#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hqb s VAL 2 N 0.00 0.00 0.16 1.61 1.01 -0.31 -4.07 120.40 118.81 2hqb s VAL 2 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 61.98 62.06 2hqb s VAL 2 Cb 0.00 -1.00 -0.04 0.00 0.00 0.00 0.00 36.38 35.34 2hqb s VAL 2 CO 0.00 0.00 -0.05 -0.83 0.00 0.00 0.00 175.10 174.22 2hqb s GLY 3 N 1.12 1.75 -0.05 4.51 0.00 0.15 -0.30 107.32 114.50 2hqb s GLY 3 Ca -0.06 -1.38 0.01 0.00 0.00 0.00 0.00 44.72 43.29 2hqb s GLY 3 CO -0.13 -1.39 -0.05 -2.27 0.00 0.00 0.00 173.10 169.27 2hqb s LEU 4 N -2.76 1.30 -0.11 0.66 2.96 0.07 -0.57 118.68 120.24 2hqb s LEU 4 Ca 0.25 -0.14 -0.04 0.00 -0.22 0.00 0.00 54.13 53.99 2hqb s LEU 4 Cb -0.09 -0.48 -0.04 0.00 0.50 0.00 0.00 46.19 46.08 2hqb s LEU 4 CO 0.16 -0.06 0.04 -0.76 -1.32 0.00 0.00 176.35 174.42 2hqb s LEU 5 N 0.98 3.79 0.02 -0.68 1.43 0.66 -0.89 118.68 123.99 2hqb s LEU 5 Ca -0.10 0.21 0.00 0.00 -1.03 0.00 0.00 54.13 53.21 2hqb s LEU 5 Cb -0.14 -1.90 -0.02 0.00 0.03 0.00 0.00 46.19 44.17 2hqb s LEU 5 CO -0.00 0.35 -0.03 0.54 0.23 0.00 0.00 176.35 177.44 2hqb s VAL 6 N -0.72 0.18 0.34 -1.59 0.11 -0.86 -1.87 120.40 115.99 2hqb s VAL 6 Ca 0.12 -0.74 0.09 0.00 -2.93 0.00 0.00 61.98 58.51 2hqb s VAL 6 Cb -0.12 -0.28 -0.05 0.00 -1.53 0.00 0.00 36.38 34.40 2hqb s VAL 6 CO 0.02 -0.36 -0.01 -1.83 -3.33 0.00 0.00 175.10 169.59 2hqb s GLU 7 N -1.16 2.03 0.09 1.54 -1.05 -1.26 -1.64 118.70 117.26 2hqb s GLU 7 Ca -0.11 -1.76 -0.31 0.00 -0.15 0.00 0.00 54.97 52.64 2hqb s GLU 7 Cb -0.08 -1.90 -0.09 0.00 -0.44 0.00 0.00 34.13 31.62 2hqb s GLU 7 CO -0.01 0.15 1.82 -0.51 0.95 0.00 0.00 175.26 177.67 2hqb s ASP 8 N -3.69 6.47 -0.00 0.83 1.01 -1.26 -4.83 116.67 115.19 2hqb s ASP 8 Ca 0.34 2.68 -0.01 0.00 0.71 0.00 0.00 52.55 56.27 2hqb s ASP 8 Cb -0.00 -2.56 -0.00 0.00 1.01 0.00 0.00 42.92 41.37 2hqb s ASP 8 CO 0.19 -0.99 0.02 1.07 0.21 0.00 0.00 175.17 175.67 2hqb n THR 9 N 4.95 0.00 0.00 -1.27 5.66 -1.26 -5.13 114.28 117.23 2hqb n THR 9 Ca 0.18 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.18 2hqb n THR 9 Cb 0.39 -0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.17 2hqb n THR 9 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2hqb n GLY 14 N 0.04 0.68 3.46 1.09 0.00 -1.26 -5.05 105.19 104.14 2hqb n GLY 14 Ca 0.00 -0.01 -0.49 0.00 0.00 0.00 0.00 46.02 45.53 2hqb n GLY 14 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2hqb n TRP 15 N 0.00 1.53 0.49 1.61 5.03 -1.26 -4.77 117.44 120.08 2hqb n TRP 15 Ca 0.00 0.26 0.04 0.00 3.03 0.00 0.00 57.50 60.83 2hqb n TRP 15 Cb 0.00 -2.54 0.22 0.00 -1.03 0.00 0.00 31.31 27.97 2hqb n TRP 15 CO 0.00 0.00 0.00 0.09 -0.03 0.00 0.00 177.69 177.75 2hqb n ASN 16 N 10.40 0.00 0.08 -0.99 3.02 -1.26 -1.92 115.26 124.59 2hqb n ASN 16 Ca 0.42 -0.26 -0.08 0.00 -0.03 0.00 0.00 54.58 54.63 2hqb n ASN 16 Cb 0.25 0.00 -0.08 0.00 -0.61 0.00 0.00 39.78 39.34 2hqb n ASN 16 CO 0.00 0.00 0.00 0.08 -2.62 0.00 0.00 177.26 174.72 2hqb h ARG 17 N 0.00 0.08 0.00 3.52 0.11 -1.99 -2.08 114.38 114.02 2hqb h ARG 17 Ca 0.00 -0.11 0.00 0.00 0.10 0.00 0.00 59.98 59.97 2hqb h ARG 17 Cb 0.00 0.04 0.00 0.00 1.11 0.00 0.00 29.97 31.12 2hqb h ARG 17 CO 0.00 0.99 0.00 0.87 0.10 0.00 0.00 179.97 181.93 2hqb h LYS 18 N 0.03 0.00 0.14 0.08 1.79 -1.77 0.79 116.57 117.64 2hqb h LYS 18 Ca -0.04 0.00 -0.33 0.00 -2.18 0.00 0.00 60.65 58.10 2hqb h LYS 18 Cb 1.70 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 32.34 2hqb h LYS 18 CO 0.14 0.00 -1.67 0.00 -1.08 0.00 0.00 179.45 176.83 2hqb h ALA 19 N 2.03 0.26 -0.11 3.86 0.00 -1.60 -2.79 119.26 120.91 2hqb h ALA 19 Ca 0.00 -1.16 -0.00 0.00 0.00 0.00 0.00 54.91 53.74 2hqb h ALA 19 Cb 0.28 0.40 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 2hqb h ALA 19 CO 0.00 1.13 0.06 1.88 0.00 0.00 0.00 179.25 182.32 2hqb h TYR 20 N 0.08 0.15 0.00 0.00 0.99 -0.68 0.80 116.97 118.31 2hqb h TYR 20 Ca -0.30 -0.00 -0.04 0.00 2.00 0.00 0.00 58.73 60.38 2hqb h TYR 20 Cb 2.05 -0.05 -0.01 0.00 1.00 0.00 0.00 36.73 39.73 2hqb h TYR 20 CO 0.08 0.15 -0.21 1.05 -0.00 0.00 0.00 178.16 179.24 2hqb h GLU 21 N 0.09 0.00 0.07 4.88 4.11 -1.00 -0.56 114.58 122.18 2hqb h GLU 21 Ca 0.04 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.46 2hqb h GLU 21 Cb 0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.30 2hqb h GLU 21 CO -0.01 0.21 -0.03 0.78 0.07 0.00 0.00 179.01 180.03 2hqb h GLY 22 N 0.85 -0.10 1.02 1.06 0.00 -0.98 -1.03 103.07 103.90 2hqb h GLY 22 Ca -0.00 0.04 -0.01 0.00 0.00 0.00 0.00 47.33 47.35 2hqb h GLY 22 CO 0.03 -0.04 0.55 -2.00 0.00 0.00 0.00 176.54 175.08 2hqb h LEU 23 N -0.40 1.14 -1.14 3.11 5.85 -0.66 -0.97 115.31 122.24 2hqb h LEU 23 Ca -0.01 -0.08 0.01 0.00 0.84 0.00 0.00 57.88 58.64 2hqb h LEU 23 Cb 0.35 -0.29 -0.04 0.00 0.37 0.00 0.00 40.66 41.04 2hqb h LEU 23 CO 0.02 0.89 0.58 -0.07 -0.34 0.00 0.00 178.44 179.51 2hqb h LEU 24 N 1.30 0.99 -0.26 2.25 3.38 -0.82 -2.06 115.31 120.08 2hqb h LEU 24 Ca 0.33 -0.02 -0.17 0.00 0.09 0.00 0.00 57.88 58.11 2hqb h LEU 24 Cb -0.03 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.45 2hqb h LEU 24 CO -0.06 0.71 -0.83 0.78 0.09 0.00 0.00 178.44 179.13 2hqb h ASN 25 N 1.17 0.00 0.55 -0.43 2.35 -0.65 -1.75 115.58 116.81 2hqb h ASN 25 Ca 0.33 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 56.06 2hqb h ASN 25 Cb -0.10 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.26 2hqb h ASN 25 CO -0.08 0.83 -0.39 0.40 -1.65 0.00 0.00 177.43 176.54 2hqb h ILE 26 N 0.00 0.20 0.00 2.81 2.04 -0.56 1.60 117.51 123.60 2hqb h ILE 26 Ca -0.01 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.84 2hqb h ILE 26 Cb 1.51 0.20 -0.00 0.00 -0.74 0.00 0.00 36.82 37.80 2hqb h ILE 26 CO 0.11 0.00 -0.03 -0.74 0.00 0.00 0.00 178.15 177.48 2hqb h HIS 27 N -0.91 0.00 0.00 1.37 2.76 -1.39 -1.65 115.15 115.32 2hqb h HIS 27 Ca -0.06 0.00 -0.07 0.00 -2.20 0.00 0.00 60.37 58.04 2hqb h HIS 27 Cb 0.76 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.71 2hqb h HIS 27 CO -0.14 0.03 -0.69 1.03 -1.30 0.00 0.00 177.93 176.86 2hqb h SER 28 N 0.00 0.00 1.47 3.26 0.87 -0.29 -3.39 113.55 115.47 2hqb h SER 28 Ca -0.00 -0.17 0.00 0.00 -1.23 0.00 0.00 61.79 60.39 2hqb h SER 28 Cb 0.14 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.10 2hqb h SER 28 CO 0.00 0.96 0.00 0.78 -0.53 0.00 0.00 176.83 178.04 2hqb h ASN 29 N -1.00 0.00 -5.41 6.23 2.35 0.22 -3.43 115.58 114.54 2hqb h ASN 29 Ca -0.10 0.00 -0.60 0.00 -0.55 0.00 0.00 56.30 55.05 2hqb h ASN 29 Cb 0.72 0.00 -0.08 0.00 0.05 0.00 0.00 38.32 39.01 2hqb h ASN 29 CO -0.06 0.00 -0.36 0.18 -1.65 0.00 0.00 177.43 175.54 2hqb n LEU 30 N -2.91 0.00 -1.65 1.61 4.77 -0.62 -5.06 117.00 113.13 2hqb n LEU 30 Ca 0.03 -2.92 -0.17 0.00 -0.03 0.00 0.00 56.01 52.92 2hqb n LEU 30 Cb 0.41 0.14 0.09 0.00 -2.33 0.00 0.00 43.42 41.73 2hqb n LEU 30 CO 0.30 -0.51 0.43 -0.67 -1.33 0.00 0.00 177.39 175.60 2hqb n ASP 31 N -1.59 4.23 -4.99 -1.43 -0.08 -1.26 -4.59 116.55 106.84 2hqb n ASP 31 Ca -0.10 -3.79 -0.19 0.00 -1.51 0.00 0.00 54.79 49.20 2hqb n ASP 31 Cb 0.62 -0.49 0.02 0.00 2.34 0.00 0.00 41.12 43.61 2hqb n ASP 31 CO 0.00 0.00 0.00 0.68 0.12 0.00 0.00 177.20 178.00 2hqb s VAL 32 N -4.16 2.81 -0.12 5.18 -7.23 -1.26 -5.08 120.40 110.55 2hqb s VAL 32 Ca 0.49 -0.87 -0.12 0.00 -1.81 0.00 0.00 61.98 59.66 2hqb s VAL 32 Cb 0.41 -2.94 -0.05 0.00 0.56 0.00 0.00 36.38 34.36 2hqb s VAL 32 CO 0.01 0.00 0.28 -1.81 -0.31 0.00 0.00 175.10 173.27 2hqb s ASP 33 N -4.40 6.50 0.07 4.85 1.11 -1.26 -4.53 116.67 119.01 2hqb s ASP 33 Ca 0.56 0.59 0.06 0.00 0.18 0.00 0.00 52.55 53.95 2hqb s ASP 33 Cb -0.10 -2.17 -0.04 0.00 1.07 0.00 0.00 42.92 41.69 2hqb s ASP 33 CO 0.35 0.22 -0.12 -0.69 1.18 0.00 0.00 175.17 176.12 2hqb s VAL 34 N -0.21 3.25 -0.06 -1.27 1.01 -1.26 -1.16 120.40 120.70 2hqb s VAL 34 Ca 0.17 -1.16 -0.05 0.00 0.00 0.00 0.00 61.98 60.95 2hqb s VAL 34 Cb -0.14 -2.46 0.02 0.00 0.00 0.00 0.00 36.38 33.80 2hqb s VAL 34 CO 0.06 0.23 0.16 -0.69 0.00 0.00 0.00 175.10 174.86 2hqb s VAL 35 N -1.09 -0.01 -0.04 2.92 1.01 0.59 -4.96 120.40 118.81 2hqb s VAL 35 Ca 0.19 0.05 0.07 0.00 0.00 0.00 0.00 61.98 62.28 2hqb s VAL 35 Cb -0.11 -0.24 -0.02 0.00 0.00 0.00 0.00 36.38 36.02 2hqb s VAL 35 CO 0.10 0.02 -0.25 -0.22 0.00 0.00 0.00 175.10 174.75 2hqb s LEU 36 N 0.40 2.09 -0.11 3.92 2.96 -1.26 -0.75 118.68 125.92 2hqb s LEU 36 Ca -0.03 -0.48 0.03 0.00 -0.22 0.00 0.00 54.13 53.43 2hqb s LEU 36 Cb -0.04 -1.37 0.01 0.00 0.50 0.00 0.00 46.19 45.29 2hqb s LEU 36 CO -0.02 0.28 -0.19 -1.61 -1.32 0.00 0.00 176.35 173.50 2hqb s GLU 37 N -0.37 2.55 0.40 1.98 0.41 -0.07 -4.93 118.70 118.66 2hqb s GLU 37 Ca 0.03 -0.69 0.08 0.00 -0.41 0.00 0.00 54.97 53.97 2hqb s GLU 37 Cb -0.12 -2.05 -0.04 0.00 -1.78 0.00 0.00 34.13 30.14 2hqb s GLU 37 CO 0.02 0.03 0.24 -1.21 -0.49 0.00 0.00 175.26 173.85 2hqb s GLU 38 N 0.71 2.36 -1.31 1.61 2.02 -1.26 -2.04 118.70 120.78 2hqb s GLU 38 Ca -0.12 -1.69 0.00 0.00 0.02 0.00 0.00 54.97 53.19 2hqb s GLU 38 Cb -0.16 -2.15 0.00 0.00 0.10 0.00 0.00 34.13 31.92 2hqb s GLU 38 CO 0.02 -0.10 0.00 0.41 0.02 0.00 0.00 175.26 175.61 2hqb n GLY 39 N -1.33 1.29 3.56 -1.39 0.00 -1.13 -4.90 105.19 101.29 2hqb n GLY 39 Ca 0.00 -0.26 -0.38 0.00 0.00 0.00 0.00 46.02 45.38 2hqb n GLY 39 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2hqb s VAL 40 N -2.33 3.70 -1.03 1.61 1.01 -0.65 -4.78 120.40 117.93 2hqb s VAL 40 Ca 0.00 -0.22 0.11 0.00 0.00 0.00 0.00 61.98 61.87 2hqb s VAL 40 Cb 0.00 -4.69 