 7.52 2.96 -0.59 -4.83 118.68 121.16 1hqd s LEU 27 Ca -0.09 0.42 -0.30 0.00 -0.22 0.00 0.00 54.13 53.93 1hqd s LEU 27 Cb 0.01 -2.96 -0.08 0.00 0.50 0.00 0.00 46.19 43.66 1hqd s LEU 27 CO 0.13 -0.63 1.22 -1.83 -1.32 0.00 0.00 176.35 173.93 1hqd s GLU 28 N 2.91 4.46 0.12 1.98 -1.05 -1.26 0.12 118.70 125.98 1hqd s GLU 28 Ca 0.29 1.89 -0.21 0.00 -0.15 0.00 0.00 54.97 56.80 1hqd s GLU 28 Cb -0.14 -3.25 -0.05 0.00 -0.44 0.00 0.00 34.13 30.25 1hqd s GLU 28 CO 0.14 -0.15 1.71 -0.92 0.95 0.00 0.00 175.26 177.00 1hqd h TYR 29 N 5.56 -0.09 -1.84 4.83 5.03 -1.63 -3.07 116.97 125.77 1hqd h TYR 29 Ca -0.44 0.01 -0.76 0.00 2.58 0.00 0.00 58.73 60.13 1hqd h TYR 29 Cb 1.21 0.06 -0.18 0.00 1.55 0.00 0.00 36.73 39.38 1hqd h TYR 29 CO 0.63 -0.07 1.66 0.91 -1.32 0.00 0.00 178.16 179.97 1hqd n TRP 30 N -5.18 3.53 -1.37 -3.82 7.02 -1.26 -4.89 117.44 111.47 1hqd n TRP 30 Ca -0.03 -2.97 -0.54 0.00 -1.02 0.00 0.00 57.50 52.94 1hqd n TRP 30 Cb 0.11 -1.94 -0.09 0.00 -2.42 0.00 0.00 31.31 26.97 1hqd n TRP 30 CO 0.00 0.00 0.00 0.98 -2.02 0.00 0.00 177.69 176.65 1hqd n TYR 31 N 4.05 1.40 -0.68 -5.99 9.36 -1.16 -1.51 117.16 122.62 1hqd n TYR 31 Ca 0.37 0.46 0.00 0.00 3.32 0.00 0.00 57.90 62.05 1hqd n TYR 31 Cb 0.38 -2.44 0.00 0.00 -0.63 0.00 0.00 39.34 36.65 1hqd n TYR 31 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1hqd n GLY 32 N 6.90 0.41 0.18 2.98 0.00 -1.26 -4.76 105.19 109.65 1hqd n GLY 32 Ca 0.47 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.31 1hqd n GLY 32 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1hqd h ILE 33 N 0.00 1.33 -0.55 -0.61 2.04 -1.65 -2.38 117.51 115.70 1hqd h ILE 33 Ca 0.00 -2.03 -0.09 0.00 1.00 0.00 0.00 64.86 63.73 1hqd h ILE 33 Cb 0.00 2.28 -0.02 0.00 -0.74 0.00 0.00 36.82 38.34 1hqd h ILE 33 CO 0.00 0.62 -0.03 -0.61 0.00 0.00 0.00 178.15 178.13 1hqd h GLN 34 N 0.25 0.97 -0.20 2.37 4.15 -1.90 -1.13 115.11 119.61 1hqd h GLN 34 Ca -0.07 -0.30 -0.01 0.00 0.77 0.00 0.00 58.65 59.03 1hqd h GLN 34 Cb 1.40 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 29.00 1hqd h GLN 34 CO 0.15 0.97 0.09 0.93 -1.93 0.00 0.00 178.83 179.04 1hqd h GLU 35 N 0.88 0.30 0.07 1.69 3.07 -1.91 -1.90 114.58 116.79 1hqd h GLU 35 Ca 0.16 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.97 1hqd h GLU 35 Cb 0.56 -0.05 -0.00 0.00 -0.84 0.00 0.00 28.75 28.41 1hqd h GLU 35 CO 0.03 0.35 -0.05 0.22 -1.40 0.00 0.00 179.01 178.15 1hqd h ASP 36 N 0.19 -0.14 -0.77 1.42 3.58 -1.24 -1.72 116.42 117.74 1hqd h ASP 36 Ca 0.07 0.01 0.03 0.00 0.42 0.00 0.00 57.03 57.56 1hqd h ASP 36 Cb 0.15 0.05 -0.05 0.00 1.72 0.00 0.00 39.33 41.20 1hqd h ASP 36 CO -0.01 -0.09 0.49 -0.07 -2.88 0.00 0.00 179.24 176.69 1hqd h LEU 37 N -0.13 0.82 -0.97 2.28 3.38 -1.16 -2.35 115.31 117.17 1hqd h LEU 37 Ca -0.00 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 1hqd h LEU 37 Cb 0.12 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 1hqd h LEU 37 CO -0.00 0.57 -0.11 1.56 0.09 0.00 0.00 178.44 180.54 1hqd h GLN 38 N 0.97 0.62 0.00 1.13 4.20 -1.20 -1.55 115.11 119.28 1hqd h GLN 38 Ca 0.30 -0.19 -0.03 0.00 0.06 0.00 0.00 58.65 58.80 1hqd h GLN 38 Cb -0.01 -0.06 -0.00 0.00 0.30 0.00 0.00 27.48 27.70 1hqd h GLN 38 CO -0.10 0.72 -0.13 0.37 -0.67 0.00 0.00 178.83 179.02 1hqd h GLN 39 N 0.57 0.00 -0.73 1.46 4.15 -0.80 -1.75 115.11 118.01 1hqd h GLN 39 Ca 0.10 0.00 -0.12 0.00 0.77 0.00 0.00 58.65 59.41 1hqd h GLN 39 Cb 0.53 0.00 -0.07 0.00 0.21 0.00 0.00 27.48 28.15 1hqd h GLN 39 CO 0.03 0.13 0.15 0.54 -1.93 0.00 0.00 178.83 177.74 1hqd n ARG 40 N -3.67 3.82 -0.87 1.69 5.12 -0.75 -2.85 116.66 119.14 1hqd n ARG 40 Ca -0.02 -2.71 0.00 0.00 -1.93 0.00 0.00 57.85 53.19 1hqd n ARG 40 Cb 0.24 -2.14 0.00 0.00 -1.16 0.00 0.00 32.46 29.41 1hqd n ARG 40 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1hqd n GLY 41 N 0.17 0.53 3.88 -0.13 0.00 -0.47 -0.74 105.19 108.43 1hqd n GLY 41 Ca 0.31 -0.26 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 1hqd n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hqd s ALA 42 N -2.00 3.75 -0.42 4.61 0.00 -0.66 -4.05 121.76 122.99 1hqd s ALA 42 Ca 0.00 -0.46 -0.18 0.00 0.00 0.00 0.00 51.96 51.32 1hqd s ALA 42 Cb 0.00 -2.21 0.02 0.00 0.00 0.00 0.00 23.12 20.93 1hqd s ALA 42 CO 0.00 0.61 0.48 0.99 0.00 0.00 0.00 175.76 177.84 1hqd s THR 43 N -1.55 5.04 -0.02 0.00 2.01 -1.26 -4.07 115.64 115.80 1hqd s THR 43 Ca 0.38 -0.24 0.07 0.00 0.31 0.00 0.00 61.69 62.21 1hqd s THR 43 Cb -0.13 -4.06 -0.02 0.00 0.01 0.00 0.00 72.50 68.30 1hqd s THR 43 CO 0.21 -0.45 -0.24 -0.69 -0.69 0.00 0.00 174.62 172.77 1hqd s VAL 44 N 2.27 1.89 0.02 3.82 1.01 -1.26 -0.35 120.40 127.79 1hqd s VAL 44 Ca 0.14 -1.03 0.05 0.00 0.00 0.00 0.00 61.98 61.13 1hqd s VAL 44 Cb -0.16 -1.57 -0.02 0.00 0.00 0.00 0.00 36.38 34.63 1hqd s VAL 44 CO 0.15 0.52 -0.14 -0.31 0.00 0.00 0.00 175.10 175.32 1hqd s TYR 45 N -0.57 1.25 -0.25 5.22 1.51 0.56 -4.96 117.35 120.11 1hqd s TYR 45 Ca 0.09 -0.30 -0.03 0.00 -1.01 0.00 0.00 57.07 55.82 1hqd s TYR 45 Cb -0.09 -0.77 0.02 0.00 -0.11 0.00 0.00 41.96 41.01 1hqd s TYR 45 CO -0.01 0.01 -0.03 0.08 -1.11 0.00 0.00 175.55 174.49 1hqd s VAL 46 N -0.61 3.13 0.46 0.71 1.01 -1.26 -1.64 120.40 122.20 1hqd s VAL 46 Ca 0.03 -0.91 -0.24 0.00 0.00 0.00 0.00 61.98 60.87 1hqd s VAL 46 Cb -0.07 -2.58 -0.07 0.00 0.00 0.00 0.00 36.38 33.66 1hqd s VAL 46 CO 0.00 0.20 1.27 0.00 0.00 0.00 0.00 175.10 176.57 1hqd s ALA 47 N 1.37 3.06 -0.46 5.51 0.00 -0.83 -4.87 121.76 125.53 1hqd s ALA 47 Ca 0.01 1.15 0.04 0.00 0.00 0.00 0.00 51.96 53.16 1hqd s ALA 47 Cb -0.16 -3.47 0.12 0.00 0.00 0.00 0.00 23.12 19.61 1hqd s ALA 47 CO -0.03 -0.90 0.21 1.21 0.00 0.00 0.00 175.76 176.25 1hqd s ASN 48 N -1.00 4.29 0.44 0.00 3.04 -1.26 -3.78 114.94 116.67 1hqd s ASN 48 Ca 0.63 -2.73 0.07 0.00 0.04 0.00 0.00 52.86 50.87 1hqd s ASN 48 Cb -0.35 -1.51 -0.03 0.00 -1.54 0.00 0.00 41.25 37.82 1hqd s ASN 48 CO 0.44 -0.27 0.27 -0.76 -3.04 0.00 0.00 177.10 173.73 1hqd s LEU 49 N 0.13 3.08 0.19 3.21 1.43 -1.26 -4.94 118.68 120.51 1hqd s LEU 49 Ca 0.16 -1.05 -0.33 0.00 -1.03 0.00 0.00 54.13 51.88 1hqd s LEU 49 Cb -0.24 -1.52 -0.13 0.00 0.03 0.00 0.00 46.19 44.33 1hqd s LEU 49 CO -0.03 -0.69 1.68 -1.20 0.23 0.00 0.00 176.35 176.35 1hqd n SER 50 N -1.42 3.70 0.26 2.29 7.64 -1.26 -4.64 113.62 120.20 1hqd n SER 50 Ca -0.01 1.07 0.16 0.00 1.01 0.00 0.00 58.87 61.10 1hqd n SER 50 Cb 0.64 -1.52 0.58 0.00 -1.01 0.00 0.00 64.21 62.89 1hqd n SER 50 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 1hqd h GLY 51 N 6.56 0.00 -7.09 0.23 0.00 -1.84 -3.40 103.07 97.52 1hqd h GLY 51 Ca -0.44 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.38 1hqd h GLY 51 CO 0.93 0.00 -0.76 -1.36 0.00 0.00 0.00 176.54 175.35 1hqd s PHE 52 N -3.59 0.77 -0.01 5.60 0.08 -1.26 0.24 117.98 119.81 1hqd s PHE 52 Ca 0.02 -0.86 -0.30 0.00 0.12 0.00 0.00 56.93 55.91 1hqd s PHE 52 Cb 0.08 -1.02 0.12 0.00 -0.57 0.00 0.00 43.02 41.63 1hqd s PHE 52 CO 0.57 -0.67 1.28 -0.65 -0.10 0.00 0.00 175.22 175.65 1hqd s GLN 53 N 1.94 0.42 0.83 0.44 -1.52 -1.26 0.10 119.66 120.62 1hqd s GLN 53 Ca 0.04 -0.23 -0.09 0.00 -1.95 0.00 0.00 55.36 53.12 1hqd s GLN 53 Cb -0.17 0.14 0.15 0.00 -0.22 0.00 0.00 33.01 32.91 1hqd s GLN 53 CO -0.17 -0.19 1.16 -1.54 -0.25 0.00 0.00 175.29 174.30 1hqd s SER 54 N -3.03 3.87 -0.15 5.90 1.04 -1.26 -4.24 113.70 115.83 1hqd s SER 54 Ca 0.15 0.12 0.04 0.00 0.48 0.00 0.00 55.95 56.74 1hqd s SER 54 Cb 0.04 -0.40 -0.23 0.00 0.10 0.00 0.00 66.02 65.53 1hqd s SER 54 CO -0.04 -2.22 0.25 0.47 0.98 0.00 0.00 173.24 172.69 1hqd n ASP 55 N -3.30 1.47 -4.85 7.02 8.00 -1.26 -1.19 116.55 122.43 1hqd n ASP 55 Ca 0.14 0.15 -0.22 0.00 0.71 0.00 0.00 54.79 55.57 1hqd n ASP 55 Cb 0.60 -0.28 0.09 0.00 -0.02 0.00 0.00 41.12 41.51 1hqd n ASP 55 CO 0.00 0.00 0.00 1.51 -0.39 0.00 0.00 177.20 178.32 1hqd s ASP 56 N -6.45 4.70 0.00 -2.24 -4.77 -1.26 0.59 116.67 107.24 1hqd s ASP 56 Ca -0.19 -0.65 0.00 0.00 -3.30 0.00 0.00 52.55 48.41 1hqd s ASP 56 Cb 0.07 0.21 0.00 0.00 -1.09 0.00 0.00 42.92 42.11 1hqd s ASP 56 CO 0.75 -1.63 0.00 0.61 0.70 0.00 0.00 175.17 175.61 1hqd n GLY 57 N -2.54 2.13 0.35 2.12 0.00 -1.26 -3.84 105.19 102.14 1hqd n GLY 57 Ca 0.16 -1.86 0.06 0.00 0.00 0.00 0.00 46.02 44.38 1hqd n GLY 57 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1hqd h PRO 58 N 0.00 0.90 -0.64 1.61 0.11 -2.01 -2.25 132.00 129.72 1hqd h PRO 58 Ca 0.00 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.06 1hqd h PRO 58 Cb 0.00 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 30.91 1hqd h PRO 58 CO 0.00 0.60 0.00 0.09 -0.21 0.00 0.00 178.00 178.48 1hqd n ASN 59 N -4.66 3.75 -4.55 -2.05 5.03 -1.26 -4.89 115.26 106.63 1hqd n ASN 59 Ca 0.17 -2.02 -0.29 0.00 0.87 0.00 0.00 54.58 53.31 1hqd n ASN 59 Cb 0.34 -0.43 0.18 0.00 -1.02 0.00 0.00 39.78 38.85 1hqd n ASN 59 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 1hqd s GLY 60 N -1.00 1.57 0.39 7.41 0.00 -0.85 -4.89 107.32 109.95 1hqd s GLY 60 Ca 0.43 -0.52 0.17 0.00 0.00 0.00 0.00 44.72 44.80 1hqd s GLY 60 CO 0.29 0.14 1.81 3.21 0.00 0.00 0.00 173.10 178.54 1hqd h ARG 61 N -1.96 0.00 0.10 2.90 3.08 -1.12 -3.11 114.38 114.27 1hqd h ARG 61 Ca -0.53 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 59.52 1hqd h ARG 61 Cb 1.33 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.37 1hqd h ARG 61 CO 0.54 0.36 -0.07 0.78 -1.07 0.00 0.00 179.97 180.51 1hqd h GLY 62 N 1.50 -0.17 1.87 0.04 0.00 -0.08 0.92 103.07 107.15 1hqd h GLY 62 Ca -0.00 0.08 -0.08 0.00 0.00 0.00 0.00 47.33 47.33 1hqd h GLY 62 CO 0.05 -0.08 -0.30 0.83 0.00 0.00 0.00 176.54 177.04 1hqd h GLU 63 N -0.18 0.15 -0.12 4.80 4.39 -1.73 -0.95 114.58 120.94 1hqd h GLU 63 Ca -0.00 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.63 1hqd h GLU 63 Cb 0.16 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.79 1hqd h GLU 63 CO -0.00 0.45 0.04 1.96 -1.16 0.00 0.00 179.01 180.29 1hqd h GLN 64 N 0.14 0.20 -0.75 2.33 4.20 -1.39 -2.04 115.11 117.80 1hqd h GLN 64 Ca 0.02 -0.04 -0.04 0.00 0.06 0.00 0.00 