#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qs0 h GLU 2 N 0.00 0.36 -0.71 3.17 4.81 -2.05 -2.59 114.58 117.57 2qs0 h GLU 2 Ca 0.00 -0.11 0.09 0.00 -0.13 0.00 0.00 59.36 59.21 2qs0 h GLU 2 Cb 0.00 -0.04 -0.07 0.00 0.63 0.00 0.00 28.75 29.28 2qs0 h GLU 2 CO 0.00 0.54 0.37 -0.22 -0.73 0.00 0.00 179.01 178.97 2qs0 h LYS 3 N 0.33 0.62 0.87 1.92 3.64 -2.05 0.31 116.57 122.20 2qs0 h LYS 3 Ca 0.06 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.36 2qs0 h LYS 3 Cb 0.53 -0.14 0.01 0.00 -0.41 0.00 0.00 32.23 32.22 2qs0 h LYS 3 CO 0.03 0.41 -0.42 0.28 -2.27 0.00 0.00 179.45 177.49 2qs0 h VAL 4 N 0.64 0.00 -0.94 2.00 2.07 -1.91 -1.71 116.25 116.40 2qs0 h VAL 4 Ca 0.34 -0.12 0.20 0.00 0.82 0.00 0.00 66.70 67.95 2qs0 h VAL 4 Cb 0.33 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 29.99 2qs0 h VAL 4 CO -0.25 0.00 0.51 -0.08 0.02 0.00 0.00 177.57 177.77 2qs0 h GLU 5 N -1.29 0.56 -0.38 1.57 4.57 -1.27 0.11 114.58 118.45 2qs0 h GLU 5 Ca -0.12 -0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 58.02 2qs0 h GLU 5 Cb 0.90 -0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 29.34 2qs0 h GLU 5 CO 0.20 0.37 0.20 1.49 -1.18 0.00 0.00 179.01 180.09 2qs0 h GLU 6 N 0.58 0.54 0.26 1.92 4.22 -0.24 -0.14 114.58 121.71 2qs0 h GLU 6 Ca 0.57 -0.07 -0.01 0.00 0.08 0.00 0.00 59.36 59.93 2qs0 h GLU 6 Cb 0.98 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.13 2qs0 h GLU 6 CO -0.45 0.45 -0.13 -0.07 -2.18 0.00 0.00 179.01 176.63 2qs0 h LEU 7 N 0.49 -0.32 -0.63 1.64 3.38 0.08 0.54 115.31 120.48 2qs0 h LEU 7 Ca 0.13 0.01 0.10 0.00 0.09 0.00 0.00 57.88 58.22 2qs0 h LEU 7 Cb 0.07 0.09 -0.08 0.00 0.09 0.00 0.00 40.66 40.84 2qs0 h LEU 7 CO -0.02 -0.23 0.23 0.11 0.09 0.00 0.00 178.44 178.63 2qs0 h LYS 8 N -0.37 0.40 -0.00 1.13 1.57 -0.86 1.21 116.57 119.65 2qs0 h LYS 8 Ca -0.03 -0.02 0.01 0.00 -1.87 0.00 0.00 60.65 58.73 2qs0 h LYS 8 Cb 0.29 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.50 2qs0 h LYS 8 CO 0.05 0.26 -0.06 -0.22 -0.57 0.00 0.00 179.45 178.92 2qs0 h LYS 9 N 0.41 -0.10 -0.50 3.15 3.64 -0.33 0.96 116.57 123.80 2qs0 h LYS 9 Ca 0.32 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.71 2qs0 h LYS 9 Cb 0.42 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.23 2qs0 h LYS 9 CO -0.33 -0.07 0.33 0.93 -2.27 0.00 0.00 179.45 178.05 2qs0 h GLU 10 N -0.10 0.66 -0.71 1.90 4.39 0.22 -1.99 114.58 118.95 2qs0 h GLU 10 Ca 0.02 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.68 2qs0 h GLU 10 Cb 0.13 -0.15 -0.03 0.00 -0.10 0.00 0.00 28.75 28.60 2qs0 h GLU 10 CO -0.06 0.44 0.44 0.82 -1.16 0.00 0.00 179.01 179.49 2qs0 h ILE 11 N 0.67 1.20 -0.26 3.13 2.04 0.17 -0.28 117.51 124.19 2qs0 h ILE 11 Ca 0.18 -0.40 0.00 0.00 1.00 0.00 0.00 64.86 65.64 2qs0 h ILE 11 Cb -0.08 0.19 -0.01 0.00 -0.74 0.00 0.00 36.82 36.18 2qs0 h ILE 11 CO -0.04 0.20 0.17 -0.08 0.00 0.00 0.00 178.15 178.39 2qs0 h GLU 12 N 0.96 0.33 0.59 2.37 4.57 -0.47 0.22 114.58 123.15 2qs0 h GLU 12 Ca 0.26 -0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 58.39 2qs0 h GLU 12 Cb -0.06 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.44 2qs0 h GLU 12 CO -0.05 0.22 -0.41 -0.09 -1.18 0.00 0.00 179.01 177.50 2qs0 h ARG 13 N 0.34 -0.92 -0.86 1.92 2.43 -0.95 -2.11 114.38 114.24 2qs0 h ARG 13 Ca 0.09 0.06 0.19 0.00 -0.81 0.00 0.00 59.98 59.52 2qs0 h ARG 13 Cb -0.03 0.21 -0.16 0.00 -0.42 0.00 0.00 29.97 29.56 2qs0 h ARG 13 CO -0.02 -0.61 -0.11 -0.07 -1.51 0.00 0.00 179.97 177.64 2qs0 h LEU 14 N -0.95 -0.62 -0.23 3.80 -0.00 -0.88 0.79 115.31 117.22 2qs0 h LEU 14 Ca -0.08 0.25 0.03 0.00 -0.00 0.00 0.00 57.88 58.08 2qs0 h LEU 14 Cb 0.78 0.48 -0.06 0.00 -0.00 0.00 0.00 40.66 41.86 2qs0 h LEU 14 CO 0.04 -0.27 -0.44 0.50 -0.00 0.00 0.00 178.44 178.28 2qs0 h LYS 15 N 0.03 -0.36 -0.83 1.13 3.64 -0.05 1.06 116.57 121.20 2qs0 h LYS 15 Ca 0.45 0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.82 2qs0 h LYS 15 Cb 0.77 0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 32.63 2qs0 h LYS 15 CO -0.84 -0.24 0.37 -0.22 -2.27 0.00 0.00 179.45 176.26 2qs0 h LYS 16 N -0.38 1.20 -0.36 1.90 3.11 -0.58 0.89 116.57 122.36 2qs0 h LYS 16 Ca 0.04 -0.19 -0.15 0.00 -2.81 0.00 0.00 60.65 57.55 2qs0 h LYS 16 Cb 0.50 -0.21 -0.01 0.00 -1.00 0.00 0.00 32.23 31.51 2qs0 h LYS 16 CO -0.42 0.94 -0.36 0.93 -2.81 0.00 0.00 179.45 177.74 2qs0 h GLU 17 N 1.19 0.83 0.00 1.90 5.08 -0.26 -3.01 114.58 120.31 2qs0 h GLU 17 Ca 0.28 -0.42 0.00 0.00 -1.00 0.00 0.00 59.36 58.23 2qs0 h GLU 17 Cb 0.