0.26 0.00 0.00 0.00 0.00 36.38 31.95 2hqb s VAL 40 CO 0.00 -1.61 1.17 0.59 0.00 0.00 0.00 175.10 175.25 2hqb n ASN 41 N 10.43 2.72 -3.77 3.32 5.03 -1.26 -4.19 115.26 127.54 2hqb n ASN 41 Ca 0.24 -1.89 -0.10 0.00 0.87 0.00 0.00 54.58 53.70 2hqb n ASN 41 Cb 0.50 -0.18 -0.06 0.00 -1.02 0.00 0.00 39.78 39.02 2hqb n ASN 41 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 2hqb s SER 42 N -0.99 -0.06 0.19 6.41 1.04 -1.26 -5.02 113.70 114.01 2hqb s SER 42 Ca 0.21 -0.54 -0.12 0.00 0.48 0.00 0.00 55.95 55.98 2hqb s SER 42 Cb 0.12 0.43 0.20 0.00 0.10 0.00 0.00 66.02 66.87 2hqb s SER 42 CO 0.15 -0.83 1.73 -0.08 0.98 0.00 0.00 173.24 175.20 2hqb h GLU 43 N 2.52 0.31 -0.47 4.02 4.81 -1.96 -0.76 114.58 123.05 2hqb h GLU 43 Ca -0.33 -0.02 0.05 0.00 -0.13 0.00 0.00 59.36 58.93 2hqb h GLU 43 Cb 1.23 -0.07 -0.07 0.00 0.63 0.00 0.00 28.75 30.47 2hqb h GLU 43 CO 0.50 0.20 -0.38 0.37 -0.73 0.00 0.00 179.01 178.97 2hqb h GLN 44 N 0.32 -0.13 -0.41 1.92 4.15 -1.99 0.47 115.11 119.44 2hqb h GLN 44 Ca 0.26 0.01 -0.00 0.00 0.77 0.00 0.00 58.65 59.69 2hqb h GLN 44 Cb 0.32 0.03 -0.02 0.00 0.21 0.00 0.00 27.48 28.01 2hqb h GLN 44 CO -0.29 -0.08 0.25 0.87 -1.93 0.00 0.00 178.83 177.65 2hqb h LYS 45 N -0.13 0.56 -0.53 1.69 1.57 -1.91 -1.84 116.57 115.97 2hqb h LYS 45 Ca 0.08 -0.05 0.08 0.00 -1.87 0.00 0.00 60.65 58.89 2hqb h LYS 45 Cb 0.33 -0.12 -0.06 0.00 0.08 0.00 0.00 32.23 32.46 2hqb h LYS 45 CO -0.51 0.41 0.18 0.00 -0.57 0.00 0.00 179.45 178.96 2hqb h ALA 46 N 1.12 0.66 -0.45 3.86 0.00 -0.01 0.13 119.26 124.56 2hqb h ALA 46 Ca 0.15 0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.10 2hqb h ALA 46 Cb -0.01 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 2hqb h ALA 46 CO -0.03 -0.22 0.16 0.45 0.00 0.00 0.00 179.25 179.61 2hqb h HIS 47 N 0.35 0.71 0.08 0.00 3.86 0.34 -2.28 115.15 118.22 2hqb h HIS 47 Ca 0.26 -0.06 -0.00 0.00 -1.16 0.00 0.00 60.37 59.41 2hqb h HIS 47 Cb 0.31 -0.21 0.00 0.00 1.06 0.00 0.00 27.41 28.57 2hqb h HIS 47 CO -0.17 0.62 -0.04 0.00 0.86 0.00 0.00 177.93 179.20 2hqb h ARG 48 N 0.59 -0.11 0.00 2.45 3.08 -0.67 -2.44 114.38 117.28 2hqb h ARG 48 Ca 0.15 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.21 2hqb h ARG 48 Cb 0.23 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.30 2hqb h ARG 48 CO -0.01 -0.03 0.00 0.54 -1.07 0.00 0.00 179.97 179.40 2hqb n ARG 49 N -5.12 0.09 0.03 0.04 5.12 0.39 -0.96 116.66 116.25 2hqb n ARG 49 Ca -0.08 0.46 -0.06 0.00 -1.93 0.00 0.00 57.85 56.23 2hqb n ARG 49 Cb 0.09 -1.71 -0.12 0.00 -1.16 0.00 0.00 32.46 29.56 2hqb n ARG 49 CO 0.00 0.00 0.00 0.82 -1.93 0.00 0.00 177.63 176.52 2hqb h ILE 50 N 0.00 1.17 0.22 0.55 2.04 -0.93 -2.62 117.51 117.94 2hqb h ILE 50 Ca 0.00 -2.91 -0.01 0.00 1.00 0.00 0.00 64.86 62.94 2hqb h ILE 50 Cb 0.15 2.56 0.00 0.00 -0.74 0.00 0.00 36.82 38.80 2hqb h ILE 50 CO 0.00 0.67 -0.11 0.11 0.00 0.00 0.00 178.15 178.82 2hqb h LYS 51 N 0.00 -0.28 -0.14 2.37 1.57 -0.76 -1.64 116.57 117.69 2hqb h LYS 51 Ca -0.14 0.02 0.04 0.00 -1.87 0.00 0.00 60.65 58.69 2hqb h LYS 51 Cb 1.84 0.06 -0.04 0.00 0.08 0.00 0.00 32.23 34.17 2hqb h LYS 51 CO 0.10 0.07 -0.12 0.93 -0.57 0.00 0.00 179.45 179.85 2hqb h GLU 52 N -0.70 -0.14 -0.48 3.15 5.08 -1.56 0.19 114.58 120.13 2hqb h GLU 52 Ca -0.03 0.01 0.09 0.00 -1.00 0.00 0.00 59.36 58.43 2hqb h GLU 52 Cb 0.48 0.03 -0.07 0.00 0.50 0.00 0.00 28.75 29.69 2hqb h GLU 52 CO 0.05 -0.09 0.03 -0.07 -1.00 0.00 0.00 179.01 177.93 2hqb h LEU 53 N -0.14 -0.13 -0.52 1.33 3.38 -1.40 0.57 115.31 118.40 2hqb h LEU 53 Ca 0.09 0.10 -0.07 0.00 0.09 0.00 0.00 57.88 58.10 2hqb h LEU 53 Cb 0.27 0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 2hqb h LEU 53 CO -0.22 -0.03 -0.33 0.58 0.09 0.00 0.00 178.44 178.52 2hqb h VAL 54 N 0.15 0.65 -0.23 1.22 2.07 -1.01 0.21 116.25 119.32 2hqb h VAL 54 Ca 0.24 -1.61 -0.05 0.00 0.82 0.00 0.00 66.70 66.11 2hqb h VAL 54 Cb 0.35 2.08 -0.01 0.00 -1.52 0.00 0.00 31.29 32.19 2hqb h VAL 54 CO -0.37 0.33 -0.05 0.44 0.02 0.00 0.00 177.57 177.94 2hqb h ASP 55 N 0.00 0.43 0.62 0.57 5.19 0.98 -2.22 116.42 121.99 2hqb h ASP 55 Ca -0.00 -0.36 0.00 0.00 -0.62 0.00 0.00 57.03 56.05 2hqb h ASP 55 Cb 1.06 -0.12 0.00 0.00 0.18 0.00 0.00 39.33 40.45 2hqb h ASP 55 CO 0.04 0.69 0.00 1.23 -3.12 0.00 0.00 179.24 178.08 2hqb h GLY 56 N 0.17 0.00 0.00 2.75 0.00 0.30 -3.46 103.07 102.83 2hqb h GLY 56 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.39 2hqb h GLY 56 CO 0.02 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.17 2hqb n GLY 57 N -0.28 1.44 3.86 4.60 0.00 -0.73 -5.08 105.19 109.01 2hqb n GLY 57 Ca 0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 2hqb n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2hqb s VAL 58 N -2.00 4.97 0.00 1.61 1.01 0.66 -4.93 120.40 121.72 2hqb s VAL 58 Ca 0.00 0.54 0.00 0.00 0.00 0.00 0.00 61.98 62.52 2hqb s VAL 58 Cb 0.00 -3.66 0.00 0.00 0.00 0.00 0.00 36.38 32.72 2hqb s VAL 58 CO 0.00 0.13 0.00 -0.46 0.00 0.00 0.00 175.10 174.77 2hqb n ASN 59 N 0.45 0.62 -4.00 3.32 6.94 -1.26 -4.40 115.26 116.94 2hqb n ASN 59 Ca -0.04 -0.27 -0.30 0.00 -0.02 0.00 0.00 54.58 53.95 2hqb n ASN 59 Cb 0.52 0.66 -0.16 0.00 -2.36 0.00 0.00 39.78 38.44 2hqb n ASN 59 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 2hqb s LEU 60 N -1.44 2.14 -0.17 -4.53 2.96 -1.26 -1.37 118.68 115.00 2hqb s LEU 60 Ca 0.00 -0.79 -0.00 0.00 -0.22 0.00 0.00 54.13 53.12 2hqb s LEU 60 Cb 0.00 -1.22 0.00 0.00 0.50 0.00 0.00 46.19 45.48 2hqb s LEU 60 CO 0.00 -0.12 -0.15 -0.63 -1.32 0.00 0.00 176.35 174.12 2hqb s ILE 61 N 1.42 2.56 0.09 6.68 1.01 -0.56 -0.67 121.20 131.72 2hqb s ILE 61 Ca 0.00 -0.79 -0.00 0.00 0.00 0.00 0.00 60.65 59.86 2hqb s ILE 61 Cb -0.15 -2.09 -0.04 0.00 0.01 0.00 0.00 42.46 40.18 2hqb s ILE 61 CO -0.09 0.51 0.25 -0.36 0.00 0.00 0.00 174.94 175.25 2hqb s PHE 62 N 1.08 3.51 -0.18 3.97 0.40 0.27 -0.99 117.98 126.04 2hqb s PHE 62 Ca -0.00 0.26 -0.01 0.00 -0.60 0.00 0.00 56.93 56.58 2hqb s PHE 62 Cb -0.14 -1.77 0.05 0.00 0.51 0.00 0.00 43.02 41.66 2hqb s PHE 62 CO -0.05 0.55 -0.01 0.20 0.70 0.00 0.00 175.22 176.61 2hqb s GLY 63 N -2.64 0.85 -0.81 4.36 0.00 -0.32 -0.25 107.32 108.52 2hqb s GLY 63 Ca 0.36 -0.78 -0.21 0.00 0.00 0.00 0.00 44.72 44.08 2hqb s GLY 63 CO 0.28 1.16 1.09 -1.58 0.00 0.00 0.00 173.10 174.04 2hqb s HIS 64 N 1.72 2.82 0.00 1.90 2.46 -0.78 -0.52 115.29 122.89 2hqb s HIS 64 Ca -0.01 -0.90 0.00 0.00 0.47 0.00 0.00 55.06 54.63 2hqb s HIS 64 Cb -0.16 -4.34 0.00 0.00 -0.13 0.00 0.00 32.58 27.95 2hqb s HIS 64 CO -0.07 -1.63 0.00 0.41 -2.47 0.00 0.00 174.74 170.98 2hqb n GLY 65 N 5.56 4.47 0.27 1.59 0.00 -1.15 -4.54 105.19 111.40 2hqb n GLY 65 Ca 0.11 -1.43 0.12 0.00 0.00 0.00 0.00 46.02 44.82 2hqb n GLY 65 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 2hqb h HIS 66 N 0.00 0.00 0.00 1.61 2.76 -1.75 -3.03 115.15 114.74 2hqb h HIS 66 Ca 0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 2hqb h HIS 66 Cb 0.00 0.00 0.00 0.00 1.55 0.00 0.00 27.41 28.96 2hqb h HIS 66 CO 0.00 0.06 -0.22 0.00 -1.30 0.00 0.00 177.93 176.48 2hqb h ALA 67 N 1.94 0.86 0.00 5.26 0.00 -1.92 -3.20 119.26 122.21 2hqb h ALA 67 Ca -0.00 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2hqb h ALA 67 Cb 0.15 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 2hqb h ALA 67 CO 0.01 0.00 -0.14 0.74 0.00 0.00 0.00 179.25 179.85 2hqb h PHE 68 N 0.00 0.00 -0.18 0.00 -1.00 -1.85 -2.22 116.94 111.69 2hqb h PHE 68 Ca 0.00 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.73 2hqb h PHE 68 Cb 0.80 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.35 2hqb h PHE 68 CO 0.00 0.14 -0.09 0.00 -1.61 0.00 0.00 178.31 176.76 2hqb h ALA 69 N 1.86 0.25 -0.67 2.45 0.00 -1.72 0.29 119.26 121.71 2hqb h ALA 69 Ca -0.00 -0.28 -0.08 0.00 0.00 0.00 0.00 54.91 54.55 2hqb h ALA 69 Cb 0.66 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.36 2hqb h ALA 69 CO 0.02 0.06 0.12 1.49 0.00 0.00 0.00 179.25 180.94 2hqb h GLU 70 N 0.05 1.10 -0.47 0.00 4.57 -1.69 -0.14 114.58 117.99 2hqb h GLU 70 Ca 0.04 -0.29 0.02 0.00 -1.18 0.00 0.00 59.36 57.95 2hqb h GLU 70 Cb 0.56 -0.13 -0.03 0.00 -0.16 0.00 0.00 28.75 28.99 2hqb h GLU 70 CO 0.03 1.00 0.28 1.88 -1.18 0.00 0.00 179.01 181.01 2hqb h TYR 71 N 1.02 0.52 0.00 0.92 0.99 -1.13 -2.35 116.97 116.94 2hqb h TYR 71 Ca 0.20 0.02 -0.10 0.00 2.00 0.00 0.00 58.73 60.85 2hqb h TYR 71 Cb 0.43 -0.17 -0.01 0.00 1.00 0.00 0.00 36.73 37.98 2hqb h TYR 71 CO 0.03 0.30 -0.49 0.74 -0.00 0.00 0.00 178.16 178.74 2hqb h PHE 72 N 0.56 0.00 -0.01 4.88 0.05 -0.16 -3.14 116.94 119.11 2hqb h PHE 72 Ca 0.19 0.00 -0.11 0.00 3.82 0.00 0.00 57.97 61.87 2hqb h PHE 72 Cb 0.02 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 37.95 2hqb h PHE 72 CO -0.07 0.49 -0.51 0.77 -0.18 0.00 0.00 178.31 178.82 2hqb h SER 73 N 0.00 0.02 -0.24 2.17 0.02 -0.50 0.35 113.55 115.38 2hqb h SER 73 Ca -0.00 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 2hqb h SER 73 Cb 0.92 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.46 2hqb h SER 73 CO 0.06 0.53 0.00 0.35 -1.14 0.00 0.00 176.83 176.63 2hqb n THR 74 N -3.94 0.74 -0.64 -2.27 -2.24 -1.03 -4.07 114.28 100.83 2hqb n THR 74 Ca -0.02 -0.45 0.00 0.00 -2.27 0.00 0.00 64.05 61.32 2hqb n THR 74 Cb 0.52 -0.17 0.00 0.00 -2.10 0.00 0.00 70.33 68.58 2hqb n THR 74 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2hqb n ILE 75 N 0.26 0.00 0.45 2.28 3.06 -0.96 -4.92 119.36 119.53 2hqb n ILE 75 Ca 0.10 0.00 0.05 