58.65 58.64 1hqd h GLN 64 Cb 0.61 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.33 1hqd h GLN 64 CO 0.04 0.34 0.30 1.25 -0.67 0.00 0.00 178.83 180.10 1hqd h LEU 65 N 0.01 1.04 -0.26 1.46 5.85 -0.52 -1.65 115.31 121.24 1hqd h LEU 65 Ca 0.04 -0.17 0.03 0.00 0.84 0.00 0.00 57.88 58.62 1hqd h LEU 65 Cb 0.23 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 40.96 1hqd h LEU 65 CO -0.00 0.93 0.06 0.25 -0.34 0.00 0.00 178.44 179.33 1hqd h LEU 66 N 1.08 0.02 -0.90 2.25 6.46 -1.05 0.33 115.31 123.50 1hqd h LEU 66 Ca 0.25 0.04 -0.02 0.00 -0.12 0.00 0.00 57.88 58.03 1hqd h LEU 66 Cb 0.22 0.05 -0.04 0.00 -0.73 0.00 0.00 40.66 40.16 1hqd h LEU 66 CO -0.02 0.05 0.45 0.00 -0.62 0.00 0.00 178.44 178.30 1hqd h ALA 67 N 1.19 1.15 -0.41 1.25 0.00 -1.15 -1.90 119.26 119.38 1hqd h ALA 67 Ca 0.12 -0.15 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 1hqd h ALA 67 Cb 0.12 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 1hqd h ALA 67 CO -0.15 0.66 -0.10 -0.92 0.00 0.00 0.00 179.25 178.74 1hqd h TYR 68 N 1.23 0.89 -0.70 0.00 3.20 -0.62 -2.59 116.97 118.38 1hqd h TYR 68 Ca 0.30 -0.19 0.07 0.00 3.14 0.00 0.00 58.73 62.05 1hqd h TYR 68 Cb 0.07 -0.22 -0.06 0.00 1.54 0.00 0.00 36.73 38.06 1hqd h TYR 68 CO 0.01 0.91 0.38 0.28 -1.64 0.00 0.00 178.16 178.10 1hqd h VAL 69 N 0.61 0.93 -0.73 1.81 2.07 -0.03 -1.41 116.25 119.50 1hqd h VAL 69 Ca 0.10 -0.23 -0.01 0.00 0.82 0.00 0.00 66.70 67.38 1hqd h VAL 69 Cb 0.62 0.19 -0.04 0.00 -1.52 0.00 0.00 31.29 30.55 1hqd h VAL 69 CO 0.04 0.12 0.40 0.11 0.02 0.00 0.00 177.57 178.26 1hqd h LYS 70 N 0.68 1.01 -0.01 1.57 1.57 -1.09 -1.27 116.57 119.03 1hqd h LYS 70 Ca 0.32 -0.11 -0.12 0.00 -1.87 0.00 0.00 60.65 58.87 1hqd h LYS 70 Cb 0.25 -0.20 -0.02 0.00 0.08 0.00 0.00 32.23 32.34 1hqd h LYS 70 CO -0.21 0.74 -0.57 1.79 -0.57 0.00 0.00 179.45 180.63 1hqd h THR 71 N 1.02 1.41 -0.28 -0.16 1.35 -0.98 -1.66 112.91 113.61 1hqd h THR 71 Ca 0.26 -1.97 -0.11 0.00 -0.55 0.00 0.00 66.41 64.04 1hqd h THR 71 Cb 0.03 2.05 -0.00 0.00 -1.73 0.00 0.00 68.15 68.50 1hqd h THR 71 CO -0.04 0.56 -0.25 0.58 -0.25 0.00 0.00 175.52 176.12 1hqd h VAL 72 N 0.02 1.30 -0.31 6.82 2.07 -0.61 -1.34 116.25 124.20 1hqd h VAL 72 Ca -0.01 -1.41 -0.02 0.00 0.82 0.00 0.00 66.70 66.08 1hqd h VAL 72 Cb 1.02 1.59 -0.01 0.00 -1.52 0.00 0.00 31.29 32.37 1hqd h VAL 72 CO 0.08 0.45 0.11 -0.07 0.02 0.00 0.00 177.57 178.15 1hqd h LEU 73 N 0.40 0.44 -0.94 2.57 3.38 -1.15 -1.17 115.31 118.84 1hqd h LEU 73 Ca 0.05 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 1hqd h LEU 73 Cb 0.81 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 41.40 1hqd h LEU 73 CO 0.06 0.51 0.47 0.00 0.09 0.00 0.00 178.44 179.57 1hqd h ALA 74 N 0.95 1.19 0.00 1.53 0.00 -1.26 0.60 119.26 122.26 1hqd h ALA 74 Ca 0.10 -0.13 -0.14 0.00 0.00 0.00 0.00 54.91 54.73 1hqd h ALA 74 Cb 0.22 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1hqd h ALA 74 CO -0.01 0.65 -0.69 0.00 0.00 0.00 0.00 179.25 179.20 1hqd h ALA 75 N 1.30 0.84 0.00 0.00 0.00 -1.07 -3.32 119.26 117.01 1hqd h ALA 75 Ca 0.30 -0.63 -0.25 0.00 0.00 0.00 0.00 54.91 54.34 1hqd h ALA 75 Cb 0.04 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.67 1hqd h ALA 75 CO -0.05 0.86 -2.14 0.25 0.00 0.00 0.00 179.25 178.17 1hqd n THR 76 N -3.69 1.04 -0.60 0.00 -2.24 -0.46 -4.98 114.28 103.35 1hqd n THR 76 Ca -0.01 -0.75 0.00 0.00 -2.27 0.00 0.00 64.05 61.02 1hqd n THR 76 Cb 0.68 -0.41 0.00 0.00 -2.10 0.00 0.00 70.33 68.50 1hqd n THR 76 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1hqd n GLY 77 N 1.58 0.76 3.86 3.38 0.00 0.21 -5.04 105.19 109.92 1hqd n GLY 77 Ca -0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.48 1hqd n GLY 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hqd s ALA 78 N -2.67 3.03 -0.56 4.61 0.00 -1.17 -5.00 121.76 120.00 1hqd s ALA 78 Ca 0.00 0.01 0.19 0.00 0.00 0.00 0.00 51.96 52.16 1hqd s ALA 78 Cb 0.00 -3.11 -0.24 0.00 0.00 0.00 0.00 23.12 19.78 1hqd s ALA 78 CO 0.00 -0.65 0.65 0.25 0.00 0.00 0.00 175.76 176.01 1hqd n THR 79 N -2.50 0.00 -3.92 0.00 -2.24 -1.26 -4.67 114.28 99.69 1hqd n THR 79 Ca 0.06 -0.20 -0.09 0.00 -2.27 0.00 0.00 64.05 61.55 1hqd n THR 79 Cb 0.54 0.65 -0.07 0.00 -2.10 0.00 0.00 70.33 69.36 1hqd n THR 79 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1hqd s LYS 80 N -2.96 1.12 0.12 -0.78 1.02 -1.26 -4.58 119.74 112.42 1hqd s LYS 80 Ca 0.02 -1.11 0.02 0.00 0.02 0.00 0.00 55.97 54.92 1hqd s LYS 80 Cb 0.13 0.38 -0.04 0.00 -0.52 0.00 0.00 37.83 37.79 1hqd s LYS 80 CO 0.77 -0.41 -0.04 0.14 -0.92 0.00 0.00 175.35 174.89 1hqd s VAL 81 N -3.94 0.67 -0.26 3.17 -7.23 -0.49 -3.85 120.40 108.46 1hqd s VAL 81 Ca 0.14 -1.95 -0.09 0.00 -1.81 0.00 0.00 61.98 58.28 1hqd s VAL 81 Cb 0.03 -1.80 -0.04 0.00 0.56 0.00 0.00 36.38 35.13 1hqd s VAL 81 CO -0.02 -0.76 0.13 0.20 -0.31 0.00 0.00 175.10 174.34 1hqd s ASN 82 N -3.07 5.67 -0.17 4.85 0.01 0.30 -1.58 114.94 120.94 1hqd s ASN 82 Ca 0.15 -0.07 -0.18 0.00 -0.71 0.00 0.00 52.86 52.06 1hqd s ASN 82 Cb 0.06 -2.04 -0.04 0.00 0.41 0.00 0.00 41.25 39.64 1hqd s ASN 82 CO -0.02 -0.02 0.47 -0.76 -1.51 0.00 0.00 177.10 175.25 1hqd s LEU 83 N 1.55 4.19 -0.33 0.60 1.43 -0.49 -1.35 118.68 124.28 1hqd s LEU 83 Ca 0.06 0.67 0.02 0.00 -1.03 0.00 0.00 54.13 53.85 1hqd s LEU 83 Cb -0.15 -2.64 0.10 0.00 0.03 0.00 0.00 46.19 43.53 1hqd s LEU 83 CO 0.07 -0.09 0.08 -0.69 0.23 0.00 0.00 176.35 175.95 1hqd s VAL 84 N 1.21 1.59 0.02 -1.59 1.01 -0.45 -0.73 120.40 121.46 1hqd s VAL 84 Ca 0.23 -1.91 0.03 0.00 0.00 0.00 0.00 61.98 60.33 1hqd s VAL 84 Cb -0.15 -2.18 -0.04 0.00 0.00 0.00 0.00 36.38 34.01 1hqd s VAL 84 CO 0.09 -0.65 -0.02 -0.83 0.00 0.00 0.00 175.10 173.69 1hqd s GLY 85 N 1.22 1.84 -0.10 4.51 0.00 -0.08 -0.55 107.32 114.17 1hqd s GLY 85 Ca 0.11 -1.02 0.00 0.00 0.00 0.00 0.00 44.72 43.81 1hqd s GLY 85 CO -0.16 -0.91 -0.09 -1.58 0.00 0.00 0.00 173.10 170.36 1hqd s HIS 86 N -1.11 2.88 0.00 1.90 5.65 -0.24 -0.56 115.29 123.81 1hqd s HIS 86 Ca 0.20 -0.24 0.00 0.00 0.25 0.00 0.00 55.06 55.27 1hqd s HIS 86 Cb -0.11 -1.78 0.00 0.00 -1.18 0.00 0.00 32.58 29.50 1hqd s HIS 86 CO 0.11 0.09 0.00 0.45 -0.65 0.00 0.00 174.74 174.74 1hqd n SER 87 N 2.85 0.00 0.27 9.88 2.88 -0.20 -0.64 113.62 128.66 1hqd n SER 87 Ca -0.18 0.00 0.15 0.00 -1.33 0.00 0.00 58.87 57.52 1hqd n SER 87 Cb 0.53 0.00 0.88 0.00 -0.75 0.00 0.00 64.21 64.87 1hqd n SER 87 CO 0.00 0.00 0.00 -0.61 -1.23 0.00 0.00 175.04 173.20 1hqd h GLN 88 N 0.00 0.00 -0.79 -1.46 4.15 -1.85 -0.76 115.11 114.40 1hqd h GLN 88 Ca 0.00 0.00 0.20 0.00 0.77 0.00 0.00 58.65 59.62 1hqd h GLN 88 Cb 0.00 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 27.65 1hqd h GLN 88 CO 0.00 0.00 0.55 0.78 -1.93 0.00 0.00 178.83 178.23 1hqd h GLY 89 N 0.00 0.35 1.74 2.39 0.00 -0.85 0.30 103.07 107.00 1hqd h GLY 89 Ca 0.02 -0.08 -0.09 0.00 0.00 0.00 0.00 47.33 47.18 1hqd h GLY 89 CO -0.00 0.01 -0.31 -1.33 0.00 0.00 0.00 176.54 174.90 1hqd h GLY 90 N 0.18 0.33 1.17 4.60 0.00 -1.26 -1.50 103.07 106.58 1hqd h GLY 90 Ca 0.39 -0.28 -0.20 0.00 0.00 0.00 0.00 47.33 47.24 1hqd h GLY 90 CO -0.07 0.25 -0.62 1.41 0.00 0.00 0.00 176.54 177.51 1hqd h LEU 91 N 0.27 0.97 -1.02 3.11 3.38 -0.56 -2.12 115.31 119.33 1hqd h LEU 91 Ca 0.04 -0.55 -0.05 0.00 0.09 0.00 0.00 57.88 57.41 1hqd h LEU 91 Cb 0.69 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.13 1hqd h LEU 91 CO 0.05 1.36 0.18 0.74 0.09 0.00 0.00 178.44 180.85 1hqd h THR 92 N 0.63 1.23 -0.36 0.22 2.02 -1.11 -1.94 112.91 113.60 1hqd h THR 92 Ca -0.01 -0.78 -0.07 0.00 0.77 0.00 0.00 66.41 66.33 1hqd h THR 92 Cb 1.24 0.59 -0.01 0.00 -1.74 0.00 0.00 68.15 68.23 1hqd h THR 92 CO 0.13 0.30 -0.04 0.28 0.37 0.00 0.00 175.52 176.56 1hqd h SER 93 N 0.85 0.66 -0.70 4.18 0.02 -1.17 -2.64 113.55 114.74 1hqd h SER 93 Ca 0.19 -0.34 0.05 0.00 -0.84 0.00 0.00 61.79 60.86 1hqd h SER 93 Cb 0.26 -0.18 -0.04 0.00 0.14 0.00 0.00 62.40 62.58 1hqd h SER 93 CO -0.01 0.84 0.46 0.03 -1.14 0.00 0.00 176.83 177.01 1hqd h ARG 94 N 0.46 0.74 -0.15 3.45 3.08 -1.05 -0.11 114.38 120.80 1hqd h ARG 94 Ca 0.10 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.10 1hqd h ARG 94 Cb 0.53 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.40 1hqd h ARG 94 CO 0.03 0.49 0.07 -0.92 -1.07 0.00 0.00 179.97 178.57 1hqd h TYR 95 N 0.76 0.21 -0.55 3.04 5.03 -1.02 -1.30 116.97 123.15 1hqd h TYR 95 Ca 0.30 -0.01 -0.11 0.00 2.58 0.00 0.00 58.73 61.49 1hqd h TYR 95 Cb 0.20 -0.07 -0.02 0.00 1.55 0.00 0.00 36.73 38.40 1hqd h TYR 95 CO -0.00 0.24 -0.10 0.28 -1.32 0.00 0.00 178.16 177.26 1hqd h VAL 96 N 0.12 1.27 -0.57 1.81 2.07 -1.11 -1.30 116.25 118.53 1hqd h VAL 96 Ca 0.05 -1.26 0.00 0.00 0.82 0.00 0.00 66.70 66.32 1hqd h VAL 96 Cb 0.11 0.95 -0.03 0.00 -1.52 0.00 0.00 31.29 30.79 1hqd h VAL 96 CO -0.01 0.45 0.36 0.00 0.02 0.00 0.00 177.57 178.38 1hqd h ALA 97 N 0.96 1.55 0.01 1.67 0.00 -0.89 0.60 119.26 123.16 1hqd h ALA 97 Ca 0.14 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1hqd h ALA 97 Cb 0.67 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1hqd h ALA 97 CO 0.05 0.40 -0.11 0.00 0.00 0.00 0.00 179.25 179.58 1hqd h ALA 98 N 1.61 -0.01 0.00 0.00 0.00 -0.91 -2.82 119.26 117.14 1hqd h ALA 98 Ca 0.21 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1hqd h ALA 98 Cb -0.05 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1hqd h ALA 98 CO -0.04 0.02 -0.14 -0.39 0.00 0.00 0.00 179.25 178.70 1hqd h VAL 99 N -0.83 0.00 -2.01 0.00 -1.51 -1.23 -3.36 116.25 107.31 1hqd h VAL 99 Ca -0.02 -0.92 -0.48 0.00 -1.23 0.00 0.00 66.70 64.05 1hqd h VAL 99 Cb 1.02 1.84 -0.40 0.00 -2.13 0.00 0.00 31.29 31.62 1hqd h VAL 99 CO 0.02 0.00 -1.18 0.00 -1.23 0.00 0.00 177.57 175.18 1hqd n ALA 100 N -2.06 2.07 -0.09 5.19 0.00 0.20 -4.97 120.51 120.85 1hqd n ALA 100 Ca 0.04 -3.43 0.14 0.00 0.00 0.00 0.00 53.44 50.19 1hqd n ALA 100 Cb 0.52 -0.92 0.53 0.00 0.00 0.00 0.00 19.45 19.58 1hqd n ALA 100 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1hqd h PRO 101 N 3.01 0.33 0.00 0.00 0.13 -1.60 -1.98 132.00 