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.41 2qs0 h GLU 17 CO -0.03 1.05 -0.20 -0.09 -1.00 0.00 0.00 179.01 178.74 2qs0 h ARG 18 N 0.69 0.00 -5.43 2.33 9.65 0.13 -3.48 114.38 118.27 2qs0 h ARG 18 Ca 0.06 0.00 -0.16 0.00 -1.10 0.00 0.00 59.98 58.78 2qs0 h ARG 18 Cb 0.92 0.00 0.13 0.00 -1.39 0.00 0.00 29.97 29.63 2qs0 h ARG 18 CO 0.08 0.00 -0.56 -1.71 2.80 0.00 0.00 179.97 180.58 2qs0 n ASN 19 N -2.57 -7.05 -4.17 -3.80 5.15 0.25 -4.60 115.26 98.47 2qs0 n ASN 19 Ca 0.04 -0.49 -0.16 0.00 -0.60 0.00 0.00 54.58 53.37 2qs0 n ASN 19 Cb 0.48 -5.24 -0.11 0.00 -0.53 0.00 0.00 39.78 34.37 2qs0 n ASN 19 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2qs0 s ALA 20 N -3.26 1.12 0.21 5.20 0.00 -0.83 -1.83 121.76 122.38 2qs0 s ALA 20 Ca 0.30 -1.07 0.09 0.00 0.00 0.00 0.00 51.96 51.29 2qs0 s ALA 20 Cb -0.04 -0.04 -0.04 0.00 0.00 0.00 0.00 23.12 23.00 2qs0 s ALA 20 CO 0.74 0.07 -0.07 -1.50 0.00 0.00 0.00 175.76 175.01 2qs0 s ILE 21 N -1.75 3.27 -0.17 0.00 2.07 0.07 -4.74 121.20 119.96 2qs0 s ILE 21 Ca 0.01 -1.76 0.00 0.00 -1.41 0.00 0.00 60.65 57.49 2qs0 s ILE 21 Cb -0.07 -2.67 0.04 0.00 0.13 0.00 0.00 42.46 39.89 2qs0 s ILE 21 CO 0.01 -0.21 -0.10 -0.63 -1.91 0.00 0.00 174.94 172.11 2qs0 s ILE 22 N -1.94 1.44 0.04 2.00 1.01 -1.26 -1.54 121.20 120.95 2qs0 s ILE 22 Ca 0.27 -0.77 -0.02 0.00 0.00 0.00 0.00 60.65 60.14 2qs0 s ILE 22 Cb -0.08 -1.50 -0.04 0.00 0.01 0.00 0.00 42.46 40.85 2qs0 s ILE 22 CO 0.17 0.24 0.21 -0.76 0.00 0.00 0.00 174.94 174.80 2qs0 s LEU 23 N 1.50 4.36 -0.13 2.97 1.43 -0.54 0.68 118.68 128.94 2qs0 s LEU 23 Ca 0.01 0.33 -0.13 0.00 -1.03 0.00 0.00 54.13 53.32 2qs0 s LEU 23 Cb -0.15 -2.85 0.04 0.00 0.03 0.00 0.00 46.19 43.26 2qs0 s LEU 23 CO -0.09 0.20 0.36 0.00 0.23 0.00 0.00 176.35 177.06 2qs0 s ALA 24 N -1.44 -0.90 0.56 4.21 0.00 0.35 -0.27 121.76 124.26 2qs0 s ALA 24 Ca 0.32 1.01 -0.17 0.00 0.00 0.00 0.00 51.96 53.12 2qs0 s ALA 24 Cb -0.13 -0.57 -0.06 0.00 0.00 0.00 0.00 23.12 22.36 2qs0 s ALA 24 CO 0.24 -0.18 1.03 -1.58 0.00 0.00 0.00 175.76 175.28 2qs0 s HIS 25 N 0.14 3.14 0.51 0.00 2.46 0.12 -2.40 115.29 119.26 2qs0 s HIS 25 Ca -0.01 1.51 0.24 0.00 0.47 0.00 0.00 55.06 57.27 2qs0 s HIS 25 Cb -0.03 -2.95 1.34 0.00 -0.13 0.00 0.00 32.58 30.82 2qs0 s HIS 25 CO 0.01 -0.84 1.96 -0.91 -2.47 0.00 0.00 174.74 172.49 2qs0 h ASN 26 N 0.73 0.08 -0.25 9.88 -0.26 -0.03 -1.70 115.58 124.02 2qs0 h ASN 26 Ca -0.47 0.01 0.00 0.00 -0.56 0.00 0.00 56.30 55.27 2qs0 h ASN 26 Cb 1.21 -0.01 0.00 0.00 -1.06 0.00 0.00 38.32 38.46 2qs0 h ASN 26 CO 0.59 0.04 0.00 -1.22 -1.06 0.00 0.00 177.43 175.78 2qs0 n TYR 27 N -4.38 0.33 -1.51 1.19 4.01 -1.26 -4.91 117.16 110.62 2qs0 n TYR 27 Ca 0.12 -0.16 -0.30 0.00 -0.16 0.00 0.00 57.90 57.40 2qs0 n TYR 27 Cb 0.65 0.00 0.11 0.00 -0.31 0.00 0.00 39.34 39.79 2qs0 n TYR 27 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 2qs0 s GLN 28 N -1.67 1.77 0.55 -0.72 -1.52 -0.64 -5.00 119.66 112.43 2qs0 s GLN 28 Ca 0.28 0.57 -0.21 0.00 -1.95 0.00 0.00 55.36 54.05 2qs0 s GLN 28 Cb 0.15 -1.89 -0.05 0.00 -0.22 0.00 0.00 33.01 31.00 2qs0 s GLN 28 CO 0.21 -1.82 1.25 -0.51 -0.25 0.00 0.00 175.29 174.17 2qs0 s LEU 29 N -5.88 3.80 0.35 2.90 1.43 -1.26 -4.83 118.68 115.19 2qs0 s LEU 29 Ca 0.62 2.50 0.07 0.00 -1.03 0.00 0.00 54.13 56.29 2qs0 s LEU 29 Cb -0.15 -4.42 0.76 0.00 0.03 0.00 0.00 46.19 42.41 2qs0 s LEU 29 CO 0.54 -1.45 1.91 -0.65 0.23 0.00 0.00 176.35 176.93 2qs0 h PRO 30 N 1.32 0.73 -0.90 1.29 0.11 -1.96 -1.64 132.00 130.95 2qs0 h PRO 30 Ca -0.50 -0.04 0.01 0.00 0.11 0.00 0.00 66.00 65.58 2qs0 h PRO 30 Cb 1.29 -0.16 -0.05 0.00 0.11 0.00 0.00 31.00 32.19 2qs0 h PRO 30 CO 0.57 0.48 0.59 0.93 -0.21 0.00 0.00 178.00 180.37 2qs0 h GLU 31 N 0.75 1.16 0.04 1.05 5.08 -1.99 0.84 114.58 121.52 2qs0 h GLU 31 Ca 0.39 -0.07 -0.27 0.00 -1.00 0.00 0.00 59.36 58.40 2qs0 h GLU 31 Cb 0.48 -0.26 0.02 0.00 0.50 0.00 0.00 28.75 29.49 2qs0 h GLU 31 CO -0.16 0.77 -1.10 0.28 -1.00 0.00 0.00 179.01 177.81 2qs0 h VAL 32 N 1.20 1.30 -0.16 3.13 2.07 -1.70 -3.05 116.25 119.04 2qs0 h VAL 32 Ca 0.34 -2.36 -0.00 0.00 0.82 0.00 0.00 66.70 65.50 2qs0 h VAL 32 Cb -0.11 2.49 -0.01 0.00 -1.52 0.00 0.00 31.29 32.15 2qs0 h VAL 32 CO -0.08 0.72 0.09 1.56 0.02 0.00 0.00 177.57 179.88 2qs0 h GLN 33 N 0.33 0.22 -0.40 1.57 4.20 -0.96 -0.48 115.11 119.60 2qs0 h GLN 33 Ca -0.14 -0.02 0.07 0.00 0.06 0.00 0.00 58.65 58.62 2qs0 h GLN 33 Cb 1.76 -0.04 -0.09 0.00 0.30 0.00 0.00 27.48 29.40 2qs0 h GLN 33 CO 0.21 0.21 -0.40 0.22 -0.67 0.00 0.00 178.83 178.40 2qs0 h ASP 34 N 0.17 -1.34 0.71 1.46 3.58 -0.87 0.20 116.42 120.32 2qs0 h ASP 34 Ca 0.06 0.21 0.00 0.00 0.42 0.00 0.00 57.03 57.72 2qs0 h ASP 34 Cb 0.05 0.60 0.00 0.00 1.72 0.00 0.00 39.33 41.70 2qs0 h ASP 34 CO -0.01 -0.36 0.00 1.62 -2.88 0.00 0.00 179.24 177.61 2qs0 h VAL 35 N -0.31 0.00 -4.06 2.25 3.04 -1.39 -3.44 116.25 112.34 2qs0 h VAL 35 Ca 0.15 -0.24 -0.47 0.00 -1.01 0.00 0.00 66.70 65.12 2qs0 h VAL 35 Cb 0.58 0.99 0.02 0.00 -2.01 0.00 0.00 31.29 30.87 2qs0 h VAL 35 CO -0.56 0.00 0.39 0.00 -1.01 0.00 0.00 177.57 176.38 2qs0 s ALA 36 N -3.38 2.91 0.02 3.17 0.00 0.69 -4.91 121.76 120.27 2qs0 s ALA 36 Ca 0.03 0.61 -0.16 0.00 0.00 0.00 0.00 51.96 52.45 2qs0 s ALA 36 Cb 0.09 -3.25 -0.35 0.00 0.00 0.00 0.00 23.12 19.61 2qs0 s ALA 36 CO 0.40 -0.28 0.96 -0.44 0.00 0.00 0.00 175.76 176.40 2qs0 h ASP 37 N 1.71 0.83 -3.53 0.00 3.32 -0.03 -3.45 116.42 115.28 2qs0 h ASP 37 Ca -0.49 -0.92 -0.50 0.00 0.02 0.00 0.00 57.03 55.13 2qs0 h ASP 37 Cb 1.22 -0.27 -0.33 0.00 0.22 0.00 0.00 39.33 40.17 2qs0 h ASP 37 CO 0.60 1.72 -0.81 0.12 -1.72 0.00 0.00 179.24 179.15 2qs0 s PHE 38 N -2.60 1.39 -0.04 