0.00 -2.50 0.00 0.00 62.75 60.40 2hqb n ILE 75 Cb 0.44 0.33 0.26 0.00 0.54 0.00 0.00 39.64 41.21 2hqb n ILE 75 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2hqb n HIS 76 N 0.00 0.00 0.77 9.51 1.44 0.12 -2.28 115.22 124.78 2hqb n HIS 76 Ca 0.00 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 55.82 2hqb n HIS 76 Cb 0.00 -0.41 0.05 0.00 0.12 0.00 0.00 29.99 29.75 2hqb n HIS 76 CO 0.00 0.00 0.00 0.09 -2.81 0.00 0.00 176.34 173.62 2hqb n ASN 77 N -1.41 0.66 -1.18 4.39 3.02 -1.26 -3.86 115.26 115.61 2hqb n ASN 77 Ca 0.04 -0.39 0.12 0.00 -0.03 0.00 0.00 54.58 54.32 2hqb n ASN 77 Cb 0.11 0.70 0.23 0.00 -0.61 0.00 0.00 39.78 40.22 2hqb n ASN 77 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2hqb n GLN 78 N -1.74 2.53 -3.15 3.52 10.64 -0.96 -4.37 117.38 123.84 2hqb n GLN 78 Ca 0.03 -2.33 -0.21 0.00 -1.83 0.00 0.00 57.00 52.66 2hqb n GLN 78 Cb 0.39 -1.52 -0.04 0.00 -0.86 0.00 0.00 30.24 28.20 2hqb n GLN 78 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 2hqb n TYR 79 N 1.51 1.00 0.25 2.61 4.02 -1.25 -4.93 117.16 120.37 2hqb n TYR 79 Ca 0.20 -3.83 0.07 0.00 -0.01 0.00 0.00 57.90 54.33 2hqb n TYR 79 Cb 0.61 -0.43 0.60 0.00 -0.02 0.00 0.00 39.34 40.10 2hqb n TYR 79 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 2hqb h PRO 80 N 3.21 0.00 0.00 -0.72 0.13 -1.76 -1.64 132.00 131.22 2hqb h PRO 80 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 2hqb h PRO 80 Cb 0.85 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.98 2hqb h PRO 80 CO 0.57 0.05 0.00 -0.40 -0.23 0.00 0.00 178.00 177.99 2hqb n ASP 81 N -4.47 0.00 -4.08 1.44 5.75 -1.26 -4.75 116.55 109.17 2hqb n ASP 81 Ca -0.03 -1.15 -0.25 0.00 -0.01 0.00 0.00 54.79 53.35 2hqb n ASP 81 Cb 0.13 0.00 -0.16 0.00 -1.03 0.00 0.00 41.12 40.06 2hqb n ASP 81 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 2hqb s VAL 82 N -2.00 1.25 -0.10 2.12 1.01 -0.62 -4.90 120.40 117.16 2hqb s VAL 82 Ca 0.34 -0.60 -0.06 0.00 0.00 0.00 0.00 61.98 61.66 2hqb s VAL 82 Cb 0.16 -1.10 -0.04 0.00 0.00 0.00 0.00 36.38 35.40 2hqb s VAL 82 CO 0.26 0.37 0.14 -2.28 0.00 0.00 0.00 175.10 173.59 2hqb s HIS 83 N 0.25 3.57 -0.17 5.22 2.46 -0.47 -4.83 115.29 121.31 2hqb s HIS 83 Ca -0.07 0.48 0.01 0.00 0.47 0.00 0.00 55.06 55.95 2hqb s HIS 83 Cb -0.12 -1.91 0.01 0.00 -0.13 0.00 0.00 32.58 30.43 2hqb s HIS 83 CO 0.03 0.71 -0.18 -0.06 -2.47 0.00 0.00 174.74 172.76 2hqb s PHE 84 N -1.07 2.77 -0.09 3.88 0.40 0.28 -1.50 117.98 122.65 2hqb s PHE 84 Ca 0.17 -1.44 0.00 0.00 -0.60 0.00 0.00 56.93 55.06 2hqb s PHE 84 Cb -0.12 -1.91 -0.03 0.00 0.51 0.00 0.00 43.02 41.47 2hqb s PHE 84 CO 0.06 -0.70 -0.08 0.08 0.70 0.00 0.00 175.22 175.28 2hqb s VAL 85 N 1.15 3.54 0.15 -0.44 1.01 -0.16 0.37 120.40 126.02 2hqb s VAL 85 Ca 0.01 -0.52 0.10 0.00 0.00 0.00 0.00 61.98 61.58 2hqb s VAL 85 Cb -0.14 -2.47 -0.04 0.00 0.00 0.00 0.00 36.38 33.73 2hqb s VAL 85 CO -0.08 0.57 -0.24 -0.94 0.00 0.00 0.00 175.10 174.40 2hqb s SER 86 N -0.39 3.15 -0.43 3.32 1.04 -0.76 -1.17 113.70 118.46 2hqb s SER 86 Ca 0.05 -0.78 -0.16 0.00 0.48 0.00 0.00 55.95 55.55 2hqb s SER 86 Cb -0.12 -0.21 0.03 0.00 0.10 0.00 0.00 66.02 65.82 2hqb s SER 86 CO 0.02 0.12 0.36 0.12 0.98 0.00 0.00 173.24 174.85 2hqb s PHE 87 N -1.33 3.22 0.00 5.02 5.36 0.32 -0.64 117.98 129.92 2hqb s PHE 87 Ca 0.15 -0.62 0.00 0.00 -0.96 0.00 0.00 56.93 55.50 2hqb s PHE 87 Cb -0.09 -2.81 0.00 0.00 -0.34 0.00 0.00 43.02 39.78 2hqb s PHE 87 CO 0.07 -0.67 0.00 0.09 -1.46 0.00 0.00 175.22 173.24 2hqb n ASN 88 N 5.30 0.00 -2.01 6.13 3.02 0.63 -2.26 115.26 126.08 2hqb n ASN 88 Ca -0.10 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.45 2hqb n ASN 88 Cb 0.46 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.63 2hqb n ASN 88 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2hqb n GLY 89 N -2.00 -0.24 3.40 7.41 0.00 -1.26 -4.76 105.19 107.73 2hqb n GLY 89 Ca 0.00 -1.80 -0.34 0.00 0.00 0.00 0.00 46.02 43.88 2hqb n GLY 89 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2hqb s GLU 90 N -2.55 3.48 0.03 1.61 -1.05 -1.26 -4.82 118.70 114.15 2hqb s GLU 90 Ca 0.00 -0.61 0.02 0.00 -0.15 0.00 0.00 54.97 54.23 2hqb s GLU 90 Cb 0.00 -2.84 -0.02 0.00 -0.44 0.00 0.00 34.13 30.83 2hqb s GLU 90 CO 0.00 0.10 -0.07 0.54 0.95 0.00 0.00 175.26 176.78 2hqb s VAL 91 N 0.69 0.47 -0.06 1.83 0.11 -1.26 -4.80 120.40 117.39 2hqb s VAL 91 Ca -0.04 -0.83 0.00 0.00 -2.93 0.00 0.00 61.98 58.18 2hqb s VAL 91 Cb -0.15 -0.51 0.02 0.00 -1.53 0.00 0.00 36.38 34.21 2hqb s VAL 91 CO 0.02 -0.25 -0.03 -1.59 -3.33 0.00 0.00 175.10 169.92 2hqb s LYS 92 N -1.17 0.80 0.00 1.54 -2.85 -1.26 -4.21 119.74 112.58 2hqb s LYS 92 Ca -0.07 -0.05 0.00 0.00 -1.00 0.00 0.00 55.97 54.85 2hqb s LYS 92 Cb -0.08 -0.92 0.00 0.00 -2.06 0.00 0.00 37.83 34.77 2hqb s LYS 92 CO 0.00 -0.16 0.00 0.41 0.10 0.00 0.00 175.35 175.70 2hqb n GLY 93 N 4.44 -1.27 0.14 0.59 0.00 -1.26 -4.96 105.19 102.86 2hqb n GLY 93 Ca -0.19 -1.46 -0.23 0.00 0.00 0.00 0.00 46.02 44.15 2hqb n GLY 93 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2hqb n GLU 94 N -0.63 0.62 -1.18 1.61 1.02 -1.26 -4.23 120.64 116.59 2hqb n GLU 94 Ca 0.00 0.19 -0.26 0.00 -0.02 0.00 0.00 57.16 57.08 2hqb n GLU 94 Cb 0.00 -1.50 0.13 0.00 -0.02 0.00 0.00 31.44 30.05 2hqb n GLU 94 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 2hqb n ASN 95 N -3.64 5.00 -3.82 1.62 6.94 -1.26 -4.65 115.26 115.45 2hqb n ASN 95 Ca -0.49 -3.55 -0.15 0.00 -0.02 0.00 0.00 54.58 50.37 2hqb n ASN 95 Cb 0.95 -0.87 -0.15 0.00 -2.36 0.00 0.00 39.78 37.34 2hqb n ASN 95 CO 0.00 0.00 0.00 -0.51 -1.03 0.00 0.00 177.26 175.72 2hqb s ILE 96 N -3.52 0.03 0.26 1.53 2.07 -1.26 0.98 121.20 121.30 2hqb s ILE 96 Ca 0.55 0.11 0.02 0.00 -1.41 0.00 0.00 60.65 59.92 2hqb s ILE 96 Cb 0.45 -0.12 -0.05 0.00 0.13 0.00 0.00 42.46 42.87 2hqb s ILE 96 CO 0.06 0.08 0.07 -0.89 -1.91 0.00 0.00 174.94 172.35 2hqb s THR 97 N 0.71 0.79 -0.07 4.00 2.01 0.16 -1.39 115.64 121.86 2hqb s THR 97 Ca -0.06 -2.00 -0.07 0.00 0.31 0.00 0.00 61.69 59.86 2hqb s THR 97 Cb -0.09 -2.60 0.02 0.00 0.01 0.00 0.00 72.50 69.84 2hqb s THR 97 CO -0.02 -0.08 0.19 -0.94 -0.69 0.00 0.00 174.62 173.08 2hqb s SER 98 N -3.34 -0.18 -0.06 3.53 1.04 -0.28 -1.83 113.70 112.57 2hqb s SER 98 Ca 0.35 0.34 0.01 0.00 0.48 0.00 0.00 55.95 57.13 2hqb s SER 98 Cb 0.08 0.38 -0.03 0.00 0.10 0.00 0.00 66.02 66.55 2hqb s SER 98 CO 0.13 -0.10 -0.08 -0.76 0.98 0.00 0.00 173.24 173.40 2hqb s LEU 99 N -0.05 3.09 -0.00 2.42 1.43 0.18 -0.35 118.68 125.40 2hqb s LEU 99 Ca -0.02 -0.06 -0.00 0.00 -1.03 0.00 0.00 54.13 53.02 2hqb s LEU 99 Cb -0.02 -1.67 0.00 0.00 0.03 0.00 0.00 46.19 44.53 2hqb s LEU 99 CO 0.00 0.36 0.01 -1.00 0.23 0.00 0.00 176.35 175.95 2hqb s HIS 100 N -0.81 -0.00 -0.09 0.29 3.76 -0.63 -0.27 115.29 117.55 2hqb s HIS 100 Ca 0.12 0.03 -0.11 0.00 -0.15 0.00 0.00 55.06 54.95 2hqb s HIS 100 Cb -0.11 -0.03 -0.05 0.00 1.11 0.00 0.00 32.58 33.50 2hqb s HIS 100 CO 0.02 -0.01 0.26 -0.06 -0.85 0.00 0.00 174.74 174.09 2hqb s PHE 101 N 0.14 3.60 -0.18 1.40 0.40 -1.26 -0.17 117.98 121.91 2hqb s PHE 101 Ca -0.01 0.68 -0.28 0.00 -0.60 0.00 0.00 56.93 56.72 2hqb s PHE 101 Cb -0.02 -2.15 -0.00 0.00 0.51 0.00 0.00 43.02 41.36 2hqb s PHE 101 CO -0.00 0.58 0.96 -2.00 0.70 0.00 0.00 175.22 175.46 2hqb s GLU 102 N -0.66 4.30 -0.17 0.44 2.56 0.35 -4.87 118.70 120.66 2hqb s GLU 102 Ca 0.18 1.25 0.04 0.00 0.00 0.00 0.00 54.97 56.44 2hqb s GLU 102 Cb -0.14 -3.60 -0.22 0.00 2.00 0.00 0.00 34.13 32.17 2hqb s GLU 102 CO 0.07 -0.47 0.17 0.41 -0.56 0.00 0.00 175.26 174.88 2hqb n GLY 103 N 3.34 -0.66 0.37 -1.50 0.00 -1.26 -4.66 105.19 100.82 2hqb n GLY 103 Ca 0.09 -0.21 -0.11 0.00 0.00 0.00 0.00 46.02 45.79 2hqb n GLY 103 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2hqb h TYR 104 N 0.02 -1.10 0.00 1.61 3.20 -1.92 -2.84 116.97 115.94 2hqb h TYR 104 Ca -0.47 0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.45 2hqb h TYR 104 Cb 2.03 0.52 0.00 0.00 1.54 0.00 0.00 36.73 40.82 2hqb h TYR 104 CO 0.03 -0.44 0.00 0.00 -1.64 0.00 0.00 178.16 176.12 2hqb n ALA 105 N -2.96 0.36 0.00 1.82 0.00 -1.26 -1.43 120.51 117.04 2hqb n ALA 105 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2hqb n ALA 105 Cb 0.35 -0.28 0.00 0.00 0.00 0.00 0.00 19.45 19.51 2hqb n ALA 105 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2hqb n GLY 107 N -0.01 0.00 0.18 0.00 0.00 -1.07 -2.06 105.19 102.23 2hqb n GLY 107 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 2hqb n GLY 107 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2hqb h TYR 108 N 0.00 -0.41 -0.97 1.61 3.20 0.00 0.21 116.97 120.61 2hqb h TYR 108 Ca 0.00 -0.01 0.22 0.00 3.14 0.00 0.00 58.73 62.08 2hqb h TYR 108 Cb 0.00 0.14 -0.09 0.00 1.54 0.00 0.00 36.73 38.32 2hqb h TYR 108 CO 0.00 -0.26 0.62 0.74 -1.64 0.00 0.00 178.16 177.63 2hqb h PHE 109 N -0.46 0.73 -0.51 -3.82 0.04 -1.66 0.30 116.94 111.56 2hqb h PHE 109 Ca -0.05 0.02 -0.07 0.00 2.80 0.00 0.00 57.97 60.67 2hqb h PHE 109 Cb 0.34 -0.22 -0.02 0.00 2.20 0.00 0.00 35.95 38.26 2hqb h PHE 109 CO 0.14 0.15 0.03 0.78 -0.60 0.00 0.00 178.31 178.82 2hqb h GLY 110 N 0.51 0.95 -3.42 -1.45 0.00 -1.77 -2.99 103.07 94.90 2hqb h GLY 110 Ca 0.54 -0.67 0.00 0.00 0.00 0.00 0.00 47.33 47.19 2hqb h GLY 110 CO -0.27 0.62 0.00 0.61 0.00 0.00 0.00 176.54 177.50 2hqb n GLY 111 N -0.44 0.89 0.26 4.60 0.00 0.11 -1.01 105.19 109.59 2hqb n GLY 111 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2hqb n GLY 111 