131.90 1hqd h PRO 101 Ca 0.10 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 1hqd h PRO 101 Cb 0.96 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.01 1hqd h PRO 101 CO 0.51 0.22 0.00 0.38 -0.23 0.00 0.00 178.00 178.88 1hqd h ASP 102 N 0.34 0.00 -0.02 1.44 2.03 -1.87 -2.67 116.42 115.68 1hqd h ASP 102 Ca 0.30 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.60 1hqd h ASP 102 Cb 0.71 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.21 1hqd h ASP 102 CO -0.08 0.00 -0.43 0.18 -1.03 0.00 0.00 179.24 177.89 1hqd n LEU 103 N -2.48 2.07 -4.49 0.15 4.77 -0.74 -4.77 117.00 111.50 1hqd n LEU 103 Ca 0.00 -0.78 -0.33 0.00 -0.03 0.00 0.00 56.01 54.87 1hqd n LEU 103 Cb 0.15 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.12 1hqd n LEU 103 CO 0.17 0.38 -0.44 -0.69 -1.33 0.00 0.00 177.39 175.49 1hqd s VAL 104 N -2.38 3.19 -0.09 4.08 1.01 -1.01 -1.39 120.40 123.81 1hqd s VAL 104 Ca 0.19 -0.67 0.12 0.00 0.00 0.00 0.00 61.98 61.61 1hqd s VAL 104 Cb 0.18 -2.26 -0.17 0.00 0.00 0.00 0.00 36.38 34.13 1hqd s VAL 104 CO 0.53 0.59 0.11 0.00 0.00 0.00 0.00 175.10 176.33 1hqd n ALA 105 N 2.34 1.91 -3.46 5.51 0.00 -0.62 -4.76 120.51 121.43 1hqd n ALA 105 Ca -0.17 -0.68 -0.11 0.00 0.00 0.00 0.00 53.44 52.48 1hqd n ALA 105 Cb 0.52 -0.13 -0.02 0.00 0.00 0.00 0.00 19.45 19.83 1hqd n ALA 105 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1hqd s SER 106 N -4.25 -0.49 -0.05 0.00 1.04 -1.25 -1.85 113.70 106.85 1hqd s SER 106 Ca -0.06 -0.01 -0.01 0.00 0.48 0.00 0.00 55.95 56.35 1hqd s SER 106 Cb 0.05 0.52 0.03 0.00 0.10 0.00 0.00 66.02 66.72 1hqd s SER 106 CO 0.51 -0.84 0.02 -0.69 0.98 0.00 0.00 173.24 173.23 1hqd s VAL 107 N -3.51 0.17 -0.11 5.02 1.01 -0.43 -1.40 120.40 121.16 1hqd s VAL 107 Ca 0.03 0.24 0.03 0.00 0.00 0.00 0.00 61.98 62.27 1hqd s VAL 107 Cb -0.01 -0.36 0.01 0.00 0.00 0.00 0.00 36.38 36.02 1hqd s VAL 107 CO -0.11 0.22 -0.20 -0.89 0.00 0.00 0.00 175.10 174.11 1hqd s THR 108 N 1.95 1.84 -0.08 3.92 2.01 0.09 -1.28 115.64 124.09 1hqd s THR 108 Ca 0.03 -0.87 0.03 0.00 0.31 0.00 0.00 61.69 61.20 1hqd s THR 108 Cb -0.12 -1.62 -0.02 0.00 0.01 0.00 0.00 72.50 70.75 1hqd s THR 108 CO -0.04 0.51 -0.18 0.42 -0.69 0.00 0.00 174.62 174.64 1hqd s THR 109 N 0.62 2.65 -0.28 -0.82 -4.23 -0.90 -0.90 115.64 111.79 1hqd s THR 109 Ca -0.13 -0.84 -0.02 0.00 -1.18 0.00 0.00 61.69 59.52 1hqd s THR 109 Cb -0.17 -2.04 0.04 0.00 1.34 0.00 0.00 72.50 71.68 1hqd s THR 109 CO 0.04 0.56 -0.03 -0.63 -0.54 0.00 0.00 174.62 174.02 1hqd s ILE 110 N -0.16 2.94 -1.40 2.99 1.01 0.28 -2.56 121.20 124.29 1hqd s ILE 110 Ca -0.02 -1.21 -0.05 0.00 0.00 0.00 0.00 60.65 59.37 1hqd s ILE 110 Cb -0.14 -2.60 0.03 0.00 0.01 0.00 0.00 42.46 39.77 1hqd s ILE 110 CO 0.04 0.04 0.74 0.61 0.00 0.00 0.00 174.94 176.37 1hqd n GLY 111 N 4.64 -0.34 3.71 6.18 0.00 -0.85 -1.03 105.19 117.50 1hqd n GLY 111 Ca -0.15 0.15 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 1hqd n GLY 111 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1hqd s THR 112 N -3.59 5.26 -1.34 2.61 2.01 -1.26 -3.23 115.64 116.08 1hqd s THR 112 Ca 0.22 0.67 -0.16 0.00 0.31 0.00 0.00 61.69 62.73 1hqd s THR 112 Cb -0.11 -3.69 0.02 0.00 0.01 0.00 0.00 72.50 68.73 1hqd s THR 112 CO 0.83 0.34 2.08 -0.81 -0.69 0.00 0.00 174.62 176.37 1hqd n PRO 113 N 3.85 2.75 0.29 4.92 -0.04 -1.26 -3.49 135.00 142.03 1hqd n PRO 113 Ca -0.10 -2.68 0.16 0.00 -0.04 0.00 0.00 63.50 60.84 1hqd n PRO 113 Cb 0.52 -3.32 0.90 0.00 -0.04 0.00 0.00 33.50 31.56 1hqd n PRO 113 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1hqd h HIS 114 N 6.68 0.00 -0.19 0.54 3.86 -1.49 -1.50 115.15 123.04 1hqd h HIS 114 Ca 0.52 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.73 1hqd h HIS 114 Cb 0.71 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.18 1hqd h HIS 114 CO 1.42 0.03 0.00 0.54 0.86 0.00 0.00 177.93 180.79 1hqd n ARG 115 N -3.67 2.53 0.00 2.45 5.12 -1.22 -4.72 116.66 117.15 1hqd n ARG 115 Ca -0.03 -2.59 0.00 0.00 -1.93 0.00 0.00 57.85 53.30 1hqd n ARG 115 Cb 0.13 -1.63 0.00 0.00 -1.16 0.00 0.00 32.46 29.79 1hqd n ARG 115 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1hqd n GLY 116 N -0.60 -0.87 3.13 -0.13 0.00 -0.57 -4.34 105.19 101.81 1hqd n GLY 116 Ca 0.17 -1.68 -0.28 0.00 0.00 0.00 0.00 46.02 44.23 1hqd n GLY 116 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1hqd s SER 117 N -1.60 2.44 0.54 1.61 0.15 0.74 -4.76 113.70 112.82 1hqd s SER 117 Ca 0.00 -0.43 0.29 0.00 0.70 0.00 0.00 55.95 56.51 1hqd s SER 117 Cb 0.00 -1.04 1.52 0.00 -1.71 0.00 0.00 66.02 64.79 1hqd s SER 117 CO 0.00 0.11 2.09 -0.33 1.20 0.00 0.00 173.24 176.31 1hqd h GLU 118 N 6.71 0.00 0.00 5.44 3.07 -1.87 -0.87 114.58 127.05 1hqd h GLU 118 Ca -0.26 0.00 -0.14 0.00 -0.50 0.00 0.00 59.36 58.45 1hqd h GLU 118 Cb 1.21 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 29.10 1hqd h GLU 118 CO 0.47 0.10 -0.68 0.35 -1.40 0.00 0.00 179.01 177.85 1hqd h PHE 119 N 0.00 0.00 -0.30 4.33 3.57 -1.93 -1.95 116.94 120.66 1hqd h PHE 119 Ca -0.00 0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.42 1hqd h PHE 119 Cb 0.32 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.05 1hqd h PHE 119 CO 0.00 0.68 -0.13 0.00 -2.23 0.00 0.00 178.31 176.63 1hqd h ALA 120 N 1.32 0.42 -0.52 2.41 0.00 -1.46 -0.84 119.26 120.59 1hqd h ALA 120 Ca -0.01 -0.32 0.02 0.00 0.00 0.00 0.00 54.91 54.61 1hqd h ALA 120 Cb 1.38 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 19.03 1hqd h ALA 120 CO 0.09 0.30 0.31 -0.44 0.00 0.00 0.00 179.25 179.51 1hqd h ASP 121 N 0.37 0.50 0.49 0.00 3.32 -1.32 -0.92 116.42 118.86 1hqd h ASP 121 Ca 0.07 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.11 1hqd h ASP 121 Cb 0.65 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 40.08 1hqd h ASP 121 CO 0.04 0.35 -0.45 0.15 -1.72 0.00 0.00 179.24 177.61 1hqd h PHE 122 N 0.61 -1.24 -0.80 4.55 3.57 -1.12 0.17 116.94 122.69 1hqd h PHE 122 Ca 0.21 0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.79 1hqd h PHE 122 Cb 0.03 0.48 -0.06 0.00 2.79 0.00 0.00 35.95 39.18 1hqd h PHE 122 CO -0.07 -0.62 0.47 0.28 -2.23 0.00 0.00 178.31 176.14 1hqd h VAL 123 N -0.94 0.98 -0.65 1.41 2.07 -0.98 -0.17 116.25 117.97 1hqd h VAL 123 Ca -0.05 -0.29 -0.07 0.00 0.82 0.00 0.00 66.70 67.10 1hqd h VAL 123 Cb 0.82 0.07 -0.03 0.00 -1.52 0.00 0.00 31.29 30.63 1hqd h VAL 123 CO -0.04 0.15 0.11 -0.61 0.02 0.00 0.00 177.57 177.20 1hqd h GLN 124 N 0.84 1.05 -0.73 1.57 4.15 -0.95 -2.48 115.11 118.57 1hqd h GLN 124 Ca 0.36 -0.27 -0.04 0.00 0.77 0.00 0.00 58.65 59.47 1hqd h GLN 124 Cb 0.23 -0.13 -0.03 0.00 0.21 0.00 0.00 27.48 27.76 1hqd h GLN 124 CO -0.20 0.96 0.30 0.78 -1.93 0.00 0.00 178.83 178.74 1hqd h GLY 125 N 1.05 1.15 0.75 2.39 0.00 0.53 -2.45 103.07 106.49 1hqd h GLY 125 Ca 0.20 -0.61 0.03 0.00 0.00 0.00 0.00 47.33 46.95 1hqd h GLY 125 CO 0.01 0.57 -0.01 -2.08 0.00 0.00 0.00 176.54 175.04 1hqd h VAL 126 N 1.05 0.88 -0.84 4.60 2.07 -0.64 -2.33 116.25 121.05 1hqd h VAL 126 Ca 0.25 -0.02 0.05 0.00 0.82 0.00 0.00 66.70 67.80 1hqd h VAL 126 Cb 0.19 0.83 -0.05 0.00 -1.52 0.00 0.00 31.29 30.74 1hqd h VAL 126 CO -0.02 0.01 0.55 -0.07 0.02 0.00 0.00 177.57 178.05 1hqd h LEU 127 N 0.05 0.85 -1.78 2.57 3.38 -1.16 -1.87 115.31 117.34 1hqd h LEU 127 Ca 0.07 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1hqd h LEU 127 Cb 0.09 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.66 1hqd h LEU 127 CO -0.13 0.57 0.00 0.00 0.09 0.00 0.00 178.44 178.97 1hqd h ALA 128 N 1.53 1.00 -0.00 1.53 0.00 -0.95 -2.60 119.26 119.76 1hqd h ALA 128 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.26 1hqd h ALA 128 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1hqd h ALA 128 CO -0.11 0.00 0.00 0.66 0.00 0.00 0.00 179.25 179.80 1hqd n TYR 129 N -2.66 0.00 -3.23 0.00 4.01 -0.70 -4.54 117.16 110.04 1hqd n TYR 129 Ca -0.01 -0.00 -0.45 0.00 -0.16 0.00 0.00 57.90 57.28 1hqd n TYR 129 Cb 0.13 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.11 1hqd n TYR 129 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 1hqd s ASP 130 N -1.73 6.19 0.64 7.72 2.15 -0.98 -4.93 116.67 125.73 1hqd s ASP 130 Ca 0.35 -1.56 0.33 0.00 0.43 0.00 0.00 52.55 52.10 1hqd s ASP 130 Cb 0.16 -2.25 1.81 0.00 -0.30 0.00 0.00 42.92 42.34 1hqd s ASP 130 CO 0.27 -0.95 2.01 1.55 -0.17 0.00 0.00 175.17 177.89 1hqd h PRO 131 N 9.00 0.00 0.00 4.34 0.13 -1.89 -0.25 132.00 143.33 1hqd h PRO 131 Ca -0.30 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 1hqd h PRO 131 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1hqd h PRO 131 CO 1.05 0.00 -0.98 0.25 -0.23 0.00 0.00 178.00 178.09 1hqd n THR 132 N -2.89 0.51 -0.30 1.56 -2.24 -1.26 -4.95 114.28 104.72 1hqd n THR 132 Ca -0.02 -0.47 0.00 0.00 -2.27 0.00 0.00 64.05 61.28 1hqd n THR 132 Cb 0.28 -0.24 0.00 0.00 -2.10 0.00 0.00 70.33 68.27 1hqd n THR 132 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1hqd n GLY 133 N 1.23 1.55 0.24 3.38 0.00 -0.11 -4.86 105.19 106.62 1hqd n GLY 133 Ca 0.01 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.10 1hqd n GLY 133 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1hqd h LEU 134 N 0.00 0.00 -1.47 0.99 3.38 -1.93 -2.60 115.31 113.68 1hqd h LEU 134 Ca 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1hqd h LEU 134 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1hqd h LEU 134 CO 0.00 0.10 0.03 0.77 0.09 0.00 0.00 178.44 179.43 1hqd h SER 135 N 0.00 0.34 -0.23 -0.43 4.64 -1.91 -1.14 113.55 114.81 1hqd h SER 135 Ca -0.00 -0.04 -0.01 0.00 -0.47 0.00 0.00 61.79 61.27 1hqd h SER 135 Cb 0.19 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.18 1hqd h SER 135 CO 0.01 0.38 0.11 0.28 -0.87 0.00 0.00 176.83 176.74 1hqd h SER 136 N 0.37 0.30 0.36 4.97 0.02 -1.78 0.93 113.55 118.72 1hqd h SER 136 Ca 0.09 -0.12 -0.02 0.00 -0.84 0.00 0.00 61.79 60.90 1hqd h SER 136 Cb 0.20 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 62.67 1hqd h SER 136 CO 0.00 0.34 -0.17 0.74 -1.14 0.00 0.00 176.83 176.60 1hqd h THR 137 N 0.24 