4.55 2.19 -0.47 -5.01 117.98 117.99 2qs0 s PHE 38 Ca -0.10 -0.48 0.04 0.00 0.33 0.00 0.00 56.93 56.73 2qs0 s PHE 38 Cb 0.04 -1.01 -0.00 0.00 -1.31 0.00 0.00 43.02 40.74 2qs0 s PHE 38 CO 0.94 -0.24 -0.18 0.08 1.83 0.00 0.00 175.22 177.66 2qs0 s VAL 39 N 0.54 1.47 0.00 3.12 1.01 -1.26 -0.49 120.40 124.79 2qs0 s VAL 39 Ca -0.12 -0.74 0.00 0.00 0.00 0.00 0.00 61.98 61.12 2qs0 s VAL 39 Cb -0.14 -1.27 0.00 0.00 0.00 0.00 0.00 36.38 34.97 2qs0 s VAL 39 CO 0.03 0.42 0.00 0.61 0.00 0.00 0.00 175.10 176.16 2qs0 n GLY 40 N 3.13 1.56 4.03 4.51 0.00 -1.01 -4.92 105.19 112.48 2qs0 n GLY 40 Ca -0.18 -0.76 -0.19 0.00 0.00 0.00 0.00 46.02 44.89 2qs0 n GLY 40 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2qs0 s ASP 41 N 0.86 5.28 0.23 1.61 1.47 -1.26 0.74 116.67 125.59 2qs0 s ASP 41 Ca 0.00 -0.72 -0.11 0.00 1.18 0.00 0.00 52.55 52.90 2qs0 s ASP 41 Cb 0.00 0.00 0.31 0.00 -0.34 0.00 0.00 42.92 42.89 2qs0 s ASP 41 CO 0.00 -1.16 1.61 0.28 0.68 0.00 0.00 175.17 176.58 2qs0 h SER 42 N 0.32 -0.62 0.07 2.11 0.02 -1.99 0.25 113.55 113.72 2qs0 h SER 42 Ca -0.33 0.21 -0.00 0.00 -0.84 0.00 0.00 61.79 60.83 2qs0 h SER 42 Cb 1.29 0.43 0.00 0.00 0.14 0.00 0.00 62.40 64.26 2qs0 h SER 42 CO 0.42 -0.23 -0.04 0.25 -1.14 0.00 0.00 176.83 176.10 2qs0 h LEU 43 N 0.01 -0.08 -1.25 5.07 5.85 -1.99 -1.47 115.31 121.44 2qs0 h LEU 43 Ca 0.35 -0.29 0.16 0.00 0.84 0.00 0.00 57.88 58.94 2qs0 h LEU 43 Cb 0.55 0.02 -0.08 0.00 0.37 0.00 0.00 40.66 41.53 2qs0 h LEU 43 CO -0.73 0.25 0.59 -0.33 -0.34 0.00 0.00 178.44 177.88 2qs0 h GLU 44 N -0.43 0.67 -0.07 1.25 5.08 -1.75 0.22 114.58 119.54 2qs0 h GLU 44 Ca -0.01 -0.04 -0.20 0.00 -1.00 0.00 0.00 59.36 58.11 2qs0 h GLU 44 Cb 0.37 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.47 2qs0 h GLU 44 CO 0.02 0.44 -0.79 -0.07 -1.00 0.00 0.00 179.01 177.61 2qs0 h LEU 45 N 0.69 0.57 0.42 1.33 3.38 -0.91 0.79 115.31 121.58 2qs0 h LEU 45 Ca 0.48 -0.40 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 2qs0 h LEU 45 Cb 0.80 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.37 2qs0 h LEU 45 CO -0.23 1.16 -0.24 0.00 0.09 0.00 0.00 178.44 179.21 2qs0 h ALA 46 N 0.83 -0.62 -0.55 1.53 0.00 0.39 0.22 119.26 121.06 2qs0 h ALA 46 Ca -0.05 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 2qs0 h ALA 46 Cb 1.39 0.29 -0.03 0.00 0.00 0.00 0.00 17.79 19.44 2qs0 h ALA 46 CO 0.14 -0.86 0.31 -0.09 0.00 0.00 0.00 179.25 178.75 2qs0 h ARG 47 N -0.63 0.76 -0.37 0.00 2.43 -0.77 -2.90 114.38 112.90 2qs0 h ARG 47 Ca -0.05 -0.08 0.02 0.00 -0.81 0.00 0.00 59.98 59.06 2qs0 h ARG 47 Cb 0.51 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.88 2qs0 h ARG 47 CO 0.06 0.58 0.20 -0.22 -1.51 0.00 0.00 179.97 179.07 2qs0 h LYS 48 N 0.74 0.39 0.00 0.20 1.63 -0.53 -0.52 116.57 118.47 2qs0 h LYS 48 Ca 0.19 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.97 2qs0 h LYS 48 Cb 0.03 -0.09 0.00 0.00 -0.60 0.00 0.00 32.23 31.58 2qs0 h LYS 48 CO -0.03 0.26 0.00 0.00 -3.45 0.00 0.00 179.45 176.22 2qs0 n ALA 49 N -2.26 1.33 1.00 5.00 0.00 0.76 0.10 120.51 126.44 2qs0 n ALA 49 Ca 0.01 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.55 2qs0 n ALA 49 Cb 0.08 -1.00 -0.06 0.00 0.00 0.00 0.00 19.45 18.47 2qs0 n ALA 49 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 2qs0 n THR 50 N -1.16 0.00 -2.40 0.00 5.66 -0.20 -4.37 114.28 111.80 2qs0 n THR 50 Ca 0.00 -0.05 -0.21 0.00 -3.05 0.00 0.00 64.05 60.74 2qs0 n THR 50 Cb 0.00 0.98 0.01 0.00 -1.55 0.00 0.00 70.33 69.77 2qs0 n THR 50 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 2qs0 n LYS 51 N -1.23 3.03 -4.46 1.09 5.02 0.11 -5.06 118.16 116.66 2qs0 n LYS 51 Ca 0.05 -4.16 -0.34 0.00 -2.02 0.00 0.00 58.31 51.84 2qs0 n LYS 51 Cb 0.35 -2.07 -0.10 0.00 -0.02 0.00 0.00 35.03 33.20 2qs0 n LYS 51 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2qs0 s VAL 52 N -4.80 4.06 -0.16 -0.18 1.01 -1.25 -4.99 120.40 114.09 2qs0 s VAL 52 Ca 0.44 -0.37 0.07 0.00 0.00 0.00 0.00 61.98 62.12 2qs0 s VAL 52 Cb 0.40 -2.70 -0.09 0.00 0.00 0.00 0.00 36.38 34.00 2qs0 s VAL 52 CO -0.08 0.58 0.21 0.47 0.00 0.00 0.00 175.10 176.28 2qs0 n ASP 53 N 2.10 1.84 -4.69 3.32 8.00 -1.26 -5.03 116.55 120.83 2qs0 n ASP 53 Ca -0.18 -0.34 -0.31 0.00 0.71 0.00 0.00 54.79 54.67 2qs0 n ASP 53 Cb 0.53 1.15 0.15 0.00 -0.02 0.00 0.00 41.12 42.93 2qs0 n ASP 53 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2qs0 s ALA 54 N -2.03 1.63 -0.34 2.24 0.00 -1.26 -4.92 121.76 117.09 2qs0 s ALA 54 Ca 0.00 0.55 0.23 0.00 0.00 0.00 0.00 51.96 52.74 2qs0 s ALA 54 Cb 0.05 -3.42 0.14 0.00 0.00 0.00 0.00 23.12 19.89 2qs0 s ALA 54 CO 0.27 -2.56 1.24 -0.44 0.00 0.00 0.00 175.76 174.28 2qs0 h ASP 55 N -1.69 0.00 -3.91 0.00 5.19 -1.67 -3.46 116.42 110.88 2qs0 h ASP 55 Ca -0.43 -0.02 -0.49 0.00 -0.62 0.00 0.00 57.03 55.47 2qs0 h ASP 55 Cb 1.26 0.00 -0.31 0.00 0.18 0.00 0.00 39.33 40.47 2qs0 h ASP 55 CO 0.43 0.01 -0.81 -0.69 -3.12 0.00 0.00 179.24 175.07 2qs0 s VAL 56 N -3.30 1.07 -0.14 -1.35 1.01 -0.92 -0.97 120.40 115.81 2qs0 s VAL 56 Ca 0.02 -0.53 0.01 0.00 0.00 0.00 0.00 61.98 61.49 2qs0 s