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2hqb n VAL 113 N 1.69 0.00 -0.15 1.61 0.31 -1.13 -1.48 118.33 119.18 2hqb n VAL 113 Ca 0.00 0.00 -0.14 0.00 -0.01 0.00 0.00 64.34 64.19 2hqb n VAL 113 Cb 0.12 0.00 -0.10 0.00 -0.91 0.00 0.00 33.84 32.95 2hqb n VAL 113 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2hqb h ALA 114 N 0.00 -0.76 0.07 3.52 0.00 -1.36 -2.58 119.26 118.14 2hqb h ALA 114 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2hqb h ALA 114 Cb 0.00 1.12 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2hqb h ALA 114 CO 0.00 -1.04 -0.03 0.00 0.00 0.00 0.00 179.25 178.17 2hqb h ALA 115 N -0.00 -0.09 0.00 0.00 0.00 -1.54 -2.99 119.26 114.65 2hqb h ALA 115 Ca 0.08 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2hqb h ALA 115 Cb 0.59 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.42 2hqb h ALA 115 CO -0.61 -0.49 0.00 -1.13 0.00 0.00 0.00 179.25 177.02 2hqb n SER 116 N -5.07 0.00 -1.64 0.00 3.41 -0.97 -4.77 113.62 104.57 2hqb n SER 116 Ca -0.08 -0.06 0.00 0.00 -0.26 0.00 0.00 58.87 58.47 2hqb n SER 116 Cb 0.11 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.06 2hqb n SER 116 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2hqb n SER 118 N 0.83 -8.16 -0.07 4.04 2.88 -1.13 -5.08 113.62 106.92 2hqb n SER 118 Ca 0.00 1.27 -0.21 0.00 -1.33 0.00 0.00 58.87 58.60 2hqb n SER 118 Cb 0.00 -4.90 -0.12 0.00 -0.75 0.00 0.00 64.21 58.43 2hqb n SER 118 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 2hqb h GLU 119 N 1.50 0.08 -0.13 -1.46 4.39 -1.93 -3.37 114.58 113.65 2hqb h GLU 119 Ca 0.00 -0.13 0.00 0.00 0.34 0.00 0.00 59.36 59.57 2hqb h GLU 119 Cb 0.12 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 28.82 2hqb h GLU 119 CO 0.00 1.06 0.00 2.41 -1.16 0.00 0.00 179.01 181.32 2hqb n THR 120 N -4.22 0.18 -4.26 1.13 -1.04 -1.26 -4.88 114.28 99.93 2hqb n THR 120 Ca -0.30 -0.18 -0.37 0.00 -2.04 0.00 0.00 64.05 61.16 2hqb n THR 120 Cb 0.76 0.09 -0.04 0.00 -1.82 0.00 0.00 70.33 69.31 2hqb n THR 120 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 2hqb n HIS 121 N -0.11 -1.54 -3.63 -1.42 8.25 -1.26 -4.90 115.22 110.61 2hqb n HIS 121 Ca 0.05 0.72 -0.29 0.00 -0.26 0.00 0.00 57.72 57.94 2hqb n HIS 121 Cb 0.11 -2.49 -0.15 0.00 1.12 0.00 0.00 29.99 28.58 2hqb n HIS 121 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 2hqb s LYS 122 N -6.95 0.41 0.21 -0.41 1.02 -1.26 -1.69 119.74 111.07 2hqb s LYS 122 Ca 0.75 -0.66 0.07 0.00 0.02 0.00 0.00 55.97 56.15 2hqb s LYS 122 Cb -0.42 -1.61 -0.04 0.00 -0.52 0.00 0.00 37.83 35.24 2hqb s LYS 122 CO 0.92 -0.93 0.08 0.14 -0.92 0.00 0.00 175.35 174.64 2hqb s VAL 123 N 1.91 4.04 -0.01 3.17 -7.23 -1.10 -2.50 120.40 118.69 2hqb s VAL 123 Ca 0.07 -1.45 -0.06 0.00 -1.81 0.00 0.00 61.98 58.73 2hqb s VAL 123 Cb -0.17 -3.11 0.00 0.00 0.56 0.00 0.00 36.38 33.67 2hqb s VAL 123 CO -0.27 -0.24 0.12 -0.83 -0.31 0.00 0.00 175.10 173.57 2hqb s GLY 124 N -3.40 0.04 -0.13 2.32 0.00 -0.60 0.22 107.32 105.78 2hqb s GLY 124 Ca 0.31 -0.09 0.01 0.00 0.00 0.00 0.00 44.72 44.94 2hqb s GLY 124 CO 0.22 -0.21 -0.15 0.14 0.00 0.00 0.00 173.10 173.10 2hqb s VAL 125 N -1.13 2.85 -0.48 1.40 1.01 0.27 -0.63 120.40 123.69 2hqb s VAL 125 Ca -0.12 -0.73 -0.02 0.00 0.00 0.00 0.00 61.98 61.11 2hqb s VAL 125 Cb -0.07 -2.18 0.13 0.00 0.00 0.00 0.00 36.38 34.26 2hqb s VAL 125 CO 0.01 0.53 0.27 -0.63 0.00 0.00 0.00 175.10 175.28 2hqb s ILE 126 N 0.39 3.28 0.45 2.22 1.01 -0.64 -0.68 121.20 127.23 2hqb s ILE 126 Ca -0.12 -2.49 0.04 0.00 0.00 0.00 0.00 60.65 58.08 2hqb s ILE 126 Cb -0.16 -3.22 0.04 0.00 0.01 0.00 0.00 42.46 39.12 2hqb s ILE 126 CO 0.06 -0.75 0.30 0.00 0.00 0.00 0.00 174.94 174.54 2hqb n ALA 127 N 4.07 0.65 -0.12 9.38 0.00 -0.36 -1.57 120.51 132.57 2hqb n ALA 127 Ca 0.02 -1.83 -0.26 0.00 0.00 0.00 0.00 53.44 51.38 2hqb n ALA 127 Cb 0.39 0.79 -0.11 0.00 0.00 0.00 0.00 19.45 20.52 2hqb n ALA 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2hqb n ALA 128 N -2.01 0.99 -2.66 0.00 0.00 -1.26 0.22 120.51 115.79 2hqb n ALA 128 Ca -0.15 -0.79 -0.12 0.00 0.00 0.00 0.00 53.44 52.38 2hqb n ALA 128 Cb 0.52 -0.22 -0.11 0.00 0.00 0.00 0.00 19.45 19.63 2hqb n ALA 128 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2hqb s PHE 129 N -2.44 0.71 0.48 0.00 0.40 -1.26 -3.66 117.98 112.21 2hqb s PHE 129 Ca -0.34 -0.62 0.13 0.00 -0.60 0.00 0.00 56.93 55.50 2hqb s PHE 129 Cb 0.10 -0.43 1.11 0.00 0.51 0.00 0.00 43.02 44.32 2hqb s PHE 129 CO 0.55 -0.11 2.11 -1.35 0.70 0.00 0.00 175.22 177.12 2hqb h PRO 130 N 4.07 0.21 0.00 0.24 0.11 -1.96 -2.48 132.00 132.18 2hqb h PRO 130 Ca -0.36 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.74 2hqb h PRO 130 Cb 1.19 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2hqb h PRO 130 CO 0.48 0.14 0.00 -2.67 -0.21 0.00 0.00 178.00 175.74 2hqb n TRP 131 N -4.51 0.00 -2.47 0.65 4.27 -1.26 -4.71 117.44 109.41 2hqb n TRP 131 Ca -0.00 0.00 -0.43 0.00 -3.89 0.00 0.00 57.50 53.18 2hqb n TRP 131 Cb 0.09 0.00 -0.02 0.00 -1.36 0.00 0.00 31.31 30.02 2hqb n TRP 131 CO 0.00 0.00 0.00 -0.65 -2.29 0.00 0.00 177.69 174.75 2hqb s GLN 132 N -2.00 3.76 0.20 -2.67 -0.21 -0.94 -4.90 119.66 112.90 2hqb s GLN 132 Ca 0.21 0.92 -0.14 0.00 0.02 0.00 0.00 55.36 56.38 2hqb s GLN 132 Cb 0.10 -3.92 0.22 0.00 1.00 0.00 0.00 33.01 30.41 2hqb s GLN 132 CO 0.16 -1.33 1.63 -1.35 -2.12 0.00 0.00 175.29 172.29 2hqb h PRO 133 N 9.62 0.01 -1.35 2.91 0.11 -1.90 -0.43 132.00 140.96 2hqb h PRO 133 Ca -0.25 -0.00 0.43 0.00 0.11 0.00 0.00 66.00 66.29 2hqb h PRO 133 Cb 1.08 -0.00 -0.12 0.00 0.11 0.00 0.00 31.00 32.07 2hqb h PRO 133 CO 1.08 0.01 0.88 0.93 -0.21 0.00 0.00 178.00 180.69 2hqb h GLU 134 N 0.01 0.09 -0.43 1.05 3.07 -1.85 0.12 114.58 116.64 2hqb h GLU 134 Ca 0.29 -0.01 -0.01 0.00 -0.50 0.00 0.00 59.36 59.14 2hqb h GLU 134 Cb 0.45 -0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 28.31 2hqb h GLU 134 CO -0.61 0.06 0.25 0.28 -1.40 0.00 0.00 179.01 177.59 2hqb h VAL 135 N 0.09 1.15 0.54 3.13 2.07 -1.42 -0.60 116.25 121.22 2hqb h VAL 135 Ca 0.81 -0.37 -0.03 0.00 0.82 0.00 0.00 66.70 67.93 2hqb h VAL 135 Cb 2.59 0.61 0.01 0.00 -1.52 0.00 0.00 31.29 32.98 2hqb h VAL 135 CO -0.37 0.16 -0.26 -0.33 0.02 0.00 0.00 177.57 176.79 2hqb h GLU 136 N 0.57 -0.70 -0.95 1.57 3.07 -0.88 -2.82 114.58 114.43 2hqb h GLU 136 Ca 0.15 0.05 0.27 0.00 -0.50 0.00 0.00 59.36 59.34 2hqb h GLU 136 Cb 0.03 0.16 -0.04 0.00 -0.84 0.00 0.00 28.75 28.06 2hqb h GLU 136 CO -0.03 -0.47 0.79 0.78 -1.40 0.00 0.00 179.01 178.68 2hqb h GLY 137 N -1.07 0.00 0.45 -3.84 0.00 -1.52 -0.42 103.07 96.68 2hqb h GLY 137 Ca -0.07 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.25 2hqb h GLY 137 CO 0.12 0.00 -0.06 -2.75 0.00 0.00 0.00 176.54 173.85 2hqb h PHE 138 N 0.00 -0.16 -0.46 5.60 3.57 -0.96 -0.90 116.94 123.64 2hqb h PHE 138 Ca 0.45 -0.00 0.06 0.00 3.53 0.00 0.00 57.97 62.00 2hqb h PHE 138 Cb 2.02 0.05 -0.05 0.00 2.79 0.00 0.00 35.95 40.76 2hqb h PHE 138 CO 0.00 0.30 0.17 0.28 -2.23 0.00 0.00 178.31 176.83 2hqb h VAL 139 N -0.72 0.86 -0.56 1.41 2.07 -0.91 -1.41 116.25 117.00 2hqb h VAL 139 Ca -0.02 -0.12 -0.00 0.00 0.82 0.00 0.00 66.70 67.38 2hqb h VAL 139 Cb 0.53 0.49 -0.03 0.00 -1.52 0.00 0.00 31.29 30.76 2hqb h VAL 139 CO 0.03 0.06 0.33 0.44 0.02 0.00 0.00 177.57 178.46 2hqb h ASP 140 N 0.35 0.66 -0.27 0.57 3.32 -1.18 -1.26 116.42 118.61 2hqb h ASP 140 Ca 0.21 -0.03 -0.07 0.00 0.02 0.00 0.00 57.03 57.16 2hqb h ASP 140 Cb 0.20 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 2hqb h ASP 140 CO -0.21 0.51 -0.10 1.23 -1.72 0.00 0.00 179.24 178.94 2hqb h GLY 141 N 0.80 0.59 0.79 2.75 0.00 -0.66 0.75 103.07 108.09 2hqb h GLY 141 Ca 0.20 -0.51 0.00 0.00 0.00 0.00 0.00 47.33 47.02 2hqb h GLY 141 CO -0.04 0.47 0.00 0.00 0.00 0.00 0.00 176.54 176.97 2hqb n ALA 142 N -2.41 2.21 -0.07 3.60 0.00 -0.62 -2.58 120.51 120.64 2hqb n ALA 142 Ca -0.04 -0.10 -0.15 0.00 0.00 0.00 0.00 53.44 53.16 2hqb n ALA 142 Cb 0.34 -1.25 -0.05 0.00 0.00 0.00 0.00 19.45 18.48 2hqb n ALA 142 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2hqb n LYS 143 N -0.90 0.34 0.00 0.00 4.81 -0.53 -0.50 118.16 121.38 2hqb n LYS 143 Ca 0.12 0.15 0.00 0.00 -0.87 0.00 0.00 58.31 57.70 2hqb n LYS 143 Cb 0.05 -1.08 0.00 0.00 0.02 0.00 0.00 35.03 34.03 2hqb n LYS 143 CO 0.00 0.00 0.00 0.98 1.17 0.00 0.00 177.40 179.55 2hqb n TYR 144 N -3.82 0.00 0.00 5.64 9.36 0.25 -2.95 117.16 125.65 2hqb n TYR 144 Ca -0.27 0.00 0.00 0.00 3.32 0.00 0.00 57.90 60.95 2hqb n TYR 144 Cb 0.63 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.34 2hqb n TYR 144 CO 0.00 0.00 0.00 -1.71 0.22 0.00 0.00 176.86 175.37 2hqb n ASN 146 N -0.03 0.00 -3.93 2.98 4.05 -1.26 -5.05 115.26 112.02 2hqb n ASN 146 Ca 0.00 0.00 -0.36 0.00 0.45 0.00 0.00 54.58 54.67 2hqb n ASN 146 Cb 0.00 -0.41 0.01 0.00 1.23 0.00 0.00 39.78 40.61 2hqb n ASN 146 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 2hqb n GLU 147 N -1.64 -1.25 -3.36 1.20 1.02 -1.15 -4.92 120.64 110.54 2hqb n GLU 147 Ca 0.00 0.28 -0.38 0.00 -0.02 0.00 0.00 57.16 57.04 2hqb n GLU 147 Cb 0.00 -3.60 -0.06 0.00 -0.02 0.00 0.00 31.44 27.76 2hqb n GLU 147 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2hqb s SER 148 N -3.75 6.71 -0.02 1.62 0.01 0.34 -4.98 113.70 113.63 2hqb s SER 148 Ca 0.35 0.85 -0.30 0.00 1.31 0.00 0.00 55.95 58.16 2hqb s SER 148 Cb -0.16 -2.28 -0.08 0.00 0.21 0.00 0.00 66.02 63.72 2hqb s SER 148 CO 0.92 0.08 1.96 -0.70 0.41 0.00 