0.65 0.29 -2.27 2.02 -1.51 0.16 112.91 112.50 1hqd h THR 137 Ca 0.08 -0.23 -0.00 0.00 0.77 0.00 0.00 66.41 67.02 1hqd h THR 137 Cb 0.12 0.78 -0.01 0.00 -1.74 0.00 0.00 68.15 67.29 1hqd h THR 137 CO -0.01 0.05 -0.23 0.58 0.37 0.00 0.00 175.52 176.28 1hqd h VAL 138 N -0.62 0.52 -0.46 3.16 2.07 -1.20 0.10 116.25 119.82 1hqd h VAL 138 Ca -0.05 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.42 1hqd h VAL 138 Cb 0.45 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 30.72 1hqd h VAL 138 CO 0.08 0.00 0.07 0.40 0.02 0.00 0.00 177.57 178.14 1hqd h ILE 139 N -0.52 1.22 -0.63 4.57 2.04 -0.85 -1.45 117.51 121.89 1hqd h ILE 139 Ca -0.02 -0.83 -0.07 0.00 1.00 0.00 0.00 64.86 64.94 1hqd h ILE 139 Cb 0.46 0.79 -0.02 0.00 -0.74 0.00 0.00 36.82 37.31 1hqd h ILE 139 CO -0.01 0.30 0.11 0.00 0.00 0.00 0.00 178.15 178.55 1hqd h ALA 140 N 1.39 0.84 -0.51 1.87 0.00 -0.39 -0.10 119.26 122.35 1hqd h ALA 140 Ca 0.15 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 1hqd h ALA 140 Cb 0.33 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1hqd h ALA 140 CO 0.01 0.59 0.28 0.00 0.00 0.00 0.00 179.25 180.12 1hqd h ALA 141 N 1.03 0.66 -0.29 0.00 0.00 -0.54 0.13 119.26 120.26 1hqd h ALA 141 Ca 0.19 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1hqd h ALA 141 Cb 0.42 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1hqd h ALA 141 CO 0.01 0.18 0.16 0.35 0.00 0.00 0.00 179.25 179.95 1hqd h PHE 142 N 0.68 0.40 -0.44 0.00 3.57 -0.91 -1.30 116.94 118.94 1hqd h PHE 142 Ca 0.18 -0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.58 1hqd h PHE 142 Cb 0.06 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 38.66 1hqd h PHE 142 CO -0.02 0.33 -0.07 0.28 -2.23 0.00 0.00 178.31 176.61 1hqd h VAL 143 N 0.35 1.27 -0.81 1.41 2.07 -0.77 -1.88 116.25 117.89 1hqd h VAL 143 Ca 0.10 -1.16 0.01 0.00 0.82 0.00 0.00 66.70 66.47 1hqd h VAL 143 Cb 0.07 1.13 -0.04 0.00 -1.52 0.00 0.00 31.29 30.92 1hqd h VAL 143 CO -0.02 0.40 0.53 0.78 0.02 0.00 0.00 177.57 179.28 1hqd h ASN 144 N 0.65 0.92 -0.69 0.57 2.35 -0.61 0.49 115.58 119.27 1hqd h ASN 144 Ca 0.12 -0.02 -0.04 0.00 -0.55 0.00 0.00 56.30 55.80 1hqd h ASN 144 Cb 0.59 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 38.71 1hqd h ASN 144 CO 0.04 0.66 0.27 0.58 -1.65 0.00 0.00 177.43 177.33 1hqd h VAL 145 N 1.08 1.25 -0.75 2.81 2.07 -1.10 -0.51 116.25 121.09 1hqd h VAL 145 Ca 0.30 -0.78 0.05 0.00 0.82 0.00 0.00 66.70 67.08 1hqd h VAL 145 Cb -0.11 0.46 -0.05 0.00 -1.52 0.00 0.00 31.29 30.07 1hqd h VAL 145 CO -0.07 0.31 0.46 0.15 0.02 0.00 0.00 177.57 178.44 1hqd h PHE 146 N 0.99 0.86 -0.03 1.57 3.57 -0.47 0.97 116.94 124.39 1hqd h PHE 146 Ca 0.23 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.75 1hqd h PHE 146 Cb 0.22 -0.28 -0.00 0.00 2.79 0.00 0.00 35.95 38.68 1hqd h PHE 146 CO 0.02 0.46 0.02 0.78 -2.23 0.00 0.00 178.31 177.36 1hqd h GLY 147 N 0.87 0.05 0.98 2.40 0.00 -0.06 0.15 103.07 107.47 1hqd h GLY 147 Ca 0.32 -0.02 -0.00 0.00 0.00 0.00 0.00 47.33 47.62 1hqd h GLY 147 CO -0.14 0.02 0.26 -2.22 0.00 0.00 0.00 176.54 174.45 1hqd h ILE 148 N 0.01 1.15 -0.56 2.60 2.04 -0.67 -0.35 117.51 121.73 1hqd h ILE 148 Ca 0.01 -0.35 -0.07 0.00 1.00 0.00 0.00 64.86 65.45 1hqd h ILE 148 Cb 0.03 0.58 -0.02 0.00 -0.74 0.00 0.00 36.82 36.67 1hqd h ILE 148 CO -0.00 0.15 0.08 -0.07 0.00 0.00 0.00 178.15 178.31 1hqd h LEU 149 N 0.59 0.90 0.00 1.44 3.38 -0.69 -3.18 115.31 117.75 1hqd h LEU 149 Ca 0.16 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1hqd h LEU 149 Cb 0.02 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.53 1hqd h LEU 149 CO -0.03 0.94 -0.38 0.71 0.09 0.00 0.00 178.44 179.78 1hqd h THR 150 N 0.83 0.00 -3.33 0.22 1.35 -0.88 -3.42 112.91 107.68 1hqd h THR 150 Ca 0.17 -0.75 -0.53 0.00 -0.55 0.00 0.00 66.41 64.75 1hqd h THR 150 Cb 0.43 1.53 0.08 0.00 -1.73 0.00 0.00 68.15 68.47 1hqd h THR 150 CO 0.01 0.00 0.89 -0.55 -0.25 0.00 0.00 175.52 175.62 1hqd s SER 151 N -5.14 6.36 0.50 5.36 0.15 -0.15 -0.75 113.70 120.04 1hqd s SER 151 Ca 0.06 2.96 0.15 0.00 0.70 0.00 0.00 55.95 59.82 1hqd s SER 151 Cb 0.10 -2.63 1.21 0.00 -1.71 0.00 0.00 66.02 62.98 1hqd s SER 151 CO 0.69 -0.92 2.12 0.77 1.20 0.00 0.00 173.24 177.10 1hqd h SER 152 N 4.85 0.08 -0.36 5.45 4.64 -1.89 -1.62 113.55 124.70 1hqd h SER 152 Ca -0.47 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 1hqd h SER 152 Cb 1.22 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1hqd h SER 152 CO 0.79 0.06 0.00 -1.54 -0.87 0.00 0.00 176.83 175.27 1hqd n SER 153 N -4.52 3.17 -3.88 4.97 3.41 -1.26 -4.68 113.62 110.84 1hqd n SER 153 Ca -0.01 -2.16 -0.30 0.00 -0.26 0.00 0.00 58.87 56.15 1hqd n SER 153 Cb 0.13 -0.30 0.03 0.00 -0.26 0.00 0.00 64.21 63.81 1hqd n SER 153 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1hqd n ASN 154 N 0.44 -4.92 -4.68 4.04 3.02 -0.61 -4.84 115.26 107.72 1hqd n ASN 154 Ca 0.14 -0.75 -0.48 0.00 -0.03 0.00 0.00 54.58 53.46 1hqd n ASN 154 Cb 0.52 -3.92 -0.05 0.00 -0.61 0.00 0.00 39.78 35.72 1hqd n ASN 154 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1hqd n ASN 155 N -2.82 3.24 -0.21 6.41 2.85 -1.26 -4.85 115.26 118.62 1hqd n ASN 155 Ca 0.04 1.02 0.14 0.00 -0.11 0.00 0.00 54.58 55.66 1hqd n ASN 155 Cb 0.53 -1.37 0.53 0.00 1.24 0.00 0.00 39.78 40.71 1hqd n ASN 155 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 1hqd n THR 156 N 4.51 0.00 -2.74 -0.44 -2.24 -1.26 -4.20 114.28 107.91 1hqd n THR 156 Ca 0.21 -0.11 -0.43 0.00 -2.27 0.00 0.00 64.05 61.44 1hqd n THR 156 Cb 0.28 0.15 -0.00 0.00 -2.10 0.00 0.00 70.33 68.66 1hqd n THR 156 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1hqd s ASN 157 N -2.38 6.94 -0.04 3.42 2.47 -1.26 -4.93 114.94 119.16 1hqd s ASN 157 Ca 0.30 -2.69 0.03 0.00 0.42 0.00 0.00 52.86 50.93 1hqd s ASN 157 Cb 0.20 -2.50 0.00 0.00 -1.45 0.00 0.00 41.25 37.50 1hqd s ASN 157 CO 0.46 -0.98 -0.14 -1.10 -3.72 0.00 0.00 177.10 171.62 1hqd s GLN 158 N 3.06 1.57 -0.41 0.43 -1.52 -1.26 -4.72 119.66 116.81 1hqd s GLN 158 Ca 0.49 -0.49 0.04 0.00 -1.95 0.00 0.00 55.36 53.45 1hqd s GLN 158 Cb 0.01 -1.36 0.17 0.00 -0.22 0.00 0.00 33.01 31.60 1hqd s GLN 158 CO 0.04 0.16 0.36 0.34 -0.25 0.00 0.00 175.29 175.95 1hqd s ASP 159 N 0.22 1.31 0.28 5.90 -1.08 0.11 -4.93 116.67 118.49 1hqd s ASP 159 Ca -0.06 -2.74 0.01 0.00 -0.52 0.00 0.00 52.55 49.23 1hqd s ASP 159 Cb -0.12 -0.14 0.54 0.00 -1.46 0.00 0.00 42.92 41.74 1hqd s ASP 159 CO 0.02 -0.18 1.82 0.00 0.52 0.00 0.00 175.17 177.35 1hqd h ALA 160 N 5.84 1.46 -0.61 3.66 0.00 -1.85 -1.21 119.26 126.55 1hqd h ALA 160 Ca 0.21 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.12 1hqd h ALA 160 Cb 0.95 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 1hqd h ALA 160 CO 0.31 0.17 0.26 -0.07 0.00 0.00 0.00 179.25 179.92 1hqd h LEU 161 N 0.92 0.83 -0.88 0.00 3.38 -1.94 -0.60 115.31 117.02 1hqd h LEU 161 Ca 0.49 -0.16 -0.12 0.00 0.09 0.00 0.00 57.88 58.18 1hqd h LEU 161 Cb 0.51 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 1hqd h LEU 161 CO -0.28 0.76 -0.50 0.00 0.09 0.00 0.00 178.44 178.51 1hqd h ALA 162 N 1.10 1.06 -0.33 1.53 0.00 -1.80 -2.38 119.26 118.44 1hqd h ALA 162 Ca 0.21 -0.47 -0.13 0.00 0.00 0.00 0.00 54.91 54.51 1hqd h ALA 162 Cb 0.18 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1hqd h ALA 162 CO -0.02 0.65 -0.32 0.00 0.00 0.00 0.00 179.25 179.56 1hqd h ALA 163 N 1.37 0.48 -0.28 0.00 0.00 -0.83 -1.86 119.26 118.14 1hqd h ALA 163 Ca 0.00 -0.42 -0.02 0.00 0.00 0.00 0.00 54.91 54.48 1hqd h ALA 163 Cb 0.93 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1hqd h ALA 163 CO 0.07 0.52 0.11 1.25 0.00 0.00 0.00 179.25 181.21 1hqd h LEU 164 N 0.56 0.39 -0.62 0.00 5.85 -1.01 -2.80 115.31 117.69 1hqd h LEU 164 Ca 0.05 -0.17 -0.01 0.00 0.84 0.00 0.00 57.88 58.59 1hqd h LEU 164 Cb 0.90 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.80 1hqd h LEU 164 CO 0.08 0.45 0.33 0.50 -0.34 0.00 0.00 178.44 179.47 1hqd h LYS 165 N 0.31 0.86 -0.86 1.25 3.64 -1.42 -2.47 116.57 117.87 1hqd h LYS 165 Ca 0.09 -0.10 0.16 0.00 -1.27 0.00 0.00 60.65 59.53 1hqd h LYS 165 Cb 0.19 -0.17 -0.07 0.00 -0.41 0.00 0.00 32.23 31.77 1hqd h LYS 165 CO -0.01 0.66 0.56 1.15 -2.27 0.00 0.00 179.45 179.54 1hqd h THR 166 N 0.84 0.78 -0.01 1.00 2.02 -1.17 -1.96 112.91 114.40 1hqd h THR 166 Ca 0.22 -0.19 0.00 0.00 0.77 0.00 0.00 66.41 67.21 1hqd h THR 166 Cb 0.05 0.18 0.00 0.00 -1.74 0.00 0.00 68.15 66.64 1hqd h THR 166 CO -0.03 0.10 -0.13 0.18 0.37 0.00 0.00 175.52 176.01 1hqd n LEU 167 N -4.53 0.96 -4.79 2.58 4.77 -0.94 -4.15 117.00 110.89 1hqd n LEU 167 Ca 0.17 -0.25 -0.33 0.00 -0.03 0.00 0.00 56.01 55.58 1hqd n LEU 167 Cb 0.55 -0.09 0.03 0.00 -2.33 0.00 0.00 43.42 41.57 1hqd n LEU 167 CO 0.30 0.17 0.72 0.42 -1.33 0.00 0.00 177.39 177.68 1hqd s THR 168 N -2.32 3.66 0.22 -5.08 -4.23 -0.74 -0.18 115.64 106.96 1hqd s THR 168 Ca 0.31 0.74 -0.07 0.00 -1.18 0.00 0.00 61.69 61.49 1hqd s THR 168 Cb 0.20 -3.29 0.15 0.00 1.34 0.00 0.00 72.50 70.91 1hqd s THR 168 CO 0.45 -0.51 1.77 0.71 -0.54 0.00 0.00 174.62 176.50 1hqd h THR 169 N 0.13 1.26 -0.64 3.99 1.35 -1.76 -0.54 112.91 116.70 1hqd h THR 169 Ca -0.46 -0.85 -0.05 0.00 -0.55 0.00 0.00 66.41 64.49 1hqd h THR 169 Cb 1.23 0.36 -0.03 0.00 -1.73 0.00 0.00 68.15 67.98 1hqd h THR 169 CO 0.56 0.34 0.19 0.00 -0.25 0.00 0.00 175.52 176.36 1hqd h ALA 170 N 1.17 0.84 -0.07 6.62 0.00 -1.93 -2.27 119.26 123.62 1hqd h ALA 170 Ca 0.26 -0.22 -0.17 0.00 0.00 0.00 0.00 54.91 54.78 1hqd h ALA 170 Cb 0.25 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1hqd h ALA 170 CO -0.02 0.52 -0.68 0.37 0.00 0.00 0.00 179.25 179.44 1hqd h GLN 171 N 0.92 0.31 -0.67 0.00 5.75 -1.75 -3.04 115.11 116.64 1hqd h GLN 171 Ca 0.20 -0.24 -0.02 0.00 -0.15 0.00 0.00 58.65 58.44 1hqd h GLN 171 Cb 0.31 0.05 -0.03 0.00 1.07 0.00 0.00 27.48 28.88 1hqd h GLN 171 CO -0.00 0.88 0.36 0.00 -2.65 0.00 0.00 178.83 177.41 1hqd h ALA 172 N 1.06 0.86 -0.86 3.38 0.00 -0.89 -0.04 119.26 122.77 1hqd h ALA 172 Ca -0.02 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.80 