VAL 56 Cb 0.09 -0.93 0.02 0.00 0.00 0.00 0.00 36.38 35.56 2qs0 s VAL 56 CO 0.75 0.32 -0.17 -0.63 0.00 0.00 0.00 175.10 175.36 2qs0 s ILE 57 N 0.05 1.72 -0.31 2.22 1.01 0.31 -0.75 121.20 125.44 2qs0 s ILE 57 Ca -0.02 -0.75 -0.12 0.00 0.00 0.00 0.00 60.65 59.76 2qs0 s ILE 57 Cb -0.09 -1.57 -0.03 0.00 0.01 0.00 0.00 42.46 40.78 2qs0 s ILE 57 CO 0.01 0.48 0.22 -0.69 0.00 0.00 0.00 174.94 174.96 2qs0 s VAL 58 N 1.19 5.30 -0.47 2.92 1.01 -0.59 -1.49 120.40 128.27 2qs0 s VAL 58 Ca -0.01 -0.04 -0.14 0.00 0.00 0.00 0.00 61.98 61.79 2qs0 s VAL 58 Cb -0.14 -3.64 0.08 0.00 0.00 0.00 0.00 36.38 32.68 2qs0 s VAL 58 CO -0.07 0.10 0.38 0.12 0.00 0.00 0.00 175.10 175.63 2qs0 s PHE 59 N 1.74 3.26 -1.23 5.22 2.19 -0.22 -1.47 117.98 127.47 2qs0 s PHE 59 Ca 0.07 -1.04 -0.13 0.00 0.33 0.00 0.00 56.93 56.16 2qs0 s PHE 59 Cb -0.17 -3.17 0.17 0.00 -1.31 0.00 0.00 43.02 38.54 2qs0 s PHE 59 CO 0.11 -0.81 1.54 0.00 1.83 0.00 0.00 175.22 177.88 2qs0 n ALA 60 N 5.16 4.17 -3.59 11.12 0.00 0.62 -4.06 120.51 133.94 2qs0 n ALA 60 Ca -0.12 -4.24 0.05 0.00 0.00 0.00 0.00 53.44 49.13 2qs0 n ALA 60 Cb 0.43 -3.07 0.01 0.00 0.00 0.00 0.00 19.45 16.83 2qs0 n ALA 60 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qs0 n GLY 61 N 3.89 0.87 3.67 0.00 0.00 -1.26 -0.70 105.19 111.66 2qs0 n GLY 61 Ca 0.38 -1.08 -0.30 0.00 0.00 0.00 0.00 46.02 45.02 2qs0 n GLY 61 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qs0 s VAL 62 N -2.24 2.46 0.19 1.61 0.11 -1.26 -4.78 120.40 116.49 2qs0 s VAL 62 Ca 0.15 0.15 -0.11 0.00 -2.93 0.00 0.00 61.98 59.24 2qs0 s VAL 62 Cb -0.02 -2.41 0.12 0.00 -1.53 0.00 0.00 36.38 32.54 2qs0 s VAL 62 CO 0.04 -0.20 1.79 -2.24 -3.33 0.00 0.00 175.10 171.17 2qs0 h ASP 63 N -1.79 0.87 0.97 3.54 2.03 -1.99 -2.01 116.42 118.04 2qs0 h ASP 63 Ca -0.49 -0.11 -0.01 0.00 -0.73 0.00 0.00 57.03 55.69 2qs0 h ASP 63 Cb 1.28 -0.22 -0.00 0.00 -0.83 0.00 0.00 39.33 39.56 2qs0 h ASP 63 CO 0.49 0.73 -0.05 2.19 -1.03 0.00 0.00 179.24 181.58 2qs0 h PHE 64 N 0.94 0.00 0.23 4.15 -5.15 -1.92 -1.13 116.94 114.06 2qs0 h PHE 64 Ca 0.24 0.00 -0.33 0.00 -0.20 0.00 0.00 57.97 57.67 2qs0 h PHE 64 Cb 0.07 0.00 0.03 0.00 0.22 0.00 0.00 35.95 36.28 2qs0 h PHE 64 CO -0.00 0.05 -1.51 0.52 -2.00 0.00 0.00 178.31 175.37 2qs0 h MET 65 N 0.00 0.50 -0.56 6.09 2.86 -1.86 -1.89 114.93 120.06 2qs0 h MET 65 Ca -0.00 -0.85 0.02 0.00 -2.06 0.00 0.00 59.70 56.81 2qs0 h MET 65 Cb 0.54 0.32 -0.03 0.00 0.06 0.00 0.00 31.60 32.49 2qs0 h MET 65 CO 0.01 1.41 0.34 0.00 1.06 0.00 0.00 176.91 179.73 2qs0 h ALA 66 N 0.13 0.72 -0.36 6.32 0.00 -1.07 -1.50 119.26 123.49 2qs0 h ALA 66 Ca -0.27 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.53 2qs0 h ALA 66 Cb 2.12 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 19.72 2qs0 h ALA 66 CO 0.25 0.08 -0.14 1.49 0.00 0.00 0.00 179.25 180.92 2qs0 h GLU 67 N 0.69 0.64 -0.03 0.00 4.81 -1.26 -1.97 114.58 117.45 2qs0 h GLU 67 Ca 0.22 -0.21 -0.02 0.00 -0.13 0.00 0.00 59.36 59.22 2qs0 h GLU 67 Cb -0.00 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.32 2qs0 h GLU 67 CO -0.09 0.76 -0.09 1.15 -0.73 0.00 0.00 179.01 180.02 2qs0 h THR 68 N 0.58 1.09 -0.03 0.32 2.02 -0.46 0.19 112.91 116.62 2qs0 h THR 68 Ca 0.10 -0.39 -0.03 0.00 0.77 0.00 0.00 66.41 66.87 2qs0 h THR 68 Cb 0.57 1.16 0.00 0.00 -1.74 0.00 0.00 68.15 68.14 2qs0 h THR 68 CO 0.04 0.11 -0.09 0.00 0.37 0.00 0.00 175.52 175.95 2qs0 h ALA 69 N 1.87 0.06 0.10 6.16 0.00 -0.66 -2.28 119.26 124.50 2qs0 h ALA 69 Ca 0.01 -0.34 0.01 0.00 0.00 0.00 0.00 54.91 54.60 2qs0 h ALA 69 Cb 0.19 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2qs0 h ALA 69 CO 0.01 -0.08 -0.14 -0.22 0.00 0.00 0.00 179.25 178.82 2qs0 h LYS 70 N -0.43 -0.28 -1.04 0.00 1.63 -0.92 0.43 116.57 115.96 2qs0 h LYS 70 Ca -0.00 0.02 0.27 0.00 -0.85 0.00 0.00 60.65 60.09 2qs0 h LYS 70 Cb 0.69 0.06 -0.11 0.00 -0.60 0.00 0.00 32.23 32.28 2qs0 h LYS 70 CO 0.02 -0.19 0.65 0.82 -3.45 0.00 0.00 179.45 177.30 2qs0 h ILE 71 N -0.29 0.50 0.00 2.00 2.04 -1.01 1.17 117.51 121.93 2qs0 h ILE 71 Ca 0.02 -0.16 -0.11 0.00 1.00 0.00 0.00 64.86 65.61 2qs0 h ILE 71 Cb 0.30 0.01 -0.02 0.00 -0.74 0.00 0.00 36.82 36.37 2qs0 h ILE 71 CO -0.07 0.08 -0.54 0.25 0.00 0.00 0.00 178.15 177.87 2qs0 h LEU 72 N 0.45 0.00 -6.37 1.44 5.85 -0.50 -3.38 115.31 112.80 2qs0 h LEU 72 Ca 0.63 0.00 -0.60 0.00 0.84 0.00 0.00 57.88 58.75 2qs0 h LEU 72 Cb 1.45 0.00 -0.42 0.00 0.37 0.00 0.00 40.66 42.06 2qs0 h LEU 72 CO -0.38 0.54 -0.61 0.59 -0.34 0.00 0.00 178.44 178.24 2qs0 n ASN 73 N -3.38 3.45 -0.12 1.25 3.02 0.40 -4.95 115.26 114.93 2qs0 n ASN 73 Ca 0.01 -3.36 -0.06 0.00 -0.03 0.00 0.00 54.58 51.13 2qs0 n ASN 73 Cb 0.68 -0.69 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 2qs0 n ASN 73 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 2qs0 h PRO 74 N 4.42 -0.18 -2.29 3.52 0.11 -1.69 -3.00 132.00 132.89 2qs0 h PRO 74 Ca 0.19 0.01 -0.73 0.00 0.11 0.00 0.00 66.00 65.58 2qs0 h PRO 74 Cb 0.69 0.04 -0.21 0.00 0.11 0.00 0.00 31.00 31.63 2qs0 h PRO 74 CO 0.80 -0.12 1.40 -0.25 -0.21 0.00 0.00 178.00 179.62 2qs0 n ASP 