0.00 173.24 175.91 2hqb s GLU 149 N 0.20 3.99 -0.06 12.44 2.12 -0.68 -4.63 118.70 132.07 2hqb s GLU 149 Ca 0.25 2.45 -0.17 0.00 0.36 0.00 0.00 54.97 57.86 2hqb s GLU 149 Cb -0.16 -4.17 -0.05 0.00 0.26 0.00 0.00 34.13 30.02 2hqb s GLU 149 CO 0.11 -1.12 0.47 0.00 -0.54 0.00 0.00 175.26 174.18 2hqb s ALA 150 N 4.99 3.55 -0.19 6.30 0.00 -1.26 -2.71 121.76 132.43 2hqb s ALA 150 Ca 0.88 -0.17 -0.04 0.00 0.00 0.00 0.00 51.96 52.64 2hqb s ALA 150 Cb -0.40 -2.58 -0.01 0.00 0.00 0.00 0.00 23.12 20.13 2hqb s ALA 150 CO 0.39 0.18 -0.05 -0.06 0.00 0.00 0.00 175.76 176.22 2hqb s PHE 151 N -0.05 2.96 -0.18 0.00 0.40 0.13 -4.98 117.98 116.27 2hqb s PHE 151 Ca 0.26 -0.71 -0.01 0.00 -0.60 0.00 0.00 56.93 55.87 2hqb s PHE 151 Cb -0.16 -2.04 0.00 0.00 0.51 0.00 0.00 43.02 41.33 2hqb s PHE 151 CO 0.12 -0.37 -0.14 0.08 0.70 0.00 0.00 175.22 175.61 2hqb s VAL 152 N 1.08 2.68 -0.02 -0.44 1.01 -1.26 0.94 120.40 124.38 2hqb s VAL 152 Ca 0.01 -0.74 0.08 0.00 0.00 0.00 0.00 61.98 61.32 2hqb s VAL 152 Cb -0.15 -2.16 -0.02 0.00 0.00 0.00 0.00 36.38 34.06 2hqb s VAL 152 CO -0.00 0.50 -0.24 -0.13 0.00 0.00 0.00 175.10 175.22 2hqb s ARG 153 N 1.15 1.98 -0.17 2.72 1.81 0.15 -4.97 118.95 121.63 2hqb s ARG 153 Ca 0.01 -0.87 -0.05 0.00 -1.72 0.00 0.00 55.73 53.10 2hqb s ARG 153 Cb -0.14 -1.92 -0.03 0.00 -0.45 0.00 0.00 34.95 32.41 2hqb s ARG 153 CO -0.05 0.53 -0.01 0.71 -0.68 0.00 0.00 175.30 175.80 2hqb s TYR 154 N -0.57 3.08 0.30 -0.53 1.51 -1.26 -1.22 117.35 118.66 2hqb s TYR 154 Ca 0.09 -0.22 -0.13 0.00 -1.01 0.00 0.00 57.07 55.81 2hqb s TYR 154 Cb -0.09 -2.00 -0.08 0.00 -0.11 0.00 0.00 41.96 39.68 2hqb s TYR 154 CO -0.01 -0.00 0.68 0.08 -1.11 0.00 0.00 175.55 175.18 2hqb s VAL 155 N 0.42 4.78 0.32 0.71 1.01 0.60 -4.94 120.40 123.30 2hqb s VAL 155 Ca -0.02 0.74 0.01 0.00 0.00 0.00 0.00 61.98 62.72 2hqb s VAL 155 Cb -0.14 -3.63 0.27 0.00 0.00 0.00 0.00 36.38 32.89 2hqb s VAL 155 CO 0.02 -0.19 1.96 1.23 0.00 0.00 0.00 175.10 178.12 2hqb h GLY 156 N 2.22 1.12 0.00 4.51 0.00 -1.87 -3.39 103.07 105.66 2hqb h GLY 156 Ca -0.47 -0.38 0.00 0.00 0.00 0.00 0.00 47.33 46.47 2hqb h GLY 156 CO 0.66 0.33 0.00 -2.21 0.00 0.00 0.00 176.54 175.32 2hqb n GLU 157 N -4.45 0.00 0.03 4.80 2.13 -1.26 -4.84 120.64 117.04 2hqb n GLU 157 Ca 0.10 0.00 0.12 0.00 0.66 0.00 0.00 57.16 58.04 2hqb n GLU 157 Cb 0.13 0.00 0.15 0.00 0.27 0.00 0.00 31.44 31.99 2hqb n GLU 157 CO 0.00 0.00 0.00 0.91 -0.41 0.00 0.00 177.13 177.63 2hqb n TRP 158 N 0.00 0.27 0.18 4.31 7.02 -1.26 -4.36 117.44 123.60 2hqb n TRP 158 Ca 0.00 0.08 0.03 0.00 -1.02 0.00 0.00 57.50 56.59 2hqb n TRP 158 Cb 0.00 -0.44 0.04 0.00 -2.42 0.00 0.00 31.31 28.49 2hqb n TRP 158 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 2hqb n THR 159 N -1.84 0.26 -2.13 -0.99 -2.24 -1.26 -1.95 114.28 104.13 2hqb n THR 159 Ca 0.04 -0.63 -0.42 0.00 -2.27 0.00 0.00 64.05 60.76 2hqb n THR 159 Cb 0.40 0.97 0.00 0.00 -2.10 0.00 0.00 70.33 69.60 2hqb n THR 159 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2hqb n ASP 160 N 0.30 4.40 0.10 3.42 -0.08 -1.26 -4.76 116.55 118.68 2hqb n ASP 160 Ca 0.05 -2.90 0.14 0.00 -1.51 0.00 0.00 54.79 50.57 2hqb n ASP 160 Cb 0.22 -1.67 0.65 0.00 2.34 0.00 0.00 41.12 42.66 2hqb n ASP 160 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2hqb h ALA 161 N 6.55 2.25 0.17 -1.67 0.00 -1.91 -0.72 119.26 123.92 2hqb h ALA 161 Ca 0.50 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.39 2hqb h ALA 161 Cb 0.73 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.53 2hqb h ALA 161 CO 1.69 -0.33 -0.08 0.22 0.00 0.00 0.00 179.25 180.75 2hqb h ASP 162 N 0.04 -0.20 -0.51 0.00 3.58 -1.99 0.12 116.42 117.46 2hqb h ASP 162 Ca 0.15 0.01 0.08 0.00 0.42 0.00 0.00 57.03 57.68 2hqb h ASP 162 Cb 0.54 0.05 -0.07 0.00 1.72 0.00 0.00 39.33 41.57 2hqb h ASP 162 CO -0.01 -0.14 0.14 0.50 -2.88 0.00 0.00 179.24 176.85 2hqb h LYS 163 N -0.23 0.29 -0.91 0.28 3.64 -1.91 0.22 116.57 117.94 2hqb h LYS 163 Ca -0.02 -0.02 0.13 0.00 -1.27 0.00 0.00 60.65 59.46 2hqb h LYS 163 Cb 0.18 -0.06 -0.07 0.00 -0.41 0.00 0.00 32.23 31.86 2hqb h LYS 163 CO 0.04 0.19 0.58 0.00 -2.27 0.00 0.00 179.45 177.99 2hqb h ALA 164 N 1.37 1.71 -0.21 5.00 0.00 -1.12 0.13 119.26 126.15 2hqb h ALA 164 Ca 0.25 0.01 -0.17 0.00 0.00 0.00 0.00 54.91 55.00 2hqb h ALA 164 Cb 0.31 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 2hqb h ALA 164 CO -0.29 0.06 -0.58 -0.07 0.00 0.00 0.00 179.25 178.37 2hqb h LEU 165 N 0.81 0.74 -0.31 0.00 3.38 0.12 -1.36 115.31 118.68 2hqb h LEU 165 Ca 0.45 -0.41 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 2hqb h LEU 165 Cb 0.58 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 2hqb h LEU 165 CO -0.21 1.15 0.19 -0.33 0.09 0.00 0.00 178.44 179.34 2hqb h GLU 166 N 0.50 0.42 -0.77 1.13 5.08 0.58 0.00 114.58 121.51 2hqb h GLU 166 Ca 0.00 -0.03 0.06 0.00 -1.00 0.00 0.00 59.36 58.38 2hqb h GLU 166 Cb 1.15 -0.09 -0.05 0.00 0.50 0.00 0.00 28.75 30.26 2hqb h GLU 166 CO 0.11 0.31 0.51 -0.07 -1.00 0.00 0.00 179.01 178.87 2hqb h LEU 167 N 0.41 0.76 0.33 1.33 3.38 -0.77 0.32 115.31 121.07 2hqb h LEU 167 Ca 0.11 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 2hqb h LEU 167 Cb -0.01 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.58 2hqb h LEU 167 CO -0.02 0.50 -0.18 0.15 0.09 0.00 0.00 178.44 178.98 2hqb h PHE 168 N 0.87 -0.46 0.14 1.13 3.57 -0.15 -1.80 116.94 120.24 2hqb h PHE 168 Ca 0.33 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.84 2hqb h PHE 168 Cb 0.18 0.16 -0.04 0.00 2.79 0.00 0.00 35.95 39.03 2hqb h PHE 168 CO -0.00 -0.28 -0.40 1.96 -2.23 0.00 0.00 178.31 177.36 2hqb h GLN 169 N -0.47 -0.62 -0.80 1.11 4.20 -0.09 0.85 115.11 119.28 2hqb h GLN 169 Ca -0.04 0.04 0.08 0.00 0.06 0.00 0.00 58.65 58.79 2hqb h GLN 169 Cb 0.37 0.14 -0.11 0.00 0.30 0.00 0.00 27.48 28.18 2hqb h GLN 169 CO 0.06 -0.41 -0.56 0.93 -0.67 0.00 0.00 178.83 178.17 2hqb h GLU 170 N -0.64 -0.12 0.00 1.46 5.08 -0.33 0.80 114.58 120.82 2hqb h GLU 170 Ca 0.02 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2hqb h GLU 170 Cb 0.66 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.94 2hqb h GLU 170 CO -0.22 -0.08 0.00 -0.07 -1.00 0.00 0.00 179.01 177.64 2hqb h LEU 171 N -0.13 0.00 0.22 1.33 3.38 -1.09 -1.66 115.31 117.37 2hqb h LEU 171 Ca 0.14 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 2hqb h LEU 171 Cb 0.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.23 2hqb h LEU 171 CO -0.83 0.00 -0.11 -0.61 0.09 0.00 0.00 178.44 176.98 2hqb h GLN 172 N 0.00 -0.29 -1.56 1.13 5.75 0.31 -2.45 115.11 118.01 2hqb h GLN 172 Ca 0.00 0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.52 2hqb h GLN 172 Cb 0.24 0.07 0.00 0.00 1.07 0.00 0.00 27.48 28.86 2hqb h GLN 172 CO 0.00 -0.01 0.00 1.63 -2.65 0.00 0.00 178.83 177.80 2hqb n LYS 173 N -5.11 0.44 -0.33 1.69 5.02 -0.50 -1.51 118.16 117.85 2hqb n LYS 173 Ca -0.09 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.20 2hqb n LYS 173 Cb 0.22 -1.28 0.00 0.00 -0.02 0.00 0.00 35.03 33.95 2hqb n LYS 173 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 2hqb n GLU 174 N 0.78 0.00 -3.60 1.97 4.07 -0.95 -5.00 120.64 117.92 2hqb n GLU 174 Ca 0.00 -0.78 -0.25 0.00 -0.06 0.00 0.00 57.16 56.07 2hqb n GLU 174 Cb 0.22 -0.47 0.07 0.00 -0.06 0.00 0.00 31.44 31.20 2hqb n GLU 174 CO 0.00 0.00 0.00 1.04 -0.06 0.00 0.00 177.13 178.11 2hqb n GLN 175 N 0.00 -7.39 -3.34 5.31 1.13 -0.57 -4.99 117.38 107.53 2hqb n GLN 175 Ca 0.00 0.80 -0.38 0.00 -1.94 0.00 0.00 57.00 55.48 2hqb n GLN 175 Cb 0.62 -5.82 -0.06 0.00 0.11 0.00 0.00 30.24 25.09 2hqb n GLN 175 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 2hqb s VAL 176 N -3.30 4.99 0.00 5.09 1.01 -1.04 -4.66 120.40 122.48 2hqb s VAL 176 Ca 0.58 1.04 0.00 0.00 0.00 0.00 0.00 61.98 63.59 2hqb s VAL 176 Cb -0.26 -3.83 0.00 0.00 0.00 0.00 0.00 36.38 32.29 2hqb s VAL 176 CO 0.71 0.47 0.30 -0.90 0.00 0.00 0.00 175.10 175.69 2hqb n ASP 177 N 2.51 0.60 -3.83 3.32 3.85 -1.04 -4.75 116.55 117.21 2hqb n ASP 177 Ca -0.10 -0.96 -0.23 0.00 -0.71 0.00 0.00 54.79 52.79 2hqb n ASP 177 Cb 0.51 0.04 -0.17 0.00 -1.35 0.00 0.00 41.12 40.15 2hqb n ASP 177 CO 0.00 0.00 0.00 -0.69 -1.01 0.00 0.00 177.20 175.50 2hqb s VAL 178 N -0.04 0.58 0.06 2.12 1.01 -1.26 -1.79 120.40 121.09 2hqb s VAL 178 Ca 0.00 -0.04 0.08 0.00 0.00 0.00 0.00 61.98 62.02 2hqb s VAL 178 Cb 0.00 -0.67 -0.03 0.00 0.00 0.00 0.00 36.38 35.67 2hqb s VAL 178 CO 0.00 0.28 -0.19 -0.36 0.00 0.00 0.00 175.10 174.83 2hqb s PHE 179 N 1.66 2.52 -0.53 5.22 0.40 0.89 -1.55 117.98 126.59 2hqb s PHE 179 Ca 0.01 -0.28 0.04 0.00 -0.60 0.00 0.00 56.93 56.10 2hqb s PHE 179 Cb -0.13 -1.43 0.14 0.00 0.51 0.00 0.00 43.02 42.11 2hqb s PHE 179 CO -0.05 0.26 0.31 -0.47 0.70 0.00 0.00 175.22 175.97 2hqb s TYR 180 N -0.95 2.88 -1.09 0.36 5.04 0.20 0.38 117.35 124.18 2hqb s TYR 180 Ca 0.15 -2.99 -0.17 0.00 -2.44 0.00 0.00 57.07 51.61 2hqb s TYR 180 Cb -0.10 -2.49 0.13 0.00 0.35 0.00 0.00 41.96 39.84 2hqb s TYR 180 CO 0.06 -0.71 1.36 -1.25 -1.34 0.00 0.00 175.55 173.66 2hqb s PRO 181 N -0.36 3.82 -1.52 4.97 0.04 -1.26 -1.61 135.00 139.08 2hqb s PRO 181 Ca 0.19 -2.00 -0.11 0.00 0.04 0.00 0.00 61.00 59.12 2hqb s PRO 181 Cb -0.20 -5.11 -0.01 0.00 0.04 0.00 0.00 34.50 29.23 2hqb s PRO 181 CO -0.04 -1.89 2.56 0.00 0.04 0.00 0.00 177.00 177.67 2hqb n ALA 182 N 6.77 6.57 -3.43 8.56 0.00 -0.61 -4.55 120.51 133.83 2hqb n ALA 182 Ca 0.33 -3.76 -0.08 0.00 0.00 0.00 0.00 