1hqd h ALA 172 Cb 1.23 -0.27 -0.05 0.00 0.00 0.00 0.00 17.79 18.70 1hqd h ALA 172 CO 0.11 0.39 0.56 0.00 0.00 0.00 0.00 179.25 180.31 1hqd h ALA 173 N 1.17 1.12 -0.56 0.00 0.00 -1.34 -0.78 119.26 118.87 1hqd h ALA 173 Ca 0.23 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 55.00 1hqd h ALA 173 Cb 0.06 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 1hqd h ALA 173 CO -0.04 0.42 -0.03 1.15 0.00 0.00 0.00 179.25 180.76 1hqd h THR 174 N 1.10 1.26 -0.93 0.00 2.02 -1.32 -2.66 112.91 112.39 1hqd h THR 174 Ca 0.34 -1.16 0.02 0.00 0.77 0.00 0.00 66.41 66.37 1hqd h THR 174 Cb -0.03 0.86 -0.05 0.00 -1.74 0.00 0.00 68.15 67.19 1hqd h THR 174 CO -0.10 0.42 0.61 0.22 0.37 0.00 0.00 175.52 177.04 1hqd h TYR 175 N 0.91 1.16 0.00 3.16 3.20 0.01 -1.64 116.97 123.77 1hqd h TYR 175 Ca 0.16 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.06 1hqd h TYR 175 Cb 0.57 -0.39 0.00 0.00 1.54 0.00 0.00 36.73 38.45 1hqd h TYR 175 CO 0.04 0.71 0.00 -0.91 -1.64 0.00 0.00 178.16 176.36 1hqd h ASN 176 N 1.24 0.00 0.25 -2.11 2.35 -0.87 -0.13 115.58 116.31 1hqd h ASN 176 Ca 0.35 0.00 -0.32 0.00 -0.55 0.00 0.00 56.30 55.78 1hqd h ASN 176 Cb -0.11 0.00 0.03 0.00 0.05 0.00 0.00 38.32 38.30 1hqd h ASN 176 CO -0.09 0.00 -1.40 1.56 -1.65 0.00 0.00 177.43 175.85 1hqd h GLN 177 N 0.00 0.55 0.00 0.81 4.20 -0.99 -2.81 115.11 116.87 1hqd h GLN 177 Ca 0.00 -0.87 -0.14 0.00 0.06 0.00 0.00 58.65 57.69 1hqd h GLN 177 Cb 0.50 0.31 -0.02 0.00 0.30 0.00 0.00 27.48 28.58 1hqd h GLN 177 CO 0.00 1.41 -0.69 -0.91 -0.67 0.00 0.00 178.83 177.97 1hqd h ASN 178 N 0.18 0.00 -2.12 1.46 2.35 -1.12 -3.36 115.58 112.97 1hqd h ASN 178 Ca -0.23 0.00 -0.56 0.00 -0.55 0.00 0.00 56.30 54.96 1hqd h ASN 178 Cb 2.09 0.00 -0.41 0.00 0.05 0.00 0.00 38.32 40.05 1hqd h ASN 178 CO 0.26 0.69 -0.87 -1.22 -1.65 0.00 0.00 177.43 174.64 1hqd n TYR 179 N -3.48 1.91 -0.73 1.19 4.01 -0.09 -5.11 117.16 114.86 1hqd n TYR 179 Ca 0.00 -3.89 -0.32 0.00 -0.16 0.00 0.00 57.90 53.53 1hqd n TYR 179 Cb 0.73 -0.46 0.15 0.00 -0.31 0.00 0.00 39.34 39.45 1hqd n TYR 179 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1hqd n PRO 180 N 0.63 -0.57 -3.66 -0.72 -0.02 -1.06 -4.70 135.00 124.90 1hqd n PRO 180 Ca 0.27 -0.12 -0.11 0.00 -2.02 0.00 0.00 63.50 61.52 1hqd n PRO 180 Cb 0.49 -2.02 -0.08 0.00 -0.02 0.00 0.00 33.50 31.87 1hqd n PRO 180 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1hqd s SER 181 N -2.22 -0.72 0.59 2.55 0.15 -1.26 -5.01 113.70 107.78 1hqd s SER 181 Ca 0.61 1.28 0.35 0.00 0.70 0.00 0.00 55.95 58.88 1hqd s SER 181 Cb -0.21 1.23 1.83 0.00 -1.71 0.00 0.00 66.02 67.15 1hqd s SER 181 CO 0.64 -0.22 2.18 0.00 1.20 0.00 0.00 173.24 177.05 1hqd h ALA 182 N 6.02 1.15 -0.00 5.45 0.00 -1.94 -1.76 119.26 128.19 1hqd h ALA 182 Ca -0.30 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1hqd h ALA 182 Cb 1.19 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1hqd h ALA 182 CO 0.16 0.05 -0.00 0.41 0.00 0.00 0.00 179.25 179.87 1hqd n GLY 183 N -0.75 -0.99 3.68 0.00 0.00 -1.26 0.15 105.19 106.02 1hqd n GLY 183 Ca -0.02 -0.20 -0.35 0.00 0.00 0.00 0.00 46.02 45.45 1hqd n GLY 183 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1hqd s LEU 184 N -2.01 3.62 0.00 0.99 1.43 -0.66 -0.57 118.68 121.47 1hqd s LEU 184 Ca 0.47 0.14 -0.04 0.00 -1.03 0.00 0.00 54.13 53.68 1hqd s LEU 184 Cb 0.22 -1.84 0.07 0.00 0.03 0.00 0.00 46.19 44.67 1hqd s LEU 184 CO 0.37 0.36 0.44 0.61 0.23 0.00 0.00 176.35 178.36 1hqd n GLY 185 N 2.28 -0.59 3.75 -3.19 0.00 -1.21 -4.20 105.19 102.04 1hqd n GLY 185 Ca -0.19 -1.79 -0.41 0.00 0.00 0.00 0.00 46.02 43.64 1hqd n GLY 185 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hqd s ALA 186 N -3.62 3.43 0.44 4.61 0.00 -1.26 -4.92 121.76 120.43 1hqd s ALA 186 Ca 0.26 0.97 -0.25 0.00 0.00 0.00 0.00 51.96 52.93 1hqd s ALA 186 Cb -0.01 -3.37 -0.09 0.00 0.00 0.00 0.00 23.12 19.65 1hqd s ALA 186 CO 0.18 -0.29 1.37 -0.35 0.00 0.00 0.00 175.76 176.67 1hqd n PRO 187 N 1.51 2.13 -0.97 0.00 -0.04 -1.26 -1.73 135.00 134.63 1hqd n PRO 187 Ca 0.01 0.76 0.00 0.00 -0.04 0.00 0.00 63.50 64.22 1hqd n PRO 187 Cb 0.44 -2.54 0.00 0.00 -0.04 0.00 0.00 33.50 31.37 1hqd n PRO 187 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1hqd n GLY 188 N 0.67 0.54 0.02 0.55 0.00 -1.26 -4.86 105.19 100.85 1hqd n GLY 188 Ca 0.06 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.19 1hqd n GLY 188 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1hqd n SER 189 N -0.12 0.22 -3.71 1.61 3.41 -0.71 -4.98 113.62 109.34 1hqd n SER 189 Ca 0.00 -0.04 -0.23 0.00 -0.26 0.00 0.00 58.87 58.33 1hqd n SER 189 Cb 0.06 1.65 0.04 0.00 -0.26 0.00 0.00 64.21 65.71 1hqd n SER 189 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1hqd s GLN 191 N -6.09 0.82 0.58 0.00 2.00 -1.26 -4.98 119.66 110.73 1hqd s GLN 191 Ca 0.22 -1.23 0.03 0.00 -2.00 0.00 0.00 55.36 52.38 1hqd s GLN 191 Cb -0.11 -0.33 0.11 0.00 0.80 0.00 0.00 33.01 33.48 1hqd s GLN 191 CO 0.80 0.02 0.80 -2.37 -0.50 0.00 0.00 175.29 174.04 1hqd n THR 192 N 0.27 0.00 0.00 -0.34 5.66 -1.26 -3.33 114.28 115.28 1hqd n THR 192 Ca -0.14 -1.49 0.00 0.00 -3.05 0.00 0.00 64.05 59.37 1hqd n THR 192 Cb 0.59 -0.81 0.00 0.00 -1.55 0.00 0.00 70.33 68.56 1hqd n THR 192 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1hqd n GLY 193 N -1.46 2.70 3.89 1.09 0.00 -0.64 -3.61 105.19 107.17 1hqd n GLY 193 Ca 0.14 -1.01 -0.29 0.00 0.00 0.00 0.00 46.02 44.86 1hqd n GLY 193 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hqd s ALA 194 N -2.48 3.31 -0.52 4.61 0.00 0.12 -4.76 121.76 122.03 1hqd s ALA 194 Ca 0.00 -0.32 0.26 0.00 0.00 0.00 0.00 51.96 51.90 1hqd s ALA 194 Cb 0.00 -2.75 0.75 0.00 0.00 0.00 0.00 23.12 21.12 1hqd s ALA 194 CO 0.00 -0.35 1.74 -1.00 0.00 0.00 0.00 175.76 176.15 1hqd h PRO 195 N 0.34 0.00 -4.19 0.00 0.13 -1.86 -3.35 132.00 123.06 1hqd h PRO 195 Ca -0.46 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.51 1hqd h PRO 195 Cb 1.20 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.20 1hqd h PRO 195 CO 0.62 0.00 -0.44 0.95 -0.23 0.00 0.00 178.00 178.90 1hqd s THR 196 N -3.22 0.03 0.05 1.56 -4.23 -1.26 -0.15 115.64 108.41 1hqd s THR 196 Ca 0.08 -1.72 -0.07 0.00 -1.18 0.00 0.00 61.69 58.80 1hqd s THR 196 Cb 0.09 -2.22 -0.01 0.00 1.34 0.00 0.00 72.50 71.70 1hqd s THR 196 CO 0.58 -0.13 0.14 -1.83 -0.54 0.00 0.00 174.62 172.84 1hqd s GLU 197 N -4.07 0.67 -0.23 3.99 -1.05 -0.52 -4.67 118.70 112.81 1hqd s GLU 197 Ca 0.28 -0.78 -0.02 0.00 -0.15 0.00 0.00 54.97 54.31 1hqd s GLU 197 Cb 0.04 0.27 0.07 0.00 -0.44 0.00 0.00 34.13 34.07 1hqd s GLU 197 CO 0.07 -0.18 0.03 0.99 0.95 0.00 0.00 175.26 177.12 1hqd s THR 198 N -2.91 0.83 -0.21 1.83 2.01 -1.26 0.04 115.64 115.98 1hqd s THR 198 Ca -0.02 -0.93 -0.01 0.00 0.31 0.00 0.00 61.69 61.04 1hqd s THR 198 Cb 0.01 -1.37 0.01 0.00 0.01 0.00 0.00 72.50 71.16 1hqd s THR 198 CO -0.06 -0.31 -0.11 -0.69 -0.69 0.00 0.00 174.62 172.76 1hqd s VAL 199 N 1.69 2.72 -1.83 3.82 1.01 0.17 -4.60 120.40 123.38 1hqd s VAL 199 Ca 0.01 -0.79 0.00 0.00 0.00 0.00 0.00 61.98 61.19 1hqd s VAL 199 Cb -0.18 -2.24 0.00 0.00 0.00 0.00 0.00 36.38 33.97 1hqd s VAL 199 CO -0.12 0.42 0.00 0.61 0.00 0.00 0.00 175.10 176.01 1hqd n GLY 200 N 4.69 0.32 1.35 4.51 0.00 -1.26 -1.65 105.19 113.15 1hqd n GLY 200 Ca -0.19 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.77 1hqd n GLY 200 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hqd n GLY 201 N -0.86 0.74 3.43 -0.02 0.00 -1.26 -5.00 105.19 102.22 1hqd n GLY 201 Ca -0.22 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.45 1hqd n GLY 201 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1hqd s ASN 202 N -2.86 4.84 0.05 1.61 0.01 -0.66 -5.08 114.94 112.85 1hqd s ASN 202 Ca 0.00 -0.22 -0.21 0.00 -0.71 0.00 0.00 52.86 51.73 1hqd s ASN 202 Cb 0.00 -1.84 -0.06 0.00 0.41 0.00 0.00 41.25 39.76 1hqd s ASN 202 CO 0.00 0.04 0.61 -0.89 -1.51 0.00 0.00 177.10 175.34 1hqd s THR 203 N 1.15 4.76 -0.06 1.60 2.01 -1.26 -0.66 115.64 123.20 1hqd s THR 203 Ca 0.03 1.29 0.03 0.00 0.31 0.00 0.00 61.69 63.35 1hqd s THR 203 Cb -0.14 -3.94 0.01 0.00 0.01 0.00 0.00 72.50 68.43 1hqd s THR 203 CO 0.02 0.50 -0.14 -1.00 -0.69 0.00 0.00 174.62 173.30 1hqd s HIS 204 N -0.74 1.56 -0.18 4.92 3.76 0.11 -4.70 115.29 120.01 1hqd s HIS 204 Ca 0.31 -0.52 -0.23 0.00 -0.15 0.00 0.00 55.06 54.47 1hqd s HIS 204 Cb -0.19 -1.10 -0.02 0.00 1.11 0.00 0.00 32.58 32.38 1hqd s HIS 204 CO 0.19 -0.23 0.72 -0.51 -0.85 0.00 0.00 174.74 174.06 1hqd s LEU 205 N 0.38 4.16 -0.12 0.89 1.43 -0.77 -1.44 118.68 123.21 1hqd s LEU 205 Ca -0.10 0.99 -0.04 0.00 -1.03 0.00 0.00 54.13 53.95 1hqd s LEU 205 Cb -0.14 -3.04 -0.03 0.00 0.03 0.00 0.00 46.19 43.00 1hqd s LEU 205 CO 0.03 -0.32 0.02 -0.76 0.23 0.00 0.00 176.35 175.55 1hqd s LEU 206 N 1.97 3.63 0.12 1.79 1.43 0.79 -1.31 118.68 127.11 1hqd s LEU 206 Ca 0.33 0.10 -0.04 0.00 -1.03 0.00 0.00 54.13 53.49 1hqd s LEU 206 Cb -0.16 -1.86 -0.03 0.00 0.03 0.00 0.00 46.19 44.17 1hqd s LEU 206 CO 0.11 0.30 0.13 -0.31 0.23 0.00 0.00 176.35 176.80 1hqd s TYR 207 N -0.38 0.59 -0.08 0.29 2.02 -0.40 -1.19 117.35 118.20 1hqd s TYR 207 Ca 0.08 -1.00 -0.32 0.00 -0.37 0.00 0.00 57.07 55.46 1hqd s TYR 207 Cb -0.12 -0.29 0.12 0.00 -0.40 0.00 0.00 41.96 41.26 1hqd s TYR 207 CO 0.02 -0.56 1.12 -1.54 -1.57 0.00 0.00 175.55 173.02 1hqd s SER 208 N -2.98 -0.19 0.12 2.29 1.04 -0.50 -2.11 113.70 111.37 1hqd s SER 208 Ca 0.17 -0.06 -0.24 0.00 0.48 0.00 0.00 55.95 56.30 1hqd s SER 208 Cb 0.06 0.24 0.08 0.00 0.10 0.00 0.00 66.02 66.50 1hqd s SER 208 CO -0.02 -0.41 0.68 -1.66 0.98 0.00 0.00 173.24 172.82 1hqd s TRP 209 N -2.68 -0.47 0.06 5.02 -2.14 -1.06 -0.87 118.94 116.79 1hqd s TRP 209 Ca 0.09 0.27 -0.01 0.00 2.66 0.00 0.00 56.10 59.11 1hqd s TRP 209 Cb -0.00 0.56 -0.04 0.00 -3.10 0.00 0.00 33.47 30.89 1hqd s TRP 209 CO -0.05 -0.79 -0.01 0.00 -2.66 0.00 0.00 176.95 173.44 1hqd s ALA 210 N -3.59 0.54 -0.15 2.67 0.00 -0.10 -2.00 121.76 119.12 1hqd s ALA 210 Ca 0.02 -1.23 -0.07 0.00 