75 N -5.41 7.48 -3.77 -2.05 8.00 -1.26 -4.90 116.55 114.65 2qs0 n ASP 75 Ca 0.02 -3.45 -0.10 0.00 0.71 0.00 0.00 54.79 51.97 2qs0 n ASP 75 Cb 0.32 -1.23 -0.04 0.00 -0.02 0.00 0.00 41.12 40.15 2qs0 n ASP 75 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2qs0 s LYS 76 N -2.81 1.35 -0.46 -1.24 1.02 -1.13 -5.03 119.74 111.44 2qs0 s LYS 76 Ca 0.49 -0.90 -0.13 0.00 0.02 0.00 0.00 55.97 55.45 2qs0 s LYS 76 Cb 0.26 0.50 0.08 0.00 -0.52 0.00 0.00 37.83 38.15 2qs0 s LYS 76 CO -0.18 -0.56 0.36 0.42 -0.92 0.00 0.00 175.35 174.47 2qs0 s ILE 77 N -3.88 4.87 -0.18 2.17 1.01 -0.14 -5.01 121.20 120.04 2qs0 s ILE 77 Ca 0.10 -1.23 -0.07 0.00 0.00 0.00 0.00 60.65 59.44 2qs0 s ILE 77 Cb -0.00 -3.96 -0.04 0.00 0.01 0.00 0.00 42.46 38.46 2qs0 s ILE 77 CO -0.02 -0.59 0.06 -0.69 0.00 0.00 0.00 174.94 173.70 2qs0 s VAL 78 N 1.56 4.78 0.01 2.92 1.01 -1.26 -0.53 120.40 128.88 2qs0 s VAL 78 Ca 0.04 -0.04 0.00 0.00 0.00 0.00 0.00 61.98 61.98 2qs0 s VAL 78 Cb -0.24 -3.15 -0.01 0.00 0.00 0.00 0.00 36.38 32.97 2qs0 s VAL 78 CO 0.05 0.46 -0.02 -1.48 0.00 0.00 0.00 175.10 174.11 2qs0 s LEU 79 N 0.35 2.11 -0.16 3.92 2.34 -0.55 0.71 118.68 127.40 2qs0 s LEU 79 Ca 0.03 -0.24 -0.07 0.00 0.06 0.00 0.00 54.13 53.91 2qs0 s LEU 79 Cb -0.12 -0.01 -0.04 0.00 -0.56 0.00 0.00 46.19 45.46 2qs0 s LEU 79 CO 0.00 -0.12 0.06 -0.51 -1.06 0.00 0.00 176.35 174.72 2qs0 s ILE 80 N -0.68 4.81 0.56 1.48 2.07 0.32 -1.05 121.20 128.71 2qs0 s ILE 80 Ca -0.07 -0.04 0.27 0.00 -1.41 0.00 0.00 60.65 59.41 2qs0 s ILE 80 Cb -0.05 -3.14 0.40 0.00 0.13 0.00 0.00 42.46 39.80 2qs0 s ILE 80 CO -0.00 0.50 1.97 -0.65 -1.91 0.00 0.00 174.94 174.85 2qs0 h PRO 81 N 6.27 0.00 -5.51 3.50 0.11 -1.82 -3.39 132.00 131.16 2qs0 h PRO 81 Ca -0.41 0.00 -0.55 0.00 0.11 0.00 0.00 66.00 65.15 2qs0 h PRO 81 Cb 1.18 0.00 -0.13 0.00 0.11 0.00 0.00 31.00 32.15 2qs0 h PRO 81 CO 0.67 0.00 -0.62 0.54 -0.21 0.00 0.00 178.00 178.38 2qs0 s ASN 82 N -5.82 3.18 0.90 -2.05 4.22 -1.26 -4.76 114.94 109.36 2qs0 s ASN 82 Ca -0.05 -1.33 -0.12 0.00 -2.14 0.00 0.00 52.86 49.22 2qs0 s ASN 82 Cb 0.18 -0.25 0.13 0.00 1.28 0.00 0.00 41.25 42.59 2qs0 s ASN 82 CO 0.66 -0.46 1.10 -0.54 -2.04 0.00 0.00 177.10 175.82 2qs0 s LYS 83 N -3.77 1.20 0.54 3.55 1.02 -1.26 -4.95 119.74 116.08 2qs0 s LYS 83 Ca 0.34 0.58 0.04 0.00 0.02 0.00 0.00 55.97 56.95 2qs0 s LYS 83 Cb 0.08 -1.82 0.03 0.00 -0.52 0.00 0.00 37.83 35.59 2qs0 s LYS 83 CO 0.16 -2.22 0.26 -0.98 -0.92 0.00 0.00 175.35 171.66 2qs0 s ARG 84 N -5.07 2.23 -0.69 1.68 1.04 -1.26 -4.79 118.95 112.10 2qs0 s ARG 84 Ca 0.63 -2.19 0.05 0.00 -1.04 0.00 0.00 55.73 53.19 2qs0 s ARG 84 Cb -0.17 -1.88 0.22 0.00 -2.04 0.00 0.00 34.95 31.08 2qs0 s ARG 84 CO 0.56 -0.56 0.69 -1.33 -0.04 0.00 0.00 175.30 174.61 2qs0 n MET 89 N -1.61 2.36 -0.00 3.89 2.00 -1.26 -4.77 117.12 117.72 2qs0 n MET 89 Ca -0.09 -4.61 0.07 0.00 0.00 0.00 0.00 57.70 53.07 2qs0 n MET 89 Cb 0.65 -2.28 -0.10 0.00 0.00 0.00 0.00 33.22 31.49 2qs0 n MET 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2qs0 n ALA 90 N 1.30 2.80 0.34 3.04 0.00 -1.26 -4.28 120.51 122.45 2qs0 n ALA 90 Ca 0.26 -0.34 0.03 0.00 0.00 0.00 0.00 53.44 53.39 2qs0 n ALA 90 Cb 0.39 -0.47 0.17 0.00 0.00 0.00 0.00 19.45 19.53 2qs0 n ALA 90 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2qs0 n ASN 91 N -1.82 0.00 -0.07 0.00 3.02 -1.26 -1.87 115.26 113.26 2qs0 n ASN 91 Ca -0.01 -0.13 -0.01 0.00 -0.03 0.00 0.00 54.58 54.40 2qs0 n ASN 91 Cb 0.32 -0.04 0.27 0.00 -0.61 0.00 0.00 39.78 39.72 2qs0 n ASN 91 CO 0.00 0.00 0.00 0.24 -2.62 0.00 0.00 177.26 174.88 2qs0 h MET 92 N 0.00 0.69 -6.23 3.52 2.86 -1.95 -3.42 114.93 110.39 2qs0 h MET 92 Ca 0.00 -0.12 -0.57 0.00 -2.06 0.00 0.00 59.70 56.96 2qs0 h MET 92 Cb 0.01 -0.12 -0.04 0.00 0.06 0.00 0.00 31.60 31.51 2qs0 h MET 92 CO 0.00 0.61 0.00 -1.17 1.06 0.00 0.00 176.91 177.41 2qs0 s LEU 93 N -9.30 4.51 0.17 1.22 2.96 -0.78 -4.77 118.68 112.69 2qs0 s LEU 93 Ca -0.09 1.29 0.05 0.00 -0.22 0.00 0.00 54.13 55.16 2qs0 s LEU 93 Cb 0.16 -2.96 -0.05 0.00 0.50 0.00 0.00 46.19 43.85 2qs0 s LEU 93 CO 0.78 0.22 -0.08 -0.54 -1.32 0.00 0.00 176.35 175.40 2qs0 s LYS 94 N -0.87 1.16 0.16 1.98 1.02 -1.26 -4.92 119.74 117.01 2qs0 s LYS 94 Ca 0.30 -1.52 -0.15 0.00 0.02 0.00 0.00 55.97 54.62 2qs0 s LYS 94 Cb -0.20 -0.67 0.08 0.00 -0.52 0.00 0.00 37.83 36.53 2qs0 s LYS 94 CO 0.20 0.04 1.75 0.28 -0.92 0.00 0.00 175.35 176.70 2qs0 h VAL 95 N 2.68 0.89 -1.02 3.17 2.07 -1.95 -2.20 116.25 119.88 2qs0 h VAL 95 Ca -0.37 -0.11 0.25 0.00 0.82 0.00 0.00 66.70 67.30 2qs0 h VAL 95 Cb 1.20 0.56 -0.09 0.00 -1.52 0.00 0.00 31.29 31.43 2qs0 h VAL 95 CO 0.64 0.06 0.65 0.50 0.02 0.00 0.00 177.57 179.44 2qs0 h LYS 96 N 0.31 0.42 -0.39 1.57 3.64 -1.99 0.29 116.57 120.44 2qs0 h LYS 96 Ca 0.18 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.53 2qs0 h LYS 96 Cb 0.15 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.86 2qs0 h LYS 96 CO -0.18 0.28 0.21 0.45 -2.27 0.00 0.00 179.45 177.95 2qs0 h HIS 97 N 0.44 0.53 -0.57 1.91 3.86 -1.81 0.73 115.15 120.23 2qs0 h HIS 97 Ca 0.59 -0.01 -0.03 0.00 -1.16 