53.44 49.93 2hqb n ALA 182 Cb 0.47 -3.38 -0.08 0.00 0.00 0.00 0.00 19.45 16.46 2hqb n ALA 182 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2hqb s GLY 183 N 2.37 -0.44 0.16 0.00 0.00 -1.26 -4.12 107.32 104.04 2hqb s GLY 183 Ca 0.58 1.16 -0.17 0.00 0.00 0.00 0.00 44.72 46.28 2hqb s GLY 183 CO -0.07 2.64 1.67 -0.55 0.00 0.00 0.00 173.10 176.78 2hqb h ASP 184 N 8.17 -0.37 -0.46 1.64 3.32 -1.86 0.25 116.42 127.11 2hqb h ASP 184 Ca -0.19 0.12 0.09 0.00 0.02 0.00 0.00 57.03 57.07 2hqb h ASP 184 Cb 1.14 0.24 -0.10 0.00 0.22 0.00 0.00 39.33 40.83 2hqb h ASP 184 CO 0.23 -0.13 -0.29 1.23 -1.72 0.00 0.00 179.24 178.55 2hqb h GLY 185 N -0.01 -0.10 -1.84 2.75 0.00 -1.85 -3.12 103.07 98.91 2hqb h GLY 185 Ca 0.18 0.37 0.00 0.00 0.00 0.00 0.00 47.33 47.88 2hqb h GLY 185 CO -0.39 -0.21 0.00 1.58 0.00 0.00 0.00 176.54 177.52 2hqb n TYR 186 N -5.42 0.05 -0.26 5.60 0.18 -0.82 -4.70 117.16 111.78 2hqb n TYR 186 Ca 0.02 -0.02 -0.12 0.00 1.88 0.00 0.00 57.90 59.66 2hqb n TYR 186 Cb 0.33 -0.00 -0.09 0.00 -0.38 0.00 0.00 39.34 39.21 2hqb n TYR 186 CO 0.00 0.00 0.00 1.25 -2.08 0.00 0.00 176.86 176.03 2hqb h HIS 187 N 4.38 -1.71 0.52 -3.48 2.76 -0.88 -2.35 115.15 114.40 2hqb h HIS 187 Ca 0.00 0.10 -0.03 0.00 -2.20 0.00 0.00 60.37 58.25 2hqb h HIS 187 Cb 0.93 0.83 0.01 0.00 1.55 0.00 0.00 27.41 30.73 2hqb h HIS 187 CO 0.02 -0.43 -0.25 0.28 -1.30 0.00 0.00 177.93 176.25 2hqb h VAL 188 N -0.21 0.48 -0.95 5.26 2.07 -1.84 0.15 116.25 121.22 2hqb h VAL 188 Ca 0.13 -0.02 0.26 0.00 0.82 0.00 0.00 66.70 67.88 2hqb h VAL 188 Cb 0.52 0.49 -0.18 0.00 -1.52 0.00 0.00 31.29 30.61 2hqb h VAL 188 CO -0.76 0.00 -0.00 -2.65 0.02 0.00 0.00 177.57 174.19 2hqb n PRO 189 N -5.39 -0.08 0.06 1.57 -0.02 -1.05 0.24 135.00 130.34 2hqb n PRO 189 Ca -0.12 1.43 -0.14 0.00 -2.02 0.00 0.00 63.50 62.65 2hqb n PRO 189 Cb 0.30 -2.26 -0.05 0.00 -0.02 0.00 0.00 33.50 31.47 2hqb n PRO 189 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2hqb h VAL 190 N 0.00 1.39 -0.40 -1.45 2.07 -1.13 -2.78 116.25 113.95 2hqb h VAL 190 Ca 0.57 -2.40 -0.01 0.00 0.82 0.00 0.00 66.70 65.68 2hqb h VAL 190 Cb 1.15 2.38 -0.02 0.00 -1.52 0.00 0.00 31.29 33.28 2hqb h VAL 190 CO -0.90 0.72 0.20 0.58 0.02 0.00 0.00 177.57 178.19 2hqb h VAL 191 N 0.26 1.16 0.15 2.57 2.07 0.28 -2.20 116.25 120.54 2hqb h VAL 191 Ca -0.08 -0.44 0.01 0.00 0.82 0.00 0.00 66.70 67.00 2hqb h VAL 191 Cb 1.56 0.73 -0.04 0.00 -1.52 0.00 0.00 31.29 32.03 2hqb h VAL 191 CO 0.16 0.17 -0.44 -0.08 0.02 0.00 0.00 177.57 177.41 2hqb h GLU 192 N 0.51 -0.64 -1.14 1.57 4.57 -0.55 0.13 114.58 119.02 2hqb h GLU 192 Ca 0.14 0.04 0.32 0.00 -1.18 0.00 0.00 59.36 58.69 2hqb h GLU 192 Cb 0.09 0.15 -0.06 0.00 -0.16 0.00 0.00 28.75 28.76 2hqb h GLU 192 CO -0.02 -0.43 0.80 0.00 -1.18 0.00 0.00 179.01 178.18 2hqb h ALA 193 N -0.77 2.86 0.32 2.92 0.00 -1.41 0.24 119.26 123.42 2hqb h ALA 193 Ca -0.01 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2hqb h ALA 193 Cb 0.65 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.52 2hqb h ALA 193 CO -0.21 -1.23 -0.15 0.82 0.00 0.00 0.00 179.25 178.48 2hqb h ILE 194 N 0.11 0.18 -0.97 0.00 2.04 -0.62 -0.65 117.51 117.60 2hqb h ILE 194 Ca 0.58 -0.75 0.29 0.00 1.00 0.00 0.00 64.86 65.98 2hqb h ILE 194 Cb 2.05 0.30 -0.14 0.00 -0.74 0.00 0.00 36.82 38.29 2hqb h ILE 194 CO -0.10 0.05 0.50 0.50 0.00 0.00 0.00 178.15 179.10 2hqb h LYS 195 N -1.07 0.33 0.74 2.37 3.64 0.13 0.61 116.57 123.31 2hqb h LYS 195 Ca -0.04 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.28 2hqb h LYS 195 Cb 0.41 -0.07 0.01 0.00 -0.41 0.00 0.00 32.23 32.16 2hqb h LYS 195 CO 0.07 0.22 -0.36 0.22 -2.27 0.00 0.00 179.45 177.33 2hqb h ASP 196 N 0.34 -0.86 -0.01 4.20 1.82 -0.60 -2.27 116.42 119.03 2hqb h ASP 196 Ca 0.68 0.03 0.00 0.00 -0.39 0.00 0.00 57.03 57.36 2hqb h ASP 196 Cb 1.48 0.23 -0.00 0.00 0.68 0.00 0.00 39.33 41.72 2hqb h ASP 196 CO -0.60 -0.61 0.18 1.56 -1.61 0.00 0.00 179.24 178.17 2hqb h GLN 197 N -1.00 0.00 0.00 0.28 1.08 0.10 -3.45 115.11 112.12 2hqb h GLN 197 Ca -0.10 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.10 2hqb h GLN 197 Cb 0.77 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.20 2hqb h GLN 197 CO 0.16 0.00 0.00 0.41 -0.95 0.00 0.00 178.83 178.45 2hqb n GLY 198 N -1.17 0.65 4.00 3.46 0.00 0.18 -5.06 105.19 107.25 2hqb n GLY 198 Ca -0.02 -0.43 -0.23 0.00 0.00 0.00 0.00 46.02 45.34 2hqb n GLY 198 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2hqb s ASP 199 N -2.39 4.32 -0.03 1.61 1.01 -1.06 -5.00 116.67 115.13 2hqb s ASP 199 Ca 0.00 -0.49 -0.02 0.00 0.71 0.00 0.00 52.55 52.75 2hqb s ASP 199 Cb 0.00 0.16 -0.04 0.00 1.01 0.00 0.00 42.92 44.05 2hqb s ASP 199 CO 0.00 -1.89 0.09 -0.36 0.21 0.00 0.00 175.17 173.22 2hqb s PHE 200 N -3.12 3.34 0.27 4.23 2.99 -0.74 -4.46 117.98 120.50 2hqb s PHE 200 Ca 0.67 0.26 0.04 0.00 0.00 0.00 0.00 56.93 57.90 2hqb s PHE 200 Cb -0.05 -1.78 -0.06 0.00 0.00 0.00 0.00 43.02 41.14 2hqb s PHE 200 CO 0.44 0.57 0.01 0.00 -0.00 0.00 0.00 175.22 176.25 2hqb s ALA 201 N -1.16 2.10 -0.16 5.36 0.00 0.25 -0.07 121.76 128.08 2hqb s ALA 201 Ca 0.21 -1.90 -0.00 0.00 0.00 0.00 0.00 51.96 50.28 2hqb s ALA 201 Cb -0.12 0.51 -0.00 0.00 0.00 0.00 0.00 23.12 23.51 2hqb s ALA 201 CO 0.12 -0.24 -0.14 0.42 0.00 0.00 0.00 175.76 175.92 2hqb s ILE 202 N -3.31 2.80 0.67 0.00 -1.09 0.16 -1.99 121.20 118.44 2hqb s ILE 202 Ca 0.32 -0.72 -0.17 0.00 -2.23 0.00 0.00 60.65 57.84 2hqb s ILE 202 Cb 0.06 -2.19 0.01 0.00 -1.58 0.00 0.00 42.46 38.76 2hqb s ILE 202 CO 0.12 0.51 1.26 -0.83 -1.23 0.00 0.00 174.94 174.76 2hqb s GLY 203 N 0.79 2.67 -0.14 6.18 0.00 0.54 -4.37 107.32 112.98 2hqb s GLY 203 Ca -0.05 1.09 0.02 0.00 0.00 0.00 0.00 44.72 45.77 2hqb s GLY 203 CO 0.01 1.50 -0.19 -0.47 0.00 0.00 0.00 173.10 173.95 2hqb s TYR 204 N -1.61 2.44 0.00 1.90 5.04 -1.26 -0.40 117.35 123.46 2hqb s TYR 204 Ca 0.79 -1.27 0.00 0.00 -2.44 0.00 0.00 57.07 54.15 2hqb s TYR 204 Cb -0.34 -1.70 0.00 0.00 0.35 0.00 0.00 41.96 40.27 2hqb s TYR 204 CO 0.41 -0.62 0.00 0.28 -1.34 0.00 0.00 175.55 174.28 2hqb n VAL 205 N 4.30 0.00 -4.23 3.14 0.31 -0.30 -4.86 118.33 116.69 2hqb n VAL 205 Ca -0.19 0.00 -0.15 0.00 -0.01 0.00 0.00 64.34 63.99 2hqb n VAL 205 Cb 0.51 0.00 -0.10 0.00 -0.91 0.00 0.00 33.84 33.34 2hqb n VAL 205 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 2hqb s GLY 206 N -1.37 1.02 0.65 2.92 0.00 -1.26 -3.11 107.32 106.18 2hqb s GLY 206 Ca 0.00 -1.38 0.35 0.00 0.00 0.00 0.00 44.72 43.69 2hqb s GLY 206 CO 0.00 -1.47 2.11 -1.80 0.00 0.00 0.00 173.10 171.94 2hqb h ASP 207 N 3.10 0.00 0.00 1.64 3.58 -1.93 -3.43 116.42 119.38 2hqb h ASP 207 Ca -0.37 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.08 2hqb h ASP 207 Cb 1.19 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.24 2hqb h ASP 207 CO 0.59 0.00 0.00 0.00 -2.88 0.00 0.00 179.24 176.95 2hqb n GLN 208 N -3.12 0.00 0.14 0.28 1.13 -1.26 -4.64 117.38 109.90 2hqb n GLN 208 Ca -0.01 0.00 -0.14 0.00 -1.94 0.00 0.00 57.00 54.91 2hqb n GLN 208 Cb 0.27 -0.84 -0.08 0.00 0.11 0.00 0.00 30.24 29.70 2hqb n GLN 208 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2hqb h ALA 209 N 0.00 -0.34 0.00 -1.58 0.00 -1.91 -3.10 119.26 112.33 2hqb h ALA 209 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2hqb h ALA 209 Cb 0.00 0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2hqb h ALA 209 CO 0.00 -0.57 0.00 -0.44 0.00 0.00 0.00 179.25 178.24 2hqb h ASP 210 N -0.59 0.00 -2.50 0.00 3.32 -1.99 -2.90 116.42 111.75 2hqb h ASP 210 Ca -0.03 0.00 -0.72 0.00 0.02 0.00 0.00 57.03 56.30 2hqb h ASP 210 Cb 0.43 0.00 -0.34 0.00 0.22 0.00 0.00 39.33 39.64 2hqb h ASP 210 CO 0.06 0.00 0.23 -0.11 -1.72 0.00 0.00 179.24 177.70 2hqb n LEU 211 N -2.67 5.54 0.00 1.55 7.94 -1.17 -4.77 117.00 123.42 2hqb n LEU 211 Ca 0.01 -5.38 0.00 0.00 -1.11 0.00 0.00 56.01 49.53 2hqb n LEU 211 Cb 0.22 -0.98 0.00 0.00 0.53 0.00 0.00 43.42 43.19 2hqb n LEU 211 CO 0.22 1.95 0.00 0.61 -1.11 0.00 0.00 177.39 179.06 2hqb n GLY 212 N 0.75 0.09 0.00 -3.96 0.00 -1.19 -4.89 105.19 95.99 2hqb n GLY 212 Ca 0.31 -1.12 0.00 0.00 0.00 0.00 0.00 46.02 45.21 2hqb n GLY 212 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hqb n GLY 213 N 0.00 2.03 4.10 -0.02 0.00 -1.10 -4.92 105.19 105.28 2hqb n GLY 213 Ca 0.00 0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.21 2hqb n GLY 213 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2hqb n SER 214 N 0.00 0.00 -0.02 1.61 3.41 -1.26 -4.61 113.62 112.76 2hqb n SER 214 Ca 0.00 0.00 -0.04 0.00 -0.26 0.00 0.00 58.87 58.57 2hqb n SER 214 Cb 0.00 -0.95 -0.12 0.00 -0.26 0.00 0.00 64.21 62.88 2hqb n SER 214 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2hqb n THR 215 N -2.00 1.27 -2.87 6.66 -1.04 -1.26 -4.68 114.28 110.37 2hqb n THR 215 Ca 0.00 -0.75 -0.43 0.00 -2.04 0.00 0.00 64.05 60.83 2hqb n THR 215 Cb 0.00 -0.72 -0.03 0.00 -1.82 0.00 0.00 70.33 67.76 2hqb n THR 215 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 2hqb s ILE 216 N -2.78 4.53 0.19 12.58 -1.09 -1.26 -0.58 121.20 132.79 2hqb s ILE 216 Ca -0.05 -1.19 -0.13 0.00 -2.23 0.00 0.00 60.65 57.06 2hqb s ILE 216 Cb 0.08 -4.79 0.12 0.00 -1.58 0.00 0.00 42.46 36.29 2hqb s ILE 216 CO 0.83 -1.55 1.71 -0.07 -1.23 0.00 0.00 174.94 174.63 2hqb h LEU 217 N 10.93 -0.01 -7.82 2.97 3.38 -1.67 -3.35 115.31 119.74 2hqb h LEU 217 Ca 0.06 0.09 0.18 0.00 0.09 0.00 0.00 57.88 58.30 2hqb h LEU 217 Cb 1.03 0.13 -0.05 0.00 0.09 0.00 0.00 