0.00 0.00 0.00 51.96 50.68 1hqd s ALA 210 Cb -0.01 0.36 -0.04 0.00 0.00 0.00 0.00 23.12 23.42 1hqd s ALA 210 CO -0.11 -0.39 0.11 0.20 0.00 0.00 0.00 175.76 175.57 1hqd s GLY 211 N -2.94 2.05 -0.34 0.00 0.00 -1.26 -4.01 107.32 100.82 1hqd s GLY 211 Ca 0.09 -0.69 0.14 0.00 0.00 0.00 0.00 44.72 44.26 1hqd s GLY 211 CO -0.08 -0.17 1.04 -1.30 0.00 0.00 0.00 173.10 172.59 1hqd n THR 212 N 2.72 1.59 -0.26 0.90 -2.24 -0.10 -3.20 114.28 113.69 1hqd n THR 212 Ca -0.18 -3.70 -0.07 0.00 -2.27 0.00 0.00 64.05 57.83 1hqd n THR 212 Cb 0.53 0.02 0.05 0.00 -2.10 0.00 0.00 70.33 68.83 1hqd n THR 212 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1hqd h ALA 213 N 2.74 0.93 -1.71 6.98 0.00 -1.25 -3.40 119.26 123.55 1hqd h ALA 213 Ca 0.06 -0.24 -0.57 0.00 0.00 0.00 0.00 54.91 54.16 1hqd h ALA 213 Cb 1.15 -0.27 -0.09 0.00 0.00 0.00 0.00 17.79 18.58 1hqd h ALA 213 CO 0.58 0.64 0.82 0.42 0.00 0.00 0.00 179.25 181.71 1hqd s ILE 214 N -5.36 4.21 -0.04 0.00 -1.09 -0.25 -0.70 121.20 117.96 1hqd s ILE 214 Ca -0.12 0.82 0.04 0.00 -2.23 0.00 0.00 60.65 59.16 1hqd s ILE 214 Cb 0.15 -4.62 -0.03 0.00 -1.58 0.00 0.00 42.46 36.38 1hqd s ILE 214 CO 0.84 -1.14 -0.14 -1.10 -1.23 0.00 0.00 174.94 172.16 1hqd s GLN 215 N 4.45 2.48 0.06 2.79 -1.52 -0.58 -1.20 119.66 126.15 1hqd s GLN 215 Ca 0.41 -0.71 -0.31 0.00 -1.95 0.00 0.00 55.36 52.80 1hqd s GLN 215 Cb -0.09 -2.37 -0.06 0.00 -0.22 0.00 0.00 33.01 30.28 1hqd s GLN 215 CO 0.26 0.62 1.19 -2.14 -0.25 0.00 0.00 175.29 174.97 1hqd s PRO 216 N -0.78 4.44 0.00 2.91 0.02 -1.26 -0.61 135.00 139.71 1hqd s PRO 216 Ca 0.12 1.76 0.00 0.00 0.02 0.00 0.00 61.00 62.90 1hqd s PRO 216 Cb -0.11 -3.35 0.00 0.00 0.02 0.00 0.00 34.50 31.07 1hqd s PRO 216 CO 0.01 -0.25 0.06 0.25 -0.33 0.00 0.00 177.00 176.74 1hqd n THR 217 N 3.92 0.00 -3.63 0.99 -2.24 -0.25 -4.91 114.28 108.16 1hqd n THR 217 Ca 0.09 -0.26 -0.13 0.00 -2.27 0.00 0.00 64.05 61.47 1hqd n THR 217 Cb 0.46 1.11 -0.07 0.00 -2.10 0.00 0.00 70.33 69.73 1hqd n THR 217 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 1hqd s ILE 218 N -0.41 0.00 -0.08 2.28 2.07 -1.10 -5.00 121.20 118.95 1hqd s ILE 218 Ca 0.00 0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.24 1hqd s ILE 218 Cb 0.00 -1.00 0.02 0.00 0.13 0.00 0.00 42.46 41.61 1hqd s ILE 218 CO 0.00 0.00 -0.06 -0.55 -1.91 0.00 0.00 174.94 172.42 1hqd s SER 219 N 0.38 1.68 -0.10 4.50 0.15 -1.26 0.30 113.70 119.35 1hqd s SER 219 Ca 0.00 -0.21 -0.05 0.00 0.70 0.00 0.00 55.95 56.39 1hqd s SER 219 Cb -0.05 -0.66 0.05 0.00 -1.71 0.00 0.00 66.02 63.65 1hqd s SER 219 CO 0.00 -0.09 0.23 -0.69 1.20 0.00 0.00 173.24 173.89 1hqd s VAL 220 N 1.38 -0.05 -1.39 4.45 1.01 0.85 -4.91 120.40 121.73 1hqd s VAL 220 Ca -0.03 0.16 -0.04 0.00 0.00 0.00 0.00 61.98 62.07 1hqd s VAL 220 Cb -0.14 -0.36 0.03 0.00 0.00 0.00 0.00 36.38 35.92 1hqd s VAL 220 CO -0.03 0.07 0.73 0.33 0.00 0.00 0.00 175.10 176.19 1hqd n PHE 221 N 4.27 -1.97 -0.18 5.22 7.35 -1.26 -0.87 117.46 130.03 1hqd n PHE 221 Ca -0.25 0.84 0.00 0.00 -0.76 0.00 0.00 57.45 57.28 1hqd n PHE 221 Cb 0.53 -4.16 0.00 0.00 0.35 0.00 0.00 39.48 36.20 1hqd n PHE 221 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1hqd n GLY 222 N -1.66 1.88 3.79 7.13 0.00 -1.26 -4.98 105.19 110.09 1hqd n GLY 222 Ca -0.21 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.45 1hqd n GLY 222 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1hqd s VAL 223 N -2.60 5.38 -0.18 1.61 1.01 -0.04 -5.08 120.40 120.49 1hqd s VAL 223 Ca 0.00 0.35 -0.02 0.00 0.00 0.00 0.00 61.98 62.30 1hqd s VAL 223 Cb 0.00 -3.51 -0.01 0.00 0.00 0.00 0.00 36.38 32.86 1hqd s VAL 223 CO 0.00 0.51 -0.07 -0.89 0.00 0.00 0.00 175.10 174.64 1hqd s THR 224 N -0.27 3.35 -0.00 3.92 2.01 -1.26 -0.11 115.64 123.28 1hqd s THR 224 Ca 0.14 -0.53 -0.02 0.00 0.31 0.00 0.00 61.69 61.59 1hqd s THR 224 Cb -0.12 -2.47 -0.04 0.00 0.01 0.00 0.00 72.50 69.87 1hqd s THR 224 CO 0.03 0.47 0.16 -0.83 -0.69 0.00 0.00 174.62 173.77 1hqd s GLY 225 N 0.87 2.14 0.48 4.40 0.00 0.15 -4.71 107.32 110.65 1hqd s GLY 225 Ca -0.02 -0.80 0.05 0.00 0.00 0.00 0.00 44.72 43.96 1hqd s GLY 225 CO 0.01 -0.69 0.22 0.00 0.00 0.00 0.00 173.10 172.63 1hqd s ALA 226 N -1.32 3.97 -0.02 3.20 0.00 -1.26 -1.09 121.76 125.25 1hqd s ALA 226 Ca 0.27 -1.47 0.01 0.00 0.00 0.00 0.00 51.96 50.77 1hqd s ALA 226 Cb -0.13 -0.41 0.02 0.00 0.00 0.00 0.00 23.12 22.60 1hqd s ALA 226 CO 0.19 -0.23 -0.01 0.99 0.00 0.00 0.00 175.76 176.70 1hqd s THR 227 N -2.71 0.20 -0.85 0.00 2.01 0.22 -4.80 115.64 109.70 1hqd s THR 227 Ca 0.31 0.00 -0.20 0.00 0.31 0.00 0.00 61.69 62.11 1hqd s THR 227 Cb 0.01 -0.25 0.10 0.00 0.01 0.00 0.00 72.50 72.38 1hqd s THR 227 CO 0.18 0.11 1.11 -0.62 -0.69 0.00 0.00 174.62 174.71 1hqd s ASP 228 N 0.59 6.46 0.00 3.53 -1.08 -1.26 -1.53 116.67 123.39 1hqd s ASP 228 Ca -0.06 -1.63 0.16 0.00 -0.52 0.00 0.00 52.55 50.50 1hqd s ASP 228 Cb -0.09 -2.42 0.88 0.00 -1.46 0.00 0.00 42.92 39.82 1hqd s ASP 228 CO -0.01 -1.24 1.38 0.35 0.52 0.00 0.00 175.17 176.17 1hqd n THR 229 N 5.79 0.21 0.20 1.71 -2.24 0.13 -2.55 114.28 117.53 1hqd n THR 229 Ca 0.16 0.05 0.11 0.00 -2.27 0.00 0.00 64.05 62.09 1hqd n THR 229 Cb 0.48 -0.80 0.13 0.00 -2.10 0.00 0.00 70.33 68.04 1hqd n THR 229 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1hqd h SER 230 N 0.00 0.00 -2.58 3.42 4.64 -1.75 -3.44 113.55 113.84 1hqd h SER 230 Ca 0.00 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.74 1hqd h SER 230 Cb 0.05 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 62.04 1hqd h SER 230 CO 0.00 0.07 -0.65 0.42 -0.87 0.00 0.00 176.83 175.80 1hqd s THR 231 N -3.19 3.59 -0.16 2.95 -4.23 -1.06 -1.15 115.64 112.39 1hqd s THR 231 Ca 0.06 -1.65 -0.29 0.00 -1.18 0.00 0.00 61.69 58.63 1hqd s THR 231 Cb 0.06 -2.85 -0.01 0.00 1.34 0.00 0.00 72.50 71.04 1hqd s THR 231 CO 0.69 -0.23 1.11 -0.63 -0.54 0.00 0.00 174.62 175.02 1hqd s ILE 232 N -1.99 4.54 -0.41 2.99 1.01 -1.26 -4.84 121.20 121.25 1hqd s ILE 232 Ca 0.29 1.85 -0.42 0.00 0.00 0.00 0.00 60.65 62.37 1hqd s ILE 232 Cb -0.08 -4.19 -0.18 0.00 0.01 0.00 0.00 42.46 38.01 1hqd s ILE 232 CO 0.19 -0.10 1.41 -2.65 0.00 0.00 0.00 174.94 173.79 1hqd n PRO 233 N 5.95 0.00 0.00 2.79 -0.02 -1.26 -2.22 135.00 140.23 1hqd n PRO 233 Ca 0.12 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.60 1hqd n PRO 233 Cb 0.46 -1.38 0.00 0.00 -0.02 0.00 0.00 33.50 32.57 1hqd n PRO 233 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1hqd n LEU 234 N 3.41 0.00 -0.20 2.45 4.77 -1.26 -4.52 117.00 121.65 1hqd n LEU 234 Ca 0.27 0.00 0.14 0.00 -0.03 0.00 0.00 56.01 56.40 1hqd n LEU 234 Cb -0.04 0.00 0.63 0.00 -2.33 0.00 0.00 43.42 41.68 1hqd n LEU 234 CO 0.80 0.00 0.90 1.33 -1.33 0.00 0.00 177.39 179.08 1hqd n VAL 235 N 0.00 0.00 -1.68 4.08 0.24 -1.22 -4.93 118.33 114.82 1hqd n VAL 235 Ca 0.00 -0.10 -0.44 0.00 -2.04 0.00 0.00 64.34 61.76 1hqd n VAL 235 Cb 0.00 0.03 -0.03 0.00 -1.47 0.00 0.00 33.84 32.36 1hqd n VAL 235 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 1hqd n ASP 236 N -0.64 3.91 0.27 -1.34 -0.08 -0.94 -4.86 116.55 112.87 1hqd n ASP 236 Ca 0.17 0.97 0.12 0.00 -1.51 0.00 0.00 54.79 54.55 1hqd n ASP 236 Cb 0.27 -1.50 0.79 0.00 2.34 0.00 0.00 41.12 43.02 1hqd n ASP 236 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1hqd h PRO 237 N 8.92 0.00 -0.06 -0.67 0.11 -1.91 -2.29 132.00 136.10 1hqd h PRO 237 Ca -0.47 0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.65 1hqd h PRO 237 Cb 1.24 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 1hqd h PRO 237 CO 0.94 0.00 0.12 0.00 -0.21 0.00 0.00 178.00 178.85 1hqd h ALA 238 N 1.99 1.42 0.00 -0.75 0.00 -1.89 0.18 119.26 120.21 1hqd h ALA 238 Ca 0.01 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1hqd h ALA 238 Cb 0.03 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 1hqd h ALA 238 CO -0.00 -0.15 -0.14 -0.91 0.00 0.00 0.00 179.25 178.05 1hqd h ASN 239 N 0.00 0.00 0.00 0.00 -0.26 -1.66 -2.48 115.58 111.18 1hqd h ASN 239 Ca 0.03 0.00 -0.35 0.00 -0.56 0.00 0.00 56.30 55.42 1hqd h ASN 239 Cb 0.26 0.00 -0.06 0.00 -1.06 0.00 0.00 38.32 37.46 1hqd h ASN 239 CO -0.00 0.14 -2.32 0.00 -1.06 0.00 0.00 177.43 174.19 1hqd n ALA 240 N -2.15 1.51 0.58 -0.83 0.00 0.47 -4.55 120.51 115.54 1hqd n ALA 240 Ca 0.02 -1.15 0.12 0.00 0.00 0.00 0.00 53.44 52.42 1hqd n ALA 240 Cb 0.47 -0.11 0.11 0.00 0.00 0.00 0.00 19.45 19.92 1hqd n ALA 240 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1hqd n LEU 241 N -2.91 0.65 -3.82 0.00 4.77 -0.28 -4.70 117.00 110.71 1hqd n LEU 241 Ca -0.36 0.11 -0.30 0.00 -0.03 0.00 0.00 56.01 55.44 1hqd n LEU 241 Cb 1.04 -0.15 -0.15 0.00 -2.33 0.00 0.00 43.42 41.84 1hqd n LEU 241 CO 0.33 -0.01 -0.35 -0.62 -1.33 0.00 0.00 177.39 175.42 1hqd s ASP 242 N -4.07 4.02 0.61 -1.43 -1.08 -0.93 -5.00 116.67 108.78 1hqd s ASP 242 Ca 0.05 -1.57 0.33 0.00 -0.52 0.00 0.00 52.55 50.83 1hqd s ASP 242 Cb 0.14 -1.02 1.92 0.00 -1.46 0.00 0.00 42.92 42.50 1hqd s ASP 242 CO 0.76 -0.37 2.26 1.55 0.52 0.00 0.00 175.17 179.88 1hqd h PRO 243 N 8.00 0.00 0.00 4.34 0.13 -1.84 -2.04 132.00 140.59 1hqd h PRO 243 Ca -0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.00 1hqd h PRO 243 Cb 1.03 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.16 1hqd h PRO 243 CO 0.46 0.00 0.00 0.66 -0.23 0.00 0.00 178.00 178.89 1hqd h SER 244 N 0.00 0.00 0.62 1.44 4.64 -1.94 -3.14 113.55 115.17 1hqd h SER 244 Ca 0.01 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.31 1hqd h SER 244 Cb 0.07 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.15 1hqd h SER 244 CO -0.00 0.00 -0.44 0.74 -0.87 0.00 0.00 176.83 176.26 1hqd h THR 245 N 0.00 0.11 -0.20 2.95 2.02 -1.63 0.92 112.91 117.07 1hqd h THR 245 Ca 0.00 0.00 -0.15 0.00 0.77 0.00 0.00 66.41 67.03 1hqd h THR 245 Cb 0.66 0.11 -0.01 0.00 -1.74 0.00 0.00 68.15 67.17 1hqd h THR 245 CO 0.00 0.00 -0.51 -0.07 0.37 0.00 0.00 175.52 175.31 1hqd h LEU 246 N -1.03 0.63 -0.52 2.58 3.38 -1.76 -2.40 115.31 116.19 1hqd h LEU 246 Ca -0.08 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 