0.00 0.00 60.37 59.76 2qs0 h HIS 97 Cb 1.41 -0.17 -0.03 0.00 1.06 0.00 0.00 27.41 29.69 2qs0 h HIS 97 CO -0.00 0.40 0.23 0.82 0.86 0.00 0.00 177.93 180.24 2qs0 h ILE 98 N 0.50 1.22 -0.34 2.45 2.04 -0.47 0.15 117.51 123.05 2qs0 h ILE 98 Ca 0.14 -0.68 -0.02 0.00 1.00 0.00 0.00 64.86 65.30 2qs0 h ILE 98 Cb 0.05 0.61 -0.02 0.00 -0.74 0.00 0.00 36.82 36.72 2qs0 h ILE 98 CO -0.02 0.26 0.14 -0.07 0.00 0.00 0.00 178.15 178.46 2qs0 h LEU 99 N 0.78 0.46 -0.79 1.44 3.38 -0.84 0.47 115.31 120.20 2qs0 h LEU 99 Ca 0.19 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2qs0 h LEU 99 Cb 0.19 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.78 2qs0 h LEU 99 CO -0.02 0.49 0.51 -0.33 0.09 0.00 0.00 178.44 179.18 2qs0 h GLU 100 N 0.40 1.05 0.23 1.13 4.39 -0.63 0.16 114.58 121.31 2qs0 h GLU 100 Ca 0.11 -0.08 -0.01 0.00 0.34 0.00 0.00 59.36 59.73 2qs0 h GLU 100 Cb 0.17 -0.23 0.00 0.00 -0.10 0.00 0.00 28.75 28.59 2qs0 h GLU 100 CO -0.01 0.72 -0.11 0.00 -1.16 0.00 0.00 179.01 178.45 2qs0 h ALA 101 N 1.28 -0.31 -0.06 3.43 0.00 -0.10 -2.69 119.26 120.81 2qs0 h ALA 101 Ca 0.29 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 2qs0 h ALA 101 Cb -0.09 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2qs0 h ALA 101 CO -0.06 -0.63 -0.06 0.87 0.00 0.00 0.00 179.25 179.37 2qs0 h LYS 102 N -0.38 0.08 0.18 0.00 1.79 0.20 -1.41 116.57 117.03 2qs0 h LYS 102 Ca -0.03 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.43 2qs0 h LYS 102 Cb 0.29 -0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 30.91 2qs0 h LYS 102 CO 0.05 0.15 -0.18 -0.22 -1.08 0.00 0.00 179.45 178.17 2qs0 h LYS 103 N 0.08 -0.38 0.00 3.15 3.64 -0.36 -0.83 116.57 121.87 2qs0 h LYS 103 Ca 0.02 0.03 -0.12 0.00 -1.27 0.00 0.00 60.65 59.31 2qs0 h LYS 103 Cb 0.16 0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.04 2qs0 h LYS 103 CO 0.01 -0.25 -0.56 0.87 -2.27 0.00 0.00 179.45 177.25 2qs0 h LYS 104 N -0.39 0.00 -2.11 1.90 1.57 -1.28 -3.37 116.57 112.90 2qs0 h LYS 104 Ca 0.00 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 58.23 2qs0 h LYS 104 Cb 0.36 0.00 -0.41 0.00 0.08 0.00 0.00 32.23 32.27 2qs0 h LYS 104 CO -0.04 0.56 -0.92 0.66 -0.57 0.00 0.00 179.45 179.14 2qs0 n TYR 105 N -3.47 1.65 -0.40 -1.35 4.01 -0.56 -4.96 117.16 112.08 2qs0 n TYR 105 Ca 0.00 -3.86 0.32 0.00 -0.16 0.00 0.00 57.90 54.20 2qs0 n TYR 105 Cb 0.66 -0.45 0.62 0.00 -0.31 0.00 0.00 39.34 39.86 2qs0 n TYR 105 CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 2qs0 h PRO 106 N 3.53 0.18 -0.01 -0.72 0.11 -1.32 -0.15 132.00 133.62 2qs0 h PRO 106 Ca 0.12 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.22 2qs0 h PRO 106 Cb 0.77 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.84 2qs0 h PRO 106 CO 0.63 0.12 -0.30 0.09 -0.21 0.00 0.00 178.00 178.33 2qs0 n ASN 107 N -4.58 1.21 -4.73 -2.05 3.02 -1.26 -4.92 115.26 101.95 2qs0 n ASN 107 Ca 0.32 -1.01 -0.41 0.00 -0.03 0.00 0.00 54.58 53.45 2qs0 n ASN 107 Cb 1.24 0.20 -0.04 0.00 -0.61 0.00 0.00 39.78 40.56 2qs0 n ASN 107 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2qs0 s ALA 108 N -2.50 3.24 0.89 5.41 0.00 -0.07 -4.87 121.76 123.86 2qs0 s ALA 108 Ca 0.23 0.58 -0.11 0.00 0.00 0.00 0.00 51.96 52.66 2qs0 s ALA 108 Cb 0.19 -3.29 0.12 0.00 0.00 0.00 0.00 23.12 20.14 2qs0 s ALA 108 CO 0.53 -0.06 1.09 -2.14 0.00 0.00 0.00 175.76 175.18 2qs0 s PRO 109 N 0.12 1.32 -0.28 0.00 0.02 -1.25 -4.72 135.00 130.21 2qs0 s PRO 109 Ca 0.48 0.93 -0.02 0.00 0.02 0.00 0.00 61.00 62.42 2qs0 s PRO 109 Cb -0.23 -1.81 0.04 0.00 0.02 0.00 0.00 34.50 32.52 2qs0 s PRO 109 CO 0.30 -2.23 -0.03 0.08 -0.33 0.00 0.00 177.00 174.79 2qs0 s VAL 110 N -2.89 2.91 -0.24 3.83 1.01 -1.26 -0.88 120.40 122.88 2qs0 s VAL 110 Ca 0.63 -1.25 -0.04 0.00 0.00 0.00 0.00 61.98 61.33 2qs0 s VAL 110 Cb -0.18 -2.60 0.00 0.00 0.00 0.00 0.00 36.38 33.60 2qs0 s VAL 110 CO 0.57 0.02 -0.02 -0.69 0.00 0.00 0.00 175.10 174.99 2qs0 s VAL 111 N 1.28 3.41 -0.07 2.92 1.01 0.26 -0.37 120.40 128.84 2qs0 s VAL 111 Ca -0.03 -0.66 -0.03 0.00 0.00 0.00 0.00 61.98 61.26 2qs0 s VAL 111 Cb -0.18 -2.65 -0.04 0.00 0.00 0.00 0.00 36.38 33.51 2qs0 s VAL 111 CO -0.03 0.29 0.06 -0.76 0.00 0.00 0.00 175.10 174.67 2qs0 s LEU 112 N 1.45 3.89 0.40 3.92 1.43 -1.09 -2.38 118.68 126.31 2qs0 s LEU 112 Ca 0.04 0.23 -0.24 0.00 -1.03 0.00 0.00 54.13 53.13 2qs0 s LEU 112 Cb -0.15 -2.03 -0.09 0.00 0.03 0.00 0.00 46.19 43.94 2qs0 s LEU 112 CO -0.02 0.35 1.04 -0.47 0.23 0.00 0.00 176.35 177.48 2qs0 s TYR 113 N -1.02 3.28 0.26 0.29 5.04 0.56 -1.54 117.35 124.22 2qs0 s TYR 113 Ca 0.17 1.65 -0.04 0.00 -2.44 0.00 0.00 57.07 56.41 2qs0 s TYR 113 Cb -0.12 -3.10 0.53 0.00 0.35 0.00 0.00 41.96 39.63 2qs0 s TYR 113 CO 0.07 -0.56 1.63 0.28 -1.34 0.00 0.00 175.55 175.63 2qs0 h VAL 114 N 2.17 0.31 -0.60 3.14 2.07 -0.95 -3.28 116.25 119.10 2qs0 h VAL 114 Ca -0.48 -0.04 -0.26 0.00 0.82 0.00 0.00 66.70 66.74 2qs0 h VAL 114 Cb 1.21 0.17 -0.04 0.00 -1.52 0.00 0.00 31.29 31.11 2qs0 h VAL 114 CO 0.62 0.02 0.69 0.21 0.02 0.00 0.00 177.57 179.13 2qs0 s ASN 115 N -5.15 4.91 -0.05 0.57 2.47 -1.26 -4.82 114.94 111.61 2qs0 s ASN 115 Ca -0.13 -0.79 -0.29 0.00 0.42 0.00 0.00 52.86 52.07 2qs0 s ASN 115 Cb 0.24 -2.57 0.09 0.00 -1.45 0.00 0.00 41.25 37.56 2qs0 s ASN 115 CO 0.76 -3.02 0.80 -0.94 -3.72 0.00 0.00 177.10 170.98 2qs0 s SER 116 N 8.10 -0.51 0.61 -4.21 1.04 -1.24 -4.72 113.70 112.77 2qs0 s SER 116 Ca 0.73 0.41 -0.19 0.00 0.48 0.00 0.00 55.95 57.38 2qs0 s SER 116 Cb -0.06 0.45 -0.04 0.00 0.10 0.00 0.00 66.02 66.47 2qs0 s SER 116 CO 0.04 -0.58 1.09 0.35 0.98 0.00 0.00 173.24 175.12 2qs0 n THR 117 N 0.49 4.05 0.10 2.02 -2.24 -1.26 -4.81 114.28 112.61 2qs0 n THR 117 Ca -0.14 -0.50 -0.03 0.00 -2.27 0.00 0.00 64.05 61.11 2qs0 n THR 117 Cb 0.59 -1.29 0.19 0.00 -2.10 0.00 0.00 70.33 67.72 2qs0 n THR 117 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qs0 h ALA 118 N 0.60 1.02 -0.87 6.98 0.00 -1.97 0.15 119.26 125.17 2qs0 h ALA 118 Ca -0.49 -0.46 0.01 0.00 0.00 0.00 0.00 54.91 53.97 2qs0 h ALA 118 Cb 1.35 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 19.01 2qs0 h ALA 118 CO 0.52 0.64 0.58 0.93 0.00 0.00 0.00 179.25 181.92 2qs0 h GLU 119 N 0.17 1.13 0.08 0.00 5.08 -1.90 0.26 114.58 119.41 2qs0 h GLU 119 Ca 0.01 -0.07 -0.26 0.00 -1.00 0.00 0.00 59.36 58.04 2qs0 h GLU 119 Cb 0.93 -0.25 0.01 0.00 0.50 0.00 0.00 28.75 29.93 2qs0 h GLU 119 CO 0.07 0.74 -1.13 0.00 -1.00 0.00 0.00 179.01 177.70 2qs0 h THR 120 N 1.16 1.45 -0.22 1.13 1.03 -1.75 -3.17 112.91 112.54 2qs0 h THR 120 Ca 0.33 -2.79 -0.03 0.00 -0.01 0.00 0.00 66.41 63.91 2qs0 h THR 120 Cb -0.10 2.74 -0.01 0.00 -1.07 0.00 0.00 68.15 69.70 2qs0 h THR 120 CO -0.08 0.82 0.02 0.11 -0.01 0.00 0.00 175.52 176.38 2qs0 h LYS 121 N 0.14 0.31 0.00 0.00 1.57 0.12 -0.47 116.57 118.25 2qs0 h LYS 121 Ca -0.12 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.61 2qs0 h LYS 121 Cb 1.82 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 34.07 2qs0 h LYS 121 CO 0.19 0.33 0.00 0.00 -0.57 0.00 0.00 179.45 179.40 2qs0 n ALA 122 N -2.49 1.28 -0.21 3.86 0.00 -0.03 -0.75 120.51 122.18 2qs0 n ALA 122 Ca 0.00 -0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.45 2qs0 n ALA 122 Cb 0.18 -1.00 0.01 0.00 0.00 0.00 0.00 19.45 18.64 2qs0 n ALA 122 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2qs0 n TYR 123 N -1.22 0.00 -3.93 0.00 4.01 -0.19 -4.67 117.16 111.16 2qs0 n TYR 123 Ca 0.00 -0.47 -0.25 0.00 -0.16 0.00 0.00 57.90 57.02 2qs0 n TYR 123 Cb 0.00 -0.05 -0.03 0.00 -0.31 0.00 0.00 39.34 38.95 2qs0 n TYR 123 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2qs0 s ALA 124 N -0.99 3.95 -0.05 -0.72 0.00 0.07 -4.88 121.76 119.13 2qs0 s ALA 124 Ca 0.02 -1.08 0.03 0.00 0.00 0.00 0.00 51.96 50.94 2qs0 s ALA 124 Cb 0.02 -1.78 -0.25 0.00 0.00 0.00 0.00 23.12 21.11 2qs0 s ALA 124 CO 0.00 0.44 0.63 -0.44 0.00 0.00 0.00 175.76 176.40 2qs0 h ASP 125 N 1.83 0.21 -4.94 0.00 3.32 -1.01 -3.41 116.42 112.43 2qs0 h ASP 125 Ca -0.49 -0.41 -0.06 0.00 0.02 0.00 0.00 57.03 56.08 2qs0 h ASP 125 Cb 1.20 -0.07 -0.19 0.00 0.22 0.00 0.00 39.33 40.49 2qs0 h ASP 125 CO 0.66 1.36 0.17 0.54 -1.72 0.00 0.00 179.24 180.25 2qs0 s VAL 126 N -2.59 0.00 0.61 -1.35 0.11 -1.19 -4.32 120.40 111.67 2qs0 s VAL 126 Ca -0.11 -0.02 0.07 0.00 -2.93 0.00 0.00 61.98 59.00 2qs0 s VAL 126 Cb 0.07 -0.98 0.10 0.00 -1.53 0.00 0.00 36.38 34.04 2qs0 s VAL 126 CO 0.81 -0.01 0.84 0.42 -3.33 0.00 0.00 175.10 173.84 2qs0 s THR 127 N -1.10 2.11 -0.09 5.04 -4.23 -0.93 -2.65 115.64 113.79 2qs0 s THR 127 Ca -0.10 -0.91 -0.30 0.00 -1.18 0.00 0.00 61.69 59.19 2qs0 s THR 127 Cb -0.01 -2.20 0.08 0.00 1.34 0.00 0.00 72.50 71.72 2qs0 s THR 127 CO 0.09 0.00 0.74 0.54 -0.54 0.00 0.00 174.62 175.45 2qs0 s VAL 128 N -2.78 0.00 0.30 2.29 0.11 -0.59 -4.65 120.40 115.08 2qs0 s VAL 128 Ca 0.63 0.00 0.11 0.00 -2.93 0.00 0.00 61.98 59.79 2qs0 s VAL 128 Cb -0.05 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 33.74 2qs0 s VAL 128 CO 0.40 0.00 -0.12 0.42 -3.33 0.00 0.00 175.10 172.48 2qs0 s THR 129 N -1.02 2.56 0.23 5.04 -4.23 -1.26 -0.23 115.64 116.73 2qs0 s THR 129 Ca -0.08 -2.23 -0.11 0.00 -1.18 0.00 0.00 61.69 58.08 2qs0 s THR 129 Cb -0.01 -2.53 0.29 0.00 1.34 0.00 0.00 72.50 71.59 2qs0 s THR 129 CO 0.08 -0.32 1.61 0.28 -0.54 0.00 0.00 174.62 175.74 2qs0 h SER 130 N 2.09 -0.61 -0.38 3.99 0.02 -2.01 0.77 113.55 117.42 2qs0 h SER 130 Ca -0.41 0.21 0.07 0.00 -0.84 0.00 0.00 61.79 60.82 2qs0 h SER 130 Cb 1.25 0.43 -0.07 0.00 0.14 0.00 0.00 62.40 64.15 2qs0 h SER 130 CO 0.64 -0.23 -0.06 0.00 -1.14 0.00 0.00 176.83 176.04 2qs0 h ALA 131 N 1.72 0.29 -0.33 3.77 0.00 -2.04 -3.17 119.26 119.49 2qs0 h ALA 131 Ca 0.36 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.40 2qs0 h ALA 131 Cb 0.57 0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.61 2qs0 h ALA 131 CO -0.73 -0.44 0.00 0.27 0.00 0.00 0.00 179.25 178.36 2qs0 n ASN 132 N -5.26 3.29 -0.09 0.00 0.23 -0.59 -4.66 115.26 108.19 2qs0 n ASN 132 Ca 0.02 -1.95 -0.10 0.00 -0.53 0.00 0.00 54.58 52.01 2qs0 n ASN 132 Cb 0.21 -0.21 -0.05 0.00 -2.08 0.00 0.00 39.78 37.65 2qs0 n ASN 132 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2qs0 