40.66 41.86 2hqb h LEU 217 CO 1.16 0.02 0.57 -0.89 0.09 0.00 0.00 178.44 179.40 2hqb s THR 218 N -6.14 0.00 -0.00 0.22 2.01 -1.26 -0.77 115.64 109.70 2hqb s THR 218 Ca -0.13 -0.58 0.02 0.00 0.31 0.00 0.00 61.69 61.30 2hqb s THR 218 Cb 0.16 -2.56 -0.01 0.00 0.01 0.00 0.00 72.50 70.10 2hqb s THR 218 CO 0.73 0.00 -0.06 -0.44 -0.69 0.00 0.00 174.62 174.16 2hqb s SER 219 N -3.24 0.66 -0.90 3.53 0.01 -1.26 0.20 113.70 112.70 2hqb s SER 219 Ca 0.18 -0.12 -0.20 0.00 1.31 0.00 0.00 55.95 57.13 2hqb s SER 219 Cb -0.02 -0.07 0.12 0.00 0.21 0.00 0.00 66.02 66.26 2hqb s SER 219 CO 0.04 0.06 1.13 0.42 0.41 0.00 0.00 173.24 175.29 2hqb s THR 220 N -0.18 4.61 0.05 1.44 -4.23 0.47 0.65 115.64 118.45 2hqb s THR 220 Ca 0.02 -1.35 -0.23 0.00 -1.18 0.00 0.00 61.69 58.94 2hqb s THR 220 Cb -0.02 -4.79 -0.06 0.00 1.34 0.00 0.00 72.50 68.97 2hqb s THR 220 CO -0.00 -1.53 0.71 -0.69 -0.54 0.00 0.00 174.62 172.56 2hqb s VAL 221 N 3.04 4.73 -0.20 2.29 1.01 -0.68 -1.15 120.40 129.44 2hqb s VAL 221 Ca 0.32 1.50 0.02 0.00 0.00 0.00 0.00 61.98 63.82 2hqb s VAL 221 Cb -0.06 -4.05 0.03 0.00 0.00 0.00 0.00 36.38 32.30 2hqb s VAL 221 CO -0.07 0.41 -0.16 -1.10 0.00 0.00 0.00 175.10 174.18 2hqb s GLN 222 N -0.30 2.64 -1.24 2.72 -0.21 -1.18 -1.22 119.66 120.86 2hqb s GLN 222 Ca 0.35 -0.98 -0.15 0.00 0.02 0.00 0.00 55.36 54.61 2hqb s GLN 222 Cb -0.20 -2.63 0.14 0.00 1.00 0.00 0.00 33.01 31.32 2hqb s GLN 222 CO 0.21 -0.34 1.54 0.72 -2.12 0.00 0.00 175.29 175.30 2hqb n HIS 223 N 4.58 4.80 -0.23 0.91 8.25 -0.07 -4.79 115.22 128.66 2hqb n HIS 223 Ca -0.18 -3.21 -0.06 0.00 -0.26 0.00 0.00 57.72 54.02 2hqb n HIS 223 Cb 0.47 -2.30 0.04 0.00 1.12 0.00 0.00 29.99 29.33 2hqb n HIS 223 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2hqb h VAL 224 N 4.83 1.18 -0.79 1.59 2.07 -1.88 0.14 116.25 123.39 2hqb h VAL 224 Ca 0.36 -0.36 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 2hqb h VAL 224 Cb 0.86 0.25 -0.04 0.00 -1.52 0.00 0.00 31.29 30.84 2hqb h VAL 224 CO 1.32 0.18 0.49 -2.24 0.02 0.00 0.00 177.57 177.34 2hqb h ASP 225 N 0.88 0.94 -0.14 0.57 2.03 -1.87 0.11 116.42 118.93 2hqb h ASP 225 Ca 0.24 -0.05 -0.02 0.00 -0.73 0.00 0.00 57.03 56.46 2hqb h ASP 225 Cb -0.07 -0.24 -0.01 0.00 -0.83 0.00 0.00 39.33 38.19 2hqb h ASP 225 CO -0.05 0.71 -0.00 0.44 -1.03 0.00 0.00 179.24 179.31 2hqb h ASP 226 N 1.08 0.25 -0.94 4.15 5.19 -1.81 -2.46 116.42 121.88 2hqb h ASP 226 Ca 0.28 -0.31 0.06 0.00 -0.62 0.00 0.00 57.03 56.44 2hqb h ASP 226 Cb -0.06 -0.07 -0.06 0.00 0.18 0.00 0.00 39.33 39.32 2hqb h ASP 226 CO -0.06 0.50 0.61 0.25 -3.12 0.00 0.00 179.24 177.42 2hqb h LEU 227 N -0.01 0.97 0.34 1.55 5.85 -0.35 0.27 115.31 123.93 2hqb h LEU 227 Ca 0.04 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.75 2hqb h LEU 227 Cb 0.37 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.20 2hqb h LEU 227 CO 0.01 0.63 -0.18 1.88 -0.34 0.00 0.00 178.44 180.45 2hqb h TYR 228 N 1.10 -0.45 0.25 1.25 -1.99 -0.78 0.11 116.97 116.46 2hqb h TYR 228 Ca 0.39 -0.01 0.00 0.00 2.00 0.00 0.00 58.73 61.12 2hqb h TYR 228 Cb 0.14 0.15 -0.02 0.00 2.00 0.00 0.00 36.73 39.00 2hqb h TYR 228 CO -0.00 -0.28 -0.24 0.28 -0.00 0.00 0.00 178.16 177.92 2hqb h VAL 229 N -0.48 0.49 -0.59 -2.88 2.07 -1.09 -1.22 116.25 112.54 2hqb h VAL 229 Ca -0.04 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.57 2hqb h VAL 229 Cb 0.37 0.49 -0.11 0.00 -1.52 0.00 0.00 31.29 30.52 2hqb h VAL 229 CO 0.07 0.00 -0.39 0.25 0.02 0.00 0.00 177.57 177.51 2hqb h LEU 230 N -0.52 -1.36 -1.70 2.57 5.85 -0.19 0.05 115.31 120.02 2hqb h LEU 230 Ca -0.01 0.24 -0.04 0.00 0.84 0.00 0.00 57.88 58.91 2hqb h LEU 230 Cb 0.47 0.64 -0.01 0.00 0.37 0.00 0.00 40.66 42.14 2hqb h LEU 230 CO -0.05 -0.32 -0.18 0.58 -0.34 0.00 0.00 178.44 178.13 2hqb h VAL 231 N -0.20 0.91 0.00 1.05 2.07 -0.58 -1.93 116.25 117.57 2hqb h VAL 231 Ca 0.21 -0.68 0.00 0.00 0.82 0.00 0.00 66.70 67.04 2hqb h VAL 231 Cb 0.56 1.39 0.00 0.00 -1.52 0.00 0.00 31.29 31.72 2hqb h VAL 231 CO -0.69 0.18 -0.08 0.00 0.02 0.00 0.00 177.57 177.00 2hqb h ALA 232 N 1.82 0.95 0.19 1.67 0.00 0.21 -2.78 119.26 121.32 2hqb h ALA 232 Ca -0.00 0.00 -0.35 0.00 0.00 0.00 0.00 54.91 54.56 2hqb h ALA 232 Cb 0.38 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.18 2hqb h ALA 232 CO 0.02 0.00 -1.73 -0.22 0.00 0.00 0.00 179.25 177.32 2hqb h LYS 233 N 0.00 0.41 -0.18 0.00 3.64 -0.48 -3.03 116.57 116.93 2hqb h LYS 233 Ca 0.00 -0.69 -0.15 0.00 -1.27 0.00 0.00 60.65 58.54 2hqb h LYS 233 Cb 0.84 0.26 -0.01 0.00 -0.41 0.00 0.00 32.23 32.91 2hqb h LYS 233 CO 0.00 1.33 -0.52 0.00 -2.27 0.00 0.00 179.45 177.99 2hqb h ARG 234 N 0.11 0.50 0.00 1.90 3.08 -1.40 -1.18 114.38 117.39 2hqb h ARG 234 Ca -0.34 -0.30 -0.03 0.00 0.07 0.00 0.00 59.98 59.38 2hqb h ARG 234 Cb 2.11 0.03 -0.00 0.00 0.08 0.00 0.00 29.97 32.18 2hqb h ARG 234 CO 0.19 0.90 -0.13 0.35 -1.07 0.00 0.00 179.97 180.20 2hqb h PHE 235 N 0.39 0.00 0.20 3.04 3.57 -1.59 -0.66 116.94 121.89 2hqb h PHE 235 Ca 0.01 0.00 -0.26 0.00 3.53 0.00 0.00 57.97 61.25 2hqb h PHE 235 Cb 1.04 0.00 0.03 0.00 2.79 0.00 0.00 35.95 39.81 2hqb h PHE 235 CO 0.04 0.13 -1.16 0.37 -2.23 0.00 0.00 178.31 175.46 2hqb h GLN 236 N 0.00 0.42 -1.00 1.11 4.15 -1.32 -3.21 115.11 115.26 2hqb h GLN 236 Ca -0.00 -0.71 0.00 0.00 0.77 0.00 0.00 58.65 58.71 2hqb h GLN 236 Cb 0.39 0.26 0.00 0.00 0.21 0.00 0.00 27.48 28.35 2hqb h GLN 236 CO 0.02 1.34 0.00 0.39 -1.93 0.00 0.00 178.83 178.65 2hqb n GLU 237 N -3.92 0.94 -0.03 1.69 1.02 -0.49 -4.81 120.64 115.04 2hqb n GLU 237 Ca -0.16 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.98 2hqb n GLU 237 Cb 0.96 -1.25 0.00 0.00 -0.02 0.00 0.00 31.44 31.13 2hqb n GLU 237 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2hqb n GLY 238 N 0.27 0.00 1.98 0.62 0.00 -0.91 -4.77 105.19 102.38 2hqb n GLY 238 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 2hqb n GLY 238 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2hqb n LYS 239 N -1.29 1.91 -3.73 1.61 4.81 -0.32 -4.92 118.16 116.24 2hqb n LYS 239 Ca 0.00 -1.72 -0.38 0.00 -0.87 0.00 0.00 58.31 55.35 2hqb n LYS 239 Cb 0.00 -1.70 -0.12 0.00 0.02 0.00 0.00 35.03 33.22 2hqb n LYS 239 CO 0.00 0.00 0.00 -1.17 1.17 0.00 0.00 177.40 177.40 2hqb s LEU 240 N -1.92 3.95 1.36 3.14 2.96 -1.17 -4.75 118.68 122.25 2hqb s LEU 240 Ca 0.36 -0.68 -0.20 0.00 -0.22 0.00 0.00 54.13 53.39 2hqb s LEU 240 Cb 0.27 -1.92 0.35 0.00 0.50 0.00 0.00 46.19 45.39 2hqb s LEU 240 CO -0.03 -0.20 0.96 -1.61 -1.32 0.00 0.00 176.35 174.14 2hqb s GLU 241 N 1.53 -2.42 0.32 1.98 2.02 -1.26 -4.95 118.70 115.91 2hqb s GLU 241 Ca 0.03 0.31 0.08 0.00 0.02 0.00 0.00 54.97 55.41 2hqb s GLU 241 Cb -0.17 -1.42 -0.06 0.00 0.10 0.00 0.00 34.13 32.57 2hqb s GLU 241 CO 0.04 -4.58 -0.08 -1.54 0.02 0.00 0.00 175.26 169.11 2hqb s SER 242 N -3.00 3.34 0.00 -0.19 1.04 -1.26 -4.75 113.70 108.88 2hqb s SER 242 Ca 0.69 -1.20 0.00 0.00 0.48 0.00 0.00 55.95 55.92 2hqb s SER 242 Cb -0.16 -0.27 0.00 0.00 0.10 0.00 0.00 66.02 65.68 2hqb s SER 242 CO 0.60 -0.26 0.00 0.61 0.98 0.00 0.00 173.24 175.17 2hqb n GLY 243 N -0.71 -1.88 3.61 7.32 0.00 -0.49 -4.86 105.19 108.19 2hqb n GLY 243 Ca -0.05 -1.60 -0.42 0.00 0.00 0.00 0.00 46.02 43.94 2hqb n GLY 243 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2hqb s ASN 244 N -4.00 6.72 -0.07 1.61 0.01 -1.26 -1.12 114.94 116.83 2hqb s ASN 244 Ca 0.00 0.71 -0.03 0.00 -0.71 0.00 0.00 52.86 52.83 2hqb s ASN 244 Cb 0.00 -2.45 -0.04 0.00 0.41 0.00 0.00 41.25 39.17 2hqb s ASN 244 CO 0.00 -0.75 0.07 -0.76 -1.51 0.00 0.00 177.10 174.15 2hqb s LEU 245 N 3.27 3.95 -0.10 0.60 1.43 0.52 -4.94 118.68 123.41 2hqb s LEU 245 Ca 0.37 0.25 0.03 0.00 -1.03 0.00 0.00 54.13 53.75 2hqb s LEU 245 Cb -0.13 -2.06 -0.01 0.00 0.03 0.00 0.00 46.19 44.02 2hqb s LEU 245 CO 0.15 0.35 -0.21 -0.31 0.23 0.00 0.00 176.35 176.56 2hqb s TYR 246 N -1.04 2.61 0.04 0.29 1.51 -1.26 -1.60 117.35 117.91 2hqb s TYR 246 Ca 0.17 -0.86 0.09 0.00 -1.01 0.00 0.00 57.07 55.46 2hqb s TYR 246 Cb -0.12 -1.72 -0.03 0.00 -0.11 0.00 0.00 41.96 39.98 2hqb s TYR 246 CO 0.07 -0.31 -0.24 0.71 -1.11 0.00 0.00 175.55 174.67 2hqb s TYR 247 N 0.21 2.40 0.00 2.71 1.51 0.76 -4.96 117.35 119.98 2hqb s TYR 247 Ca -0.13 -0.36 0.00 0.00 -1.01 0.00 0.00 57.07 55.57 2hqb s TYR 247 Cb -0.16 -1.42 0.00 0.00 -0.11 0.00 0.00 41.96 40.27 2hqb s TYR 247 CO 0.07 0.17 0.00 -3.47 -1.11 0.00 0.00 175.55 171.21 2hqb n ASP 248 N 1.71 0.00 -0.07 2.29 -0.08 -1.26 0.13 116.55 119.28 2hqb n ASP 248 Ca -0.17 -0.10 0.11 0.00 -1.51 0.00 0.00 54.79 53.12 2hqb n ASP 248 Cb 0.52 0.00 0.50 0.00 2.34 0.00 0.00 41.12 44.48 2hqb n ASP 248 CO 0.00 0.00 0.00 -0.26 0.12 0.00 0.00 177.20 177.06 2hqb h PHE 249 N 0.10 0.43 -0.08 -0.67 -1.00 -1.90 -1.97 116.94 111.85 2hqb h PHE 249 Ca 0.00 0.01 -0.10 0.00 2.81 0.00 0.00 57.97 60.69 2hqb h PHE 249 Cb 0.00 -0.14 -0.01 0.00 3.61 0.00 0.00 35.95 39.41 2hqb h PHE 249 CO 0.00 0.21 -0.40 1.96 -1.61 0.00 0.00 178.31 178.48 2hqb h GLN 250 N 0.41 0.18 -0.00 1.51 7.50 -1.89 -2.85 115.11 119.97 2hqb h GLN 250 Ca 0.26 -0.08 0.00 0.00 0.50 0.00 0.00 58.65 59.33 2hqb h GLN 250 Cb 0.47 -0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.99 2hqb h GLN 250 CO -0.07 0.55 -0.08 -0.25 -1.50 0.00 0.00 178.83 177.48 2hqb n ASP 251 N -4.04 0.33 0.00 1.46 10.43 -0.75 -4.94 116.55 119.04 2hqb n ASP 251 Ca -0.01 -0.46 0.00 0.00 2.57 0.00 0.00 54.79 56.88 2hqb n ASP 251 Cb 0.46 -0.13 0.00 0.00 1.84 0.00 0.00 41.12 