57.58 1hqd h LEU 246 Cb 0.85 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.40 1hqd h LEU 246 CO 0.04 1.03 0.35 0.00 0.09 0.00 0.00 178.44 179.94 1hqd h ALA 247 N 0.99 0.66 0.00 1.53 0.00 -1.48 0.70 119.26 121.67 1hqd h ALA 247 Ca 0.02 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 1hqd h ALA 247 Cb 1.05 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1hqd h ALA 247 CO 0.10 0.11 -0.36 -0.07 0.00 0.00 0.00 179.25 179.02 1hqd h LEU 248 N 0.71 0.00 -0.56 0.00 3.38 -0.76 -0.32 115.31 117.76 1hqd h LEU 248 Ca 0.19 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 58.02 1hqd h LEU 248 Cb -0.08 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1hqd h LEU 248 CO -0.04 0.36 -0.38 0.15 0.09 0.00 0.00 178.44 178.62 1hqd h PHE 249 N 0.00 0.88 -0.10 1.13 3.57 -0.81 0.12 116.94 121.73 1hqd h PHE 249 Ca -0.00 -0.25 -0.02 0.00 3.53 0.00 0.00 57.97 61.22 1hqd h PHE 249 Cb 0.69 -0.19 -0.00 0.00 2.79 0.00 0.00 35.95 39.24 1hqd h PHE 249 CO 0.00 1.00 -0.01 0.78 -2.23 0.00 0.00 178.31 177.85 1hqd h GLY 250 N 0.94 0.20 2.00 2.40 0.00 -0.07 -1.48 103.07 107.06 1hqd h GLY 250 Ca 0.05 -0.16 -0.08 0.00 0.00 0.00 0.00 47.33 47.14 1hqd h GLY 250 CO 0.08 0.15 -0.37 -0.91 0.00 0.00 0.00 176.54 175.49 1hqd h THR 251 N -0.12 1.14 -0.03 4.70 1.35 -1.06 -2.35 112.91 116.53 1hqd h THR 251 Ca 0.03 -1.34 -0.10 0.00 -0.55 0.00 0.00 66.41 64.44 1hqd h THR 251 Cb 0.40 1.75 -0.01 0.00 -1.73 0.00 0.00 68.15 68.56 1hqd h THR 251 CO 0.01 0.37 -0.46 1.23 -0.25 0.00 0.00 175.52 176.41 1hqd h GLY 252 N 1.35 0.09 1.38 5.82 0.00 -0.59 -2.36 103.07 108.76 1hqd h GLY 252 Ca -0.00 -0.08 -0.18 0.00 0.00 0.00 0.00 47.33 47.07 1hqd h GLY 252 CO 0.05 0.08 -0.59 -0.84 0.00 0.00 0.00 176.54 175.23 1hqd h THR 253 N 0.07 1.31 -0.59 4.70 2.02 -0.74 -2.18 112.91 117.50 1hqd h THR 253 Ca 0.00 -1.84 -0.06 0.00 0.77 0.00 0.00 66.41 65.29 1hqd h THR 253 Cb 0.84 1.79 -0.03 0.00 -1.74 0.00 0.00 68.15 69.02 1hqd h THR 253 CO 0.06 0.58 0.13 0.58 0.37 0.00 0.00 175.52 177.24 1hqd h VAL 254 N 0.48 1.24 -0.15 3.16 2.07 -1.28 -2.63 116.25 119.14 1hqd h VAL 254 Ca -0.00 -0.89 -0.02 0.00 0.82 0.00 0.00 66.70 66.60 1hqd h VAL 254 Cb 1.16 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 31.58 1hqd h VAL 254 CO 0.12 0.33 -0.00 0.24 0.02 0.00 0.00 177.57 178.28 1hqd h MET 255 N 0.88 0.26 0.00 1.57 2.86 -1.24 -2.74 114.93 116.53 1hqd h MET 255 Ca 0.19 -0.08 -0.01 0.00 -2.06 0.00 0.00 59.70 57.73 1hqd h MET 255 Cb 0.34 -0.02 -0.00 0.00 0.06 0.00 0.00 31.60 31.97 1hqd h MET 255 CO 0.00 0.49 -0.06 -0.39 1.06 0.00 0.00 176.91 178.02 1hqd h VAL 256 N 0.00 0.57 -0.01 -2.22 -1.51 -1.31 0.25 116.25 112.03 1hqd h VAL 256 Ca 0.04 -0.25 0.00 0.00 -1.23 0.00 0.00 66.70 65.26 1hqd h VAL 256 Cb 0.38 1.16 0.00 0.00 -2.13 0.00 0.00 31.29 30.69 1hqd h VAL 256 CO 0.01 0.06 -0.01 0.59 -1.23 0.00 0.00 177.57 176.98 1hqd n ASN 257 N -3.79 0.76 -0.55 4.19 3.02 -1.00 -2.78 115.26 115.10 1hqd n ASN 257 Ca -0.02 -1.21 0.07 0.00 -0.03 0.00 0.00 54.58 53.39 1hqd n ASN 257 Cb 0.15 -0.00 0.18 0.00 -0.61 0.00 0.00 39.78 39.50 1hqd n ASN 257 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1hqd n ARG 258 N -0.43 2.57 -1.10 3.52 1.74 0.82 -4.97 116.66 118.79 1hqd n ARG 258 Ca 0.21 -2.46 -0.03 0.00 -0.77 0.00 0.00 57.85 54.80 1hqd n ARG 258 Cb 0.24 -1.55 -0.01 0.00 -1.02 0.00 0.00 32.46 30.12 1hqd n ARG 258 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1hqd n GLY 259 N -0.49 0.60 0.16 -0.13 0.00 -1.07 -4.97 105.19 99.30 1hqd n GLY 259 Ca 0.16 -0.95 -0.07 0.00 0.00 0.00 0.00 46.02 45.16 1hqd n GLY 259 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1hqd h SER 260 N 0.00 0.33 -4.04 1.61 4.64 -1.56 -3.49 113.55 111.03 1hqd h SER 260 Ca -0.06 -0.21 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 1hqd h SER 260 Cb 0.21 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 1hqd h SER 260 CO 0.09 0.91 0.00 0.61 -0.87 0.00 0.00 176.83 177.57 1hqd n GLY 261 N 0.44 -2.20 3.51 -0.77 0.00 -1.26 -4.66 105.19 100.24 1hqd n GLY 261 Ca -0.03 -1.50 -0.47 0.00 0.00 0.00 0.00 46.02 44.02 1hqd n GLY 261 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hqd n GLN 262 N -0.40 0.72 -2.97 1.61 10.64 -1.26 -4.61 117.38 121.12 1hqd n GLN 262 Ca 0.00 0.25 -0.08 0.00 -1.83 0.00 0.00 57.00 55.35 1hqd n GLN 262 Cb 0.00 -1.49 -0.00 0.00 -0.86 0.00 0.00 30.24 27.89 1hqd n GLN 262 CO 0.00 0.00 0.00 0.27 -1.83 0.00 0.00 177.06 175.50 1hqd n ASN 263 N 1.64 -1.18 -0.54 2.61 6.94 -0.34 -1.91 115.26 122.49 1hqd n ASN 263 Ca 0.14 -2.13 0.05 0.00 -0.02 0.00 0.00 54.58 52.62 1hqd n ASN 263 Cb 0.27 2.05 0.14 0.00 -2.36 0.00 0.00 39.78 39.89 1hqd n ASN 263 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 1hqd n ASP 264 N -1.58 2.89 0.00 0.53 5.68 -1.02 -1.10 116.55 121.96 1hqd n ASP 264 Ca -0.03 -2.20 0.00 0.00 -0.50 0.00 0.00 54.79 52.06 1hqd n ASP 264 Cb 0.38 -0.25 0.00 0.00 -1.14 0.00 0.00 41.12 40.12 1hqd n ASP 264 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1hqd n GLY 265 N 0.10 2.92 0.00 6.12 0.00 -1.26 0.85 105.19 113.91 1hqd n GLY 265 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1hqd n GLY 265 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1hqd n VAL 266 N -1.12 0.00 -4.82 1.61 0.31 -1.26 -3.87 118.33 109.18 1hqd n VAL 266 Ca 0.00 0.00 -0.27 0.00 -0.01 0.00 0.00 64.34 64.06 1hqd n VAL 266 Cb 0.00 -0.16 -0.17 0.00 -0.91 0.00 0.00 33.84 32.61 1hqd n VAL 266 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1hqd s VAL 267 N -1.20 1.45 0.65 2.52 1.01 -1.26 -4.55 120.40 119.02 1hqd s VAL 267 Ca 0.00 -0.68 -0.11 0.00 0.00 0.00 0.00 61.98 61.19 1hqd s VAL 267 Cb 0.00 -1.28 -0.02 0.00 0.00 0.00 0.00 36.38 35.08 1hqd s VAL 267 CO 0.00 0.42 1.05 -0.94 0.00 0.00 0.00 175.10 175.63 1hqd s SER 268 N 0.42 5.98 0.11 3.32 1.04 -1.26 -2.43 113.70 120.87 1hqd s SER 268 Ca -0.13 1.35 -0.21 0.00 0.48 0.00 0.00 55.95 57.44 1hqd s SER 268 Cb -0.15 -2.33 -0.08 0.00 0.10 0.00 0.00 66.02 63.56 1hqd s SER 268 CO 0.05 -1.03 1.72 0.50 0.98 0.00 0.00 173.24 175.46 1hqd h LYS 269 N -0.43 0.01 -0.64 4.02 3.64 -1.65 -2.20 116.57 119.31 1hqd h LYS 269 Ca -0.44 -0.00 0.01 0.00 -1.27 0.00 0.00 60.65 58.95 1hqd h LYS 269 Cb 1.21 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.99 1hqd h LYS 269 CO 0.62 0.00 0.42 0.00 -2.27 0.00 0.00 179.45 178.23 1hqd h SER 271 N 0.84 0.00 1.06 0.00 0.87 -1.81 -3.23 113.55 111.27 1hqd h SER 271 Ca 0.24 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.80 1hqd h SER 271 Cb -0.05 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.91 1hqd h SER 271 CO -0.06 0.44 -0.15 0.00 -0.53 0.00 0.00 176.83 176.54 1hqd n ALA 272 N -2.31 2.56 -1.83 6.23 0.00 -0.86 -1.19 120.51 123.11 1hqd n ALA 272 Ca -0.00 -0.13 -0.42 0.00 0.00 0.00 0.00 53.44 52.89 1hqd n ALA 272 Cb 0.56 -1.39 -0.03 0.00 0.00 0.00 0.00 19.45 18.60 1hqd n ALA 272 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1hqd s LEU 273 N -3.61 4.38 -0.28 0.00 1.43 -1.19 -4.66 118.68 114.75 1hqd s LEU 273 Ca 0.12 2.64 -0.23 0.00 -1.03 0.00 0.00 54.13 55.62 1hqd s LEU 273 Cb 0.16 -3.57 0.09 0.00 0.03 0.00 0.00 46.19 42.91 1hqd s LEU 273 CO 0.60 -0.93 0.85 -0.47 0.23 0.00 0.00 176.35 176.62 1hqd s TYR 274 N 2.40 -0.70 0.00 0.29 5.04 -1.26 -4.82 117.35 118.30 1hqd s TYR 274 Ca 0.76 1.63 0.00 0.00 -2.44 0.00 0.00 57.07 57.02 1hqd s TYR 274 Cb -0.43 0.35 0.00 0.00 0.35 0.00 0.00 41.96 42.23 1hqd s TYR 274 CO 0.34 -0.34 0.00 0.41 -1.34 0.00 0.00 175.55 174.62 1hqd n GLY 275 N 2.78 1.97 3.61 8.97 0.00 0.26 -3.50 105.19 119.28 1hqd n GLY 275 Ca -0.14 -0.36 -0.43 0.00 0.00 0.00 0.00 46.02 45.09 1hqd n GLY 275 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1hqd s GLN 276 N 0.00 3.74 -0.84 1.61 0.74 -0.33 -4.43 119.66 120.15 1hqd s GLN 276 Ca 0.00 0.84 -0.24 0.00 0.05 0.00 0.00 55.36 56.01 1hqd s GLN 276 Cb 0.00 -3.93 0.05 0.00 1.10 0.00 0.00 33.01 30.24 1hqd s GLN 276 CO 0.00 -1.36 1.28 0.08 -0.55 0.00 0.00 175.29 174.74 1hqd s VAL 277 N 4.69 3.96 0.28 1.34 1.01 -1.26 -1.41 120.40 129.01 1hqd s VAL 277 Ca 0.53 -0.27 -0.02 0.00 0.00 0.00 0.00 61.98 62.23 1hqd s VAL 277 Cb -0.11 -4.92 0.17 0.00 0.00 0.00 0.00 36.38 31.52 1hqd s VAL 277 CO 0.29 -1.80 1.84 -0.07 0.00 0.00 0.00 175.10 175.36 1hqd h LEU 278 N 12.48 0.83 -7.00 3.92 3.38 -1.36 -3.47 115.31 124.08 1hqd h LEU 278 Ca -0.08 -0.13 0.17 0.00 0.09 0.00 0.00 57.88 57.92 1hqd h LEU 278 Cb 1.04 -0.21 -0.22 0.00 0.09 0.00 0.00 40.66 41.35 1hqd h LEU 278 CO 1.30 0.77 0.70 -0.55 0.09 0.00 0.00 178.44 180.76 1hqd s SER 279 N -6.53 -0.23 -0.00 -0.43 0.15 -1.25 -5.00 113.70 100.41 1hqd s SER 279 Ca -0.10 0.17 0.00 0.00 0.70 0.00 0.00 55.95 56.72 1hqd s SER 279 Cb 0.16 0.21 0.01 0.00 -1.71 0.00 0.00 66.02 64.68 1hqd s SER 279 CO 0.80 -0.27 0.79 0.35 1.20 0.00 0.00 173.24 176.11 1hqd n THR 280 N 0.36 0.06 0.85 6.45 -2.24 -1.26 -0.93 114.28 117.57 1hqd n THR 280 Ca -0.05 -0.07 0.10 0.00 -2.27 0.00 0.00 64.05 61.77 1hqd n THR 280 Cb 0.59 0.70 -0.10 0.00 -2.10 0.00 0.00 70.33 69.42 1hqd n THR 280 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1hqd n SER 281 N -0.04 0.83 -4.66 3.42 7.64 -1.26 -4.32 113.62 115.22 1hqd n SER 281 Ca 0.00 -0.80 -0.48 0.00 1.01 0.00 0.00 58.87 58.61 1hqd n SER 281 Cb 0.60 1.07 -0.05 0.00 -1.01 0.00 0.00 64.21 64.83 1hqd n SER 281 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1hqd n TYR 282 N -1.62 2.15 -1.68 1.43 4.01 -1.26 -4.77 117.16 115.42 1hqd n TYR 282 Ca 0.03 0.28 -0.41 0.00 -0.16 0.00 0.00 57.90 57.64 1hqd n TYR 282 Cb 0.37 -2.53 -0.01 0.00 -0.31 0.00 0.00 39.34 36.86 1hqd n TYR 282 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1hqd n LYS 283 N 4.09 3.27 -4.59 -0.72 5.02 -1.26 -0.93 118.16 123.04 1hqd n LYS 283 Ca 0.19 -2.62 -0.27 0.00 -2.02 0.00 0.00 58.31 53.59 1hqd n LYS 283 Cb 0.26 -3.07 -0.14 0.00 -0.02 0.00 0.00 35.03 32.06 1hqd n LYS 283 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 1hqd s TRP 284 N 2.38 2.05 0.64 2.13 0.51 -1.26 -4.22 118.94 121.17 1hqd s TRP 284 Ca 0.53 -0.39 0.01 0.00 -2.12 0.00 0.00 56.10 54.13 1hqd s TRP 284 Cb 0.15 -1.18 0.09 0.00 -0.81 0.00 0.00 33.47 31.72 1hqd s TRP 284 CO -0.07 0.18 0.89 0.54 -0.51 0.00 0.00 176.95 177.97 1hqd s ASN 285 N -1.53 4.78 0.38 2.95 2.20 -1.26 -1.75 114.94 120.71 1hqd s ASN 285 Ca 0.10 -0.29 0.12 0.00 -0.94 0.00 0.00 52.86 51.84 1hqd s ASN 285 Cb -0.10 -0.30 0.91 0.00 -2.00 0.00 0.00 41.25 39.77 1hqd s ASN 285 CO 0.03 -1.53 1.87 -0.74 -2.94 0.00 0.00 177.10 173.79 1hqd h HIS 286 N -0.22 0.71 0.00 1.54 -0.00 0.09 -2.67 115.15 114.60 1hqd h HIS 286 Ca -0.38 0.02 -0.07 0.00 -0.00 0.00 0.00 60.37 59.94 1hqd h HIS 286 Cb 1.28 -0.22 -0.01 0.00 -0.00 0.00 0.00 27.41 28.46 1hqd h HIS 286 CO 0.09 0.24 -0.75 -0.07 -0.00 0.00 0.00 177.93 177.44 1hqd h LEU 287 N 0.58 0.00 -1.76 0.26 3.38 -1.86 -3.26 115.31 112.65 1hqd h LEU 287 Ca 0.44 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.39 1hqd h LEU 287 Cb 0.85 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.60 1hqd h LEU 287 CO -0.19 0.28 -0.13 0.44 0.09 0.00 0.00 178.44 178.94 1hqd h ASP 288 N 0.00 0.00 -0.45 -0.43 3.32 -1.53 -1.02 116.42 116.31 1hqd h ASP 288 Ca -0.04 0.00 0.13 0.00 0.02 0.00 0.00 57.03 57.14 1hqd h ASP 288 Cb 1.25 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.79 1hqd h ASP 288 CO 0.03 0.13 0.33 -0.33 -1.72 0.00 0.00 179.24 177.67 1hqd h GLU 289 N 0.00 0.00 -0.31 3.56 5.08 -1.59 0.00 114.58 121.32 1hqd h GLU 289 Ca -0.00 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.21 1hqd h GLU 289 Cb 0.22 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.38 1hqd h GLU 289 CO 0.02 0.00 -0.11 0.44 -1.00 0.00 0.00 179.01 178.36 1hqd n ILE 290 N -4.39 2.50 -3.79 3.13 -5.35 -0.76 -4.93 119.36 105.77 1hqd n ILE 290 Ca 0.08 -2.74 -0.25 0.00 -0.27 0.00 0.00 62.75 59.57 1hqd n ILE 290 Cb 0.53 -0.31 0.03 0.00 -1.74 0.00 0.00 39.64 38.16 1hqd n ILE 290 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 1hqd n ASN 291 N -1.09 -2.95 -4.41 7.28 5.15 -0.01 -3.23 115.26 115.99 1hqd n ASN 291 Ca 0.31 -0.79 -0.22 0.00 -0.60 0.00 0.00 54.58 53.28 1hqd n ASN 291 Cb 0.99 -4.03 -0.10 0.00 -0.53 0.00 0.00 39.78 36.11 1hqd n ASN 291 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1hqd s GLN 292 N -6.27 1.51 -0.11 1.20 -1.52 -0.46 -1.25 119.66 112.76 1hqd s GLN 292 Ca 0.31 -1.67 -0.17 0.00 -1.95 0.00 0.00 55.36 51.88 1hqd s GLN 292 Cb -0.15 -1.49 -0.04 0.00 -0.22 0.00 0.00 33.01 31.10 1hqd s GLN 292 CO 0.82 0.27 0.45 -0.51 -0.25 0.00 0.00 175.29 176.07 1hqd s LEU 293 N -3.35 4.29 -1.44 2.90 1.43 -1.25 -3.61 118.68 117.64 1hqd s LEU 293 Ca 0.26 0.79 -0.10 0.00 -1.03 0.00 0.00 54.13 54.05 1hqd s LEU 293 Cb -0.03 -2.65 0.04 0.00 0.03 0.00 0.00 46.19 43.57 1hqd s LEU 293 CO 0.11 0.04 0.99 0.18 0.23 0.00 0.00 176.35 177.91 1hqd n LEU 294 N 3.48 -2.92 -0.41 1.79 7.99 -1.26 -2.31 117.00 123.36 1hqd n LEU 294 Ca -0.08 -0.56 -0.05 0.00 -0.01 0.00 0.00 56.01 55.30 1hqd n LEU 294 Cb 0.52 -2.83 -0.02 0.00 -0.11 0.00 0.00 43.42 40.97 1hqd n LEU 294 CO 0.42 0.50 -0.05 0.61 -1.51 0.00 0.00 177.39 177.36 1hqd n GLY 295 N -1.79 0.74 3.74 -0.72 0.00 -0.38 -5.01 105.19 101.77 1hqd n GLY 295 Ca -0.00 -0.31 -0.38 0.00 0.00 0.00 0.00 46.02 45.34 1hqd n GLY 295 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1hqd s VAL 296 N -1.98 5.19 0.06 1.61 1.01 -0.98 -4.92 120.40 120.39 1hqd s VAL 296 Ca 0.00 0.86 -0.11 0.00 0.00 0.00 0.00 61.98 62.73 1hqd s VAL 296 Cb 0.00 -3.77 0.01 0.00 0.00 0.00 0.00 36.38 32.62 1hqd s VAL 296 CO 0.00 0.37 0.25 0.00 0.00 0.00 0.00 175.10 175.72 1hqd s ARG 297 N 0.38 0.79 0.89 2.72 1.70 -1.26 -3.95 118.95 120.22 1hqd s ARG 297 Ca 0.24 -0.65 -0.11 0.00 -0.47 0.00 0.00 55.73 54.73 1hqd s ARG 297 Cb -0.15 0.33 0.12 0.00 -0.57 0.00 0.00 34.95 34.69 1hqd s ARG 297 CO 0.09 -0.25 1.12 0.41 -1.08 0.00 0.00 175.30 175.60 1hqd n GLY 298 N 0.44 -0.37 0.33 3.88 0.00 -1.26 -4.69 105.19 103.52 1hqd n GLY 298 Ca -0.18 -0.65 0.16 0.00 0.00 0.00 0.00 46.02 45.35 1hqd n GLY 298 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hqd h ALA 299 N -1.60 2.01 -0.15 4.61 0.00 -1.86 -1.74 119.26 120.54 1hqd h ALA 299 Ca -0.44 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1hqd h ALA 299 Cb 1.28 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1hqd h ALA 299 CO 0.42 -0.31 0.00 0.09 0.00 0.00 0.00 179.25 179.45 1hqd n ASN 300 N -4.11 2.59 -4.74 0.00 3.02 -0.30 -4.94 115.26 106.77 1hqd n ASN 300 Ca 0.02 -1.85 -0.40 0.00 -0.03 0.00 0.00 54.58 52.32 1hqd n ASN 300 Cb 0.33 -0.09 -0.05 0.00 -0.61 0.00 0.00 39.78 39.36 1hqd n ASN 300 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1hqd s ALA 301 N -1.83 3.33 0.80 5.41 0.00 -0.66 -4.64 121.76 124.18 1hqd s ALA 301 Ca 0.34 0.42 -0.11 0.00 0.00 0.00 0.00 51.96 52.61 1hqd s ALA 301 Cb 0.21 -3.11 0.07 0.00 0.00 0.00 0.00 23.12 20.29 1hqd s ALA 301 CO 0.31 0.07 1.10 -1.21 0.00 0.00 0.00 175.76 176.02 1hqd s GLU 302 N -0.26 2.04 -0.37 0.00 8.01 -1.26 -4.91 118.70 121.94 1hqd s GLU 302 Ca 0.41 1.16 -0.29 0.00 0.01 0.00 0.00 54.97 56.26 1hqd s GLU 302 Cb -0.22 -1.87 0.01 0.00 -4.31 0.00 0.00 34.13 27.73 1hqd s GLU 302 CO 0.26 -1.80 1.40 0.34 0.01 0.00 0.00 175.26 175.48 1hqd s ASP 303 N -3.34 6.42 0.34 -0.19 -1.08 -1.26 -4.90 116.67 112.66 1hqd s ASP 303 Ca 0.62 0.98 0.06 0.00 -0.52 0.00 0.00 52.55 53.69 1hqd s ASP 303 Cb -0.18 -2.54 0.63 0.00 -1.46 0.00 0.00 42.92 39.37 1hqd s ASP 303 CO 0.56 -1.34 1.85 1.55 0.52 0.00 0.00 175.17 178.32 1hqd h PRO 304 N 10.37 0.39 -0.25 4.34 0.13 -1.92 -2.33 132.00 142.73 1hqd h PRO 304 Ca -0.28 -0.10 -0.02 0.00 -0.87 0.00 0.00 66.00 64.73 1hqd h PRO 304 Cb 1.11 -0.05 -0.01 0.00 0.13 0.00 0.00 31.00 32.18 1hqd h PRO 304 CO 1.07 0.51 0.07 0.28 -0.23 0.00 0.00 178.00 179.70 1hqd h VAL 305 N 0.36 1.21 -0.76 1.56 2.07 -1.91 -1.92 116.25 116.85 1hqd h VAL 305 Ca 0.07 -0.66 -0.04 0.00 0.82 0.00 0.00 66.70 66.89 1hqd h VAL 305 Cb 0.44 1.18 -0.03 0.00 -1.52 0.00 0.00 31.29 31.35 1hqd h VAL 305 CO 0.02 0.21 0.32 0.00 0.02 0.00 0.00 177.57 178.15 1hqd h ALA 306 N 0.89 0.98 -0.34 1.67 0.00 -1.94 -0.30 119.26 120.21 1hqd h ALA 306 Ca 0.08 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1hqd h ALA 306 Cb 0.26 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1hqd h ALA 306 CO -0.00 0.58 0.19 0.28 0.00 0.00 0.00 179.25 180.30 1hqd h VAL 307 N 1.08 1.14 -0.54 0.00 2.07 -1.27 0.75 116.25 119.48 1hqd h VAL 307 Ca 0.25 -0.36 -0.09 0.00 0.82 0.00 0.00 66.70 67.33 1hqd h VAL 307 Cb 0.18 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 30.68 1hqd h VAL 307 CO -0.02 0.14 -0.02 0.40 0.02 0.00 0.00 177.57 178.08 1hqd h ILE 308 N 0.43 1.26 -0.27 4.57 2.04 -1.17 -1.86 117.51 122.51 1hqd h ILE 308 Ca 0.12 -1.12 -0.01 0.00 1.00 0.00 0.00 64.86 64.85 1hqd h ILE 308 Cb 0.06 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 36.99 1hqd h ILE 308 CO -0.02 0.40 0.12 -0.09 0.00 0.00 0.00 178.15 178.56 1hqd h ARG 309 N 0.86 0.40 -0.32 2.37 2.43 -0.69 -1.77 114.38 117.66 1hqd h ARG 309 Ca 0.16 -0.07 -0.02 0.00 -0.81 0.00 0.00 59.98 59.24 1hqd h ARG 309 Cb 0.54 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.00 1hqd h ARG 309 CO 0.03 0.41 0.11 1.15 -1.51 0.00 0.00 179.97 180.16 1hqd h THR 310 N 0.30 1.14 -0.34 0.20 2.02 -0.73 -1.98 112.91 113.52 1hqd h THR 310 Ca 0.09 -0.46 -0.14 0.00 0.77 0.00 0.00 66.41 66.67 1hqd h THR 310 Cb 0.15 0.78 -0.01 0.00 -1.74 0.00 0.00 68.15 67.34 1hqd h THR 310 CO -0.01 0.17 -0.34 -0.74 0.37 0.00 0.00 175.52 174.97 1hqd h HIS 311 N 0.46 0.90 -0.89 3.16 -0.00 -0.87 0.43 115.15 118.32 1hqd h HIS 311 Ca 0.11 -0.25 0.02 0.00 -0.00 0.00 0.00 60.37 60.26 1hqd h HIS 311 Cb 0.13 -0.20 -0.05 0.00 -0.00 0.00 0.00 27.41 27.30 1hqd h HIS 311 CO 0.00 1.00 0.59 0.00 -0.00 0.00 0.00 177.93 179.52 1hqd h ALA 312 N 0.98 1.40 -0.46 5.26 0.00 -0.61 0.18 119.26 126.00 1hqd h ALA 312 Ca 0.06 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 1hqd h ALA 312 Cb 0.88 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1hqd h ALA 312 CO 0.08 0.54 -0.19 -0.97 0.00 0.00 0.00 179.25 178.71 1hqd h ASN 313 N 1.17 0.92 -0.66 0.00 -1.24 -0.91 -1.01 115.58 113.85 1hqd h ASN 313 Ca 0.34 -0.33 0.02 0.00 0.71 0.00 0.00 56.30 57.04 1hqd h ASN 313 Cb -0.07 -0.25 -0.04 0.00 0.73 0.00 0.00 38.32 38.69 1hqd h ASN 313 CO -0.09 1.09 0.42 -0.09 -1.29 0.00 0.00 177.43 177.47 1hqd h ARG 314 N 0.80 0.81 -0.67 6.67 2.43 0.71 -0.13 114.38 125.00 1hqd h ARG 314 Ca 0.11 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 59.19 1hqd h ARG 314 Cb 0.74 -0.18 -0.03 0.00 -0.42 0.00 0.00 29.97 30.07 1hqd h ARG 314 CO 0.06 0.54 0.26 -0.07 -1.51 0.00 0.00 179.97 179.24 1hqd h LEU 315 N 0.84 0.94 0.24 3.80 3.38 -0.37 -1.32 115.31 122.81 1hqd h LEU 315 Ca 0.26 -0.18 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 1hqd h LEU 315 Cb -0.02 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 1hqd h LEU 315 CO -0.09 0.86 -0.21 0.50 0.09 0.00 0.00 178.44 179.60 1hqd h LYS 316 N 0.96 -0.45 0.00 1.13 3.64 -0.39 -1.79 116.57 119.66 1hqd h LYS 316 Ca 0.22 0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.62 1hqd h LYS 316 Cb 0.23 0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 32.15 1hqd h LYS 316 CO -0.02 -0.30 -0.06 -0.07 -2.27 0.00 0.00 179.45 176.73 1hqd h LEU 317 N -0.47 0.00 -0.11 5.20 3.38 -0.90 -0.88 115.31 121.54 1hqd h LEU 317 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1hqd h LEU 317 Cb 0.43 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.18 1hqd h LEU 317 CO -0.03 0.06 0.00 0.00 0.09 0.00 0.00 178.44 178.56 1hqd n ALA 318 N -2.38 2.17 0.00 1.53 0.00 -0.51 -4.92 120.51 116.41 1hqd n ALA 318 Ca -0.03 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1hqd n ALA 318 Cb 0.15 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.15 1hqd n ALA 318 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hqd n GLY 319 N 1.10 0.83 0.28 0.00 0.00 -0.33 -5.07 105.19 101.99 1hqd n GLY 319 Ca 0.05 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.11 1hqd n GLY 319 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65