43.29 2hqb n ASP 251 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2hqb n GLY 252 N 1.28 0.50 0.35 0.44 0.00 -1.08 -4.90 105.19 101.78 2hqb n GLY 252 Ca 0.15 -0.04 0.08 0.00 0.00 0.00 0.00 46.02 46.21 2hqb n GLY 252 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2hqb n VAL 253 N -2.98 2.05 -3.79 1.61 0.24 -1.25 -4.94 118.33 109.27 2hqb n VAL 253 Ca 0.00 -2.44 -0.13 0.00 -2.04 0.00 0.00 64.34 59.73 2hqb n VAL 253 Cb 0.00 -0.25 -0.14 0.00 -1.47 0.00 0.00 33.84 31.99 2hqb n VAL 253 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 2hqb s VAL 254 N -2.97 -0.03 0.00 3.34 1.01 -1.25 -0.90 120.40 119.61 2hqb s VAL 254 Ca 0.35 0.09 0.00 0.00 0.00 0.00 0.00 61.98 62.43 2hqb s VAL 254 Cb 0.31 -0.21 0.00 0.00 0.00 0.00 0.00 36.38 36.48 2hqb s VAL 254 CO 0.02 0.04 0.00 -1.54 0.00 0.00 0.00 175.10 173.61 2hqb n SER 255 N 3.63 0.00 -4.44 3.32 3.41 -0.36 -4.36 113.62 114.81 2hqb n SER 255 Ca -0.20 -0.51 -0.29 0.00 -0.26 0.00 0.00 58.87 57.61 2hqb n SER 255 Cb 0.55 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.38 2hqb n SER 255 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2hqb s LEU 256 N 0.00 2.52 0.68 1.04 1.43 -1.26 -1.69 118.68 121.40 2hqb s LEU 256 Ca 0.00 -0.65 -0.09 0.00 -1.03 0.00 0.00 54.13 52.36 2hqb s LEU 256 Cb 0.00 -1.39 0.03 0.00 0.03 0.00 0.00 46.19 44.86 2hqb s LEU 256 CO 0.00 0.18 1.03 -0.83 0.23 0.00 0.00 176.35 176.95 2hqb s GLY 257 N -2.10 1.63 0.06 -3.19 0.00 0.21 -4.84 107.32 99.08 2hqb s GLY 257 Ca 0.16 -0.64 -0.34 0.00 0.00 0.00 0.00 44.72 43.91 2hqb s GLY 257 CO 0.08 -0.27 1.71 -1.84 0.00 0.00 0.00 173.10 172.78 2hqb n GLU 258 N -2.89 2.17 -1.23 2.90 0.28 -1.26 -4.36 120.64 116.26 2hqb n GLU 258 Ca 0.06 0.79 -0.33 0.00 -0.16 0.00 0.00 57.16 57.53 2hqb n GLU 258 Cb 0.59 -2.59 0.11 0.00 1.43 0.00 0.00 31.44 30.97 2hqb n GLU 258 CO 0.00 0.00 0.00 -0.06 -0.16 0.00 0.00 177.13 176.91 2hqb s PHE 259 N 2.27 2.09 0.51 -1.84 0.40 -1.26 -4.57 117.98 115.58 2hqb s PHE 259 Ca 0.85 1.64 -0.18 0.00 -0.60 0.00 0.00 56.93 58.64 2hqb s PHE 259 Cb -0.68 -3.32 -0.08 0.00 0.51 0.00 0.00 43.02 39.46 2hqb s PHE 259 CO 0.44 -2.40 1.00 0.45 0.70 0.00 0.00 175.22 175.41 2hqb s SER 260 N -2.55 6.51 0.36 1.36 0.15 0.05 -4.92 113.70 114.67 2hqb s SER 260 Ca 0.69 1.68 0.08 0.00 0.70 0.00 0.00 55.95 59.09 2hqb s SER 260 Cb -0.24 -2.53 0.80 0.00 -1.71 0.00 0.00 66.02 62.35 2hqb s SER 260 CO 0.50 -0.66 1.91 0.77 1.20 0.00 0.00 173.24 176.96 2hqb h SER 261 N 1.11 0.64 -0.98 5.45 4.64 -1.92 -1.42 113.55 121.07 2hqb h SER 261 Ca -0.48 0.02 0.14 0.00 -0.47 0.00 0.00 61.79 61.00 2hqb h SER 261 Cb 1.19 -0.11 -0.09 0.00 -0.31 0.00 0.00 62.40 63.08 2hqb h SER 261 CO 0.60 0.37 0.60 0.58 -0.87 0.00 0.00 176.83 178.11 2hqb h VAL 262 N 0.70 0.85 -2.78 0.95 2.07 -1.91 -3.42 116.25 112.71 2hqb h VAL 262 Ca 0.39 -0.31 -0.53 0.00 0.82 0.00 0.00 66.70 67.07 2hqb h VAL 262 Cb 0.54 -0.13 0.02 0.00 -1.52 0.00 0.00 31.29 30.20 2hqb h VAL 262 CO -0.15 0.16 0.92 -0.69 0.02 0.00 0.00 177.57 177.83 2hqb s VAL 263 N -5.94 3.06 0.32 2.57 1.01 -0.54 -4.92 120.40 115.97 2hqb s VAL 263 Ca -0.12 0.61 -0.29 0.00 0.00 0.00 0.00 61.98 62.18 2hqb s VAL 263 Cb 0.23 -3.39 -0.12 0.00 0.00 0.00 0.00 36.38 33.10 2hqb s VAL 263 CO 0.80 0.01 1.45 -2.65 0.00 0.00 0.00 175.10 174.72 2hqb n PRO 264 N 5.04 2.42 0.08 2.72 -0.02 -1.26 -4.82 135.00 139.16 2hqb n PRO 264 Ca 0.15 0.85 0.04 0.00 -2.02 0.00 0.00 63.50 62.52 2hqb n PRO 264 Cb 0.41 -2.55 0.24 0.00 -0.02 0.00 0.00 33.50 31.58 2hqb n PRO 264 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2hqb n ASP 265 N 1.38 0.23 -0.02 2.55 -0.08 -1.26 -1.99 116.55 117.36 2hqb n ASP 265 Ca 0.06 0.54 -0.22 0.00 -1.51 0.00 0.00 54.79 53.66 2hqb n ASP 265 Cb 0.36 -0.54 -0.13 0.00 2.34 0.00 0.00 41.12 43.14 2hqb n ASP 265 CO 0.00 0.00 0.00 1.05 0.12 0.00 0.00 177.20 178.37 2hqb h GLU 266 N 0.00 0.18 -0.91 -0.67 4.11 -2.00 -3.25 114.58 112.04 2hqb h GLU 266 Ca 0.00 -0.31 0.18 0.00 0.07 0.00 0.00 59.36 59.30 2hqb h GLU 266 Cb 0.23 0.12 -0.11 0.00 0.50 0.00 0.00 28.75 29.49 2hqb h GLU 266 CO 0.00 1.15 0.48 0.28 0.07 0.00 0.00 179.01 181.00 2hqb h VAL 267 N -0.37 0.65 0.00 -1.06 2.07 -1.77 -1.56 116.25 114.22 2hqb h VAL 267 Ca -0.36 -0.21 0.00 0.00 0.82 0.00 0.00 66.70 66.95 2hqb h VAL 267 Cb 1.73 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 31.49 2hqb h VAL 267 CO -0.01 0.11 0.00 0.54 0.02 0.00 0.00 177.57 178.24 2hqb n ARG 268 N -4.88 0.00 -0.23 1.57 1.74 -1.20 -2.77 116.66 110.89 2hqb n ARG 268 Ca 0.21 0.49 0.05 0.00 -0.77 0.00 0.00 57.85 57.83 2hqb n ARG 268 Cb 0.54 -1.42 0.12 0.00 -1.02 0.00 0.00 32.46 30.68 2hqb n ARG 268 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2hqb n GLU 269 N -1.89 -0.06 -0.07 5.56 1.02 -0.94 0.78 120.64 125.04 2hqb n GLU 269 Ca 0.00 0.98 -0.07 0.00 -0.02 0.00 0.00 57.16 58.05 2hqb n GLU 269 Cb 0.00 -1.49 -0.01 0.00 -0.02 0.00 0.00 31.44 29.92 2hqb n GLU 269 CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 2hqb h GLN 270 N 0.00 -0.07 0.14 3.49 4.15 -1.16 -0.23 115.11 121.43 2hqb h GLN 270 Ca 0.33 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.75 2hqb h GLN 270 Cb 0.56 0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.27 2hqb h GLN 270 CO -0.64 -0.05 -0.07 0.82 -1.93 0.00 0.00 178.83 176.97 2hqb h ILE 271 N -0.07 1.01 -1.11 2.39 2.04 0.55 0.18 117.51 122.51 2hqb h ILE 271 Ca 0.15 -0.96 0.31 0.00 1.00 0.00 0.00 64.86 65.35 2hqb h ILE 271 Cb 0.29 1.58 -0.08 0.00 -0.74 0.00 0.00 36.82 37.88 2hqb h ILE 271 CO -0.34 0.22 0.75 0.74 0.00 0.00 0.00 178.15 179.52 2hqb h THR 272 N -0.68 0.46 0.25 -0.27 2.02 -0.84 0.76 112.91 114.61 2hqb h THR 272 Ca -0.02 -0.07 -0.32 0.00 0.77 0.00 0.00 66.41 66.76 2hqb h THR 272 Cb 0.50 0.22 0.04 0.00 -1.74 0.00 0.00 68.15 67.17 2hqb h THR 272 CO 0.03 0.04 -1.42 0.44 0.37 0.00 0.00 175.52 174.98 2hqb h ASP 273 N 0.21 0.82 -0.80 4.18 3.32 -0.86 -2.66 116.42 120.63 2hqb h ASP 273 Ca 0.59 -0.92 -0.00 0.00 0.02 0.00 0.00 57.03 56.71 2hqb h ASP 273 Cb 1.87 -0.27 -0.04 0.00 0.22 0.00 0.00 39.33 41.11 2hqb h ASP 273 CO -0.19 1.69 0.48 0.00 -1.72 0.00 0.00 179.24 179.50 2hqb h ALA 274 N 0.14 1.02 0.16 3.45 0.00 0.19 0.59 119.26 124.80 2hqb h ALA 274 Ca -0.25 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 2hqb h ALA 274 Cb 2.12 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 19.59 2hqb h ALA 274 CO 0.27 0.48 -0.08 0.82 0.00 0.00 0.00 179.25 180.74 2hqb h ILE 275 N 1.09 0.89 -1.01 0.00 2.04 0.22 0.11 117.51 120.85 2hqb h ILE 275 Ca 0.29 -0.17 0.07 0.00 1.00 0.00 0.00 64.86 66.04 2hqb h ILE 275 Cb -0.04 0.99 -0.07 0.00 -0.74 0.00 0.00 36.82 36.97 2hqb h ILE 275 CO -0.05 0.04 0.65 0.77 0.00 0.00 0.00 178.15 179.56 2hqb h SER 276 N -0.29 1.05 0.73 1.72 4.64 -1.18 0.67 113.55 120.88 2hqb h SER 276 Ca -0.02 0.01 -0.04 0.00 -0.47 0.00 0.00 61.79 61.27 2hqb h SER 276 Cb 0.23 -0.21 0.01 0.00 -0.31 0.00 0.00 62.40 62.11 2hqb h SER 276 CO 0.04 0.67 -0.35 0.74 -0.87 0.00 0.00 176.83 177.05 2hqb h THR 277 N 1.18 0.29 -0.80 2.95 2.02 -0.52 -2.10 112.91 115.93 2hqb h THR 277 Ca 0.43 -0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.72 2hqb h THR 277 Cb 0.16 0.29 -0.06 0.00 -1.74 0.00 0.00 68.15 66.81 2hqb h THR 277 CO -0.17 0.00 0.52 0.22 0.37 0.00 0.00 175.52 176.46 2hqb h TYR 278 N -0.98 0.73 -0.70 3.16 3.20 0.04 0.94 116.97 123.36 2hqb h TYR 278 Ca -0.10 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.77 2hqb h TYR 278 Cb 0.75 -0.23 -0.03 0.00 1.54 0.00 0.00 36.73 38.75 2hqb h TYR 278 CO -0.02 0.32 0.37 0.82 -1.64 0.00 0.00 178.16 178.01 2hqb h ILE 279 N 0.66 1.21 0.00 1.81 2.04 0.76 -2.01 117.51 121.99 2hqb h ILE 279 Ca 0.38 -0.55 -0.18 0.00 1.00 0.00 0.00 64.86 65.50 2hqb h ILE 279 Cb 0.56 0.28 -0.03 0.00 -0.74 0.00 0.00 36.82 36.89 2hqb h ILE 279 CO -0.15 0.24 -1.16 0.00 0.00 0.00 0.00 178.15 177.08 2hqb n GLN 280 N -4.36 0.53 0.00 2.37 6.02 -0.03 -4.72 117.38 117.20 2hqb n GLN 280 Ca 0.07 0.53 0.00 0.00 -0.01 0.00 0.00 57.00 57.58 2hqb n GLN 280 Cb 0.11 -1.70 0.00 0.00 1.02 0.00 0.00 30.24 29.67 2hqb n GLN 280 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 2hqb n THR 281 N -4.47 0.00 0.00 5.09 -1.04 0.30 -4.98 114.28 109.19 2hqb n THR 281 Ca -0.27 0.89 0.00 0.00 -2.04 0.00 0.00 64.05 62.63 2hqb n THR 281 Cb 0.58 -1.71 0.00 0.00 -1.82 0.00 0.00 70.33 67.38 2hqb n THR 281 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2hqb n GLY 282 N 0.38 1.87 3.10 3.41 0.00 -0.76 -4.99 105.19 108.20 2hqb n GLY 282 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 2hqb n GLY 282 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2hqb s GLN 283 N 0.00 0.64 0.16 1.61 -0.21 -1.26 -5.00 119.66 115.60 2hqb s GLN 283 Ca 0.00 -0.96 -0.09 0.00 0.02 0.00 0.00 55.36 54.33 2hqb s GLN 283 Cb 0.00 -0.27 -0.06 0.00 1.00 0.00 0.00 33.01 33.68 2hqb s GLN 283 CO 0.00 0.03 0.48 -0.06 -2.12 0.00 0.00 175.29 173.62 2hqb s PHE 284 N -2.15 3.50 0.00 0.91 0.40 -1.26 -3.87 117.98 115.51 2hqb s PHE 284 Ca -0.02 0.82 0.00 0.00 -0.60 0.00 0.00 56.93 57.12 2hqb s PHE 284 Cb -0.05 -2.20 0.00 0.00 0.51 0.00 0.00 43.02 41.28 2hqb s PHE 284 CO -0.01 0.39 0.06 -2.30 0.70 0.00 0.00 175.22 174.06 2hqb n PRO 285 N 0.30 0.00 0.00 0.24 -0.02 -1.26 -5.11 135.00 129.15 2hqb n PRO 285 Ca -0.03 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.45 2hqb n PRO 285 Cb 0.52 -0.95 0.00 0.00 -0.02 0.00 0.00 33.50 33.05 2hqb n PRO 285 CO 0.00 0.00 0.00 -2.39 1.98 0.00 0.00 175.50 175.09