h ALA 133 N 4.14 -0.46 -0.04 -2.53 0.00 -0.86 -0.33 119.26 119.18 2qs0 h ALA 133 Ca 0.00 0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.97 2qs0 h ALA 133 Cb 0.93 0.84 -0.02 0.00 0.00 0.00 0.00 17.79 19.54 2qs0 h ALA 133 CO 0.00 -0.87 -0.09 0.28 0.00 0.00 0.00 179.25 178.57 2qs0 h VAL 134 N -0.37 0.77 0.36 0.00 2.07 -1.83 0.43 116.25 117.68 2qs0 h VAL 134 Ca 0.12 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.63 2qs0 h VAL 134 Cb 0.59 0.77 -0.02 0.00 -1.52 0.00 0.00 31.29 31.11 2qs0 h VAL 134 CO -0.51 0.00 -0.43 -0.78 0.02 0.00 0.00 177.57 175.87 2qs0 h ASP 135 N -0.13 -1.19 -0.45 0.57 3.58 -1.74 -1.27 116.42 115.79 2qs0 h ASP 135 Ca 0.05 0.10 0.04 0.00 0.42 0.00 0.00 57.03 57.64 2qs0 h ASP 135 Cb 0.20 0.40 -0.04 0.00 1.72 0.00 0.00 39.33 41.60 2qs0 h ASP 135 CO -0.12 -0.54 0.20 0.40 -2.88 0.00 0.00 179.24 176.30 2qs0 h ILE 136 N -0.80 0.93 -0.01 2.25 2.04 -1.03 -1.58 117.51 119.30 2qs0 h ILE 136 Ca -0.04 -0.14 -0.03 0.00 1.00 0.00 0.00 64.86 65.65 2qs0 h ILE 136 Cb 0.71 0.49 -0.01 0.00 -0.74 0.00 0.00 36.82 37.28 2qs0 h ILE 136 CO -0.09 0.07 -0.15 0.40 0.00 0.00 0.00 178.15 178.38 2qs0 h ILE 137 N 0.40 1.11 -0.02 -0.67 2.04 -0.80 -1.99 117.51 117.58 2qs0 h ILE 137 Ca 0.20 -0.54 -0.20 0.00 1.00 0.00 0.00 64.86 65.32 2qs0 h ILE 137 Cb 0.14 1.28 -0.01 0.00 -0.74 0.00 0.00 36.82 37.50 2qs0 h ILE 137 CO -0.17 0.16 -0.85 -0.09 0.00 0.00 0.00 178.15 177.21 2qs0 h ARG 138 N 0.01 0.32 -0.33 2.37 2.43 -0.69 -3.24 114.38 115.25 2qs0 h ARG 138 Ca 0.00 -0.32 -0.02 0.00 -0.81 0.00 0.00 59.98 58.83 2qs0 h ARG 138 Cb 0.28 0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.90 2qs0 h ARG 138 CO 0.02 1.00 0.12 0.87 -1.51 0.00 0.00 179.97 180.46 2qs0 h LYS 139 N 0.19 0.51 -6.31 0.20 1.57 -0.59 -3.44 116.57 108.70 2qs0 h LYS 139 Ca -0.05 -0.10 -0.65 0.00 -1.87 0.00 0.00 60.65 57.97 2qs0 h LYS 139 Cb 1.46 -0.08 0.08 0.00 0.08 0.00 0.00 32.23 33.77 2qs0 h LYS 139 CO 0.14 0.53 0.25 1.28 -0.57 0.00 0.00 179.45 181.08 2qs0 n LEU 140 N -4.68 1.43 0.09 2.94 4.77 -0.90 -4.91 117.00 115.75 2qs0 n LEU 140 Ca -0.01 1.14 -0.06 0.00 -0.03 0.00 0.00 56.01 57.05 2qs0 n LEU 140 Cb 0.15 -1.20 -0.03 0.00 -2.33 0.00 0.00 43.42 40.01 2qs0 n LEU 140 CO 0.37 -1.34 0.51 0.44 -1.33 0.00 0.00 177.39 176.03 2qs0 h ASP 141 N 3.35 -0.44 -1.78 -1.43 3.32 -1.89 -3.44 116.42 114.11 2qs0 h ASP 141 Ca -0.43 0.04 -0.62 0.00 0.02 0.00 0.00 57.03 56.03 2qs0 h ASP 141 Cb 1.35 0.15 0.15 0.00 0.22 0.00 0.00 39.33 41.19 2qs0 h ASP 141 CO 0.70 -0.21 -0.77 -0.24 -1.72 0.00 0.00 179.24 176.99 2qs0 n SER 142 N -3.29 -2.23 -1.17 6.45 2.88 -1.26 -4.86 113.62 110.14 2qs0 n SER 142 Ca -0.04 0.86 0.11 0.00 -1.33 0.00 0.00 58.87 58.48 2qs0 n SER 142 Cb 0.15 -0.95 0.25 0.00 -0.75 0.00 0.00 64.21 62.92 2qs0 n SER 142 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2qs0 n ASP 143 N 2.04 3.60 -4.10 -3.46 8.00 -1.26 -4.79 116.55 116.57 2qs0 n ASP 143 Ca 0.12 -1.98 -0.30 0.00 0.71 0.00 0.00 54.79 53.34 2qs0 n ASP 143 Cb 0.38 -0.36 -0.17 0.00 -0.02 0.00 0.00 41.12 40.96 2qs0 n ASP 143 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2qs0 s VAL 144 N -1.18 1.68 -0.03 2.53 1.01 -1.26 -0.24 120.40 122.92 2qs0 s VAL 144 Ca 0.41 -0.76 0.02 0.00 0.00 0.00 0.00 61.98 61.65 2qs0 s VAL 144 Cb 0.23 -1.51 0.01 0.00 0.00 0.00 0.00 36.38 35.10 2qs0 s VAL 144 CO 0.30 0.48 -0.08 -0.63 0.00 0.00 0.00 175.10 175.17 2qs0 s ILE 145 N 0.87 0.71 -0.28 2.22 1.09 -0.20 -3.83 121.20 121.78 2qs0 s ILE 145 Ca -0.08 -0.31 -0.18 0.00 -1.10 0.00 0.00 60.65 58.98 2qs0 s ILE 145 Cb -0.15 -0.65 -0.02 0.00 -1.06 0.00 0.00 42.46 40.57 2qs0 s ILE 145 CO -0.00 0.23 0.51 -0.63 -0.10 0.00 0.00 174.94 174.95 2qs0 s ILE 146 N 0.30 5.06 0.05 2.92 1.01 -0.06 -0.22 121.20 130.27 2qs0 s ILE 146 Ca -0.05 0.77 0.05 0.00 0.00 0.00 0.00 60.65 61.42 2qs0 s ILE 146 Cb -0.09 -3.85 -0.02 0.00 0.01 0.00 0.00 42.46 38.51 2qs0 s ILE 146 CO 0.00 0.03 -0.13 0.12 0.00 0.00 0.00 174.94 174.97 2qs0 s PHE 147 N 2.32 1.15 0.00 3.97 5.36 -0.29 0.90 117.98 131.38 2qs0 s PHE 147 Ca 0.20 -0.39 0.00 0.00 -0.96 0.00 0.00 56.93 55.79 2qs0 s PHE 147 Cb -0.16 -0.67 0.00 0.00 -0.34 0.00 0.00 43.02 41.85 2qs0 s PHE 147 CO 0.10 0.03 0.00 0.41 -1.46 0.00 0.00 175.22 174.30 2qs0 n GLY 148 N 1.72 0.10 1.44 13.12 0.00 -1.00 -1.17 105.19 119.40 2qs0 n GLY 148 Ca -0.19 -0.94 0.10 0.00 0.00 0.00 0.00 46.02 44.99 2qs0 n GLY 148 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2qs0 n PRO 149 N -0.19 3.12 -2.76 1.61 -0.04 -1.25 -0.32 135.00 135.17 2qs0 n PRO 149 Ca 0.00 -2.68 -0.42 0.00 -0.04 0.00 0.00 63.50 60.36 2qs0 n PRO 149 Cb 0.00 -1.71 -0.04 0.00 -0.04 0.00 0.00 33.50 31.72 2qs0 n PRO 149 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2qs0 s ASP 150 N -0.94 6.22 0.19 3.54 -1.08 -1.26 -4.75 116.67 118.58 2qs0 s ASP 150 Ca 0.49 -0.65 -0.12 0.00 -0.52 0.00 0.00 52.55 51.75 2qs0 s ASP 150 Cb 0.28 -2.46 0.17 0.00 -1.46 0.00 0.00 42.92 39.45 2qs0 s ASP 150 CO 0.29 -1.49 1.78 0.11 0.52 0.00 0.00 175.17 176.38 2qs0 h LYS 151 N 9.62 0.50 -0.09 4.34 1.79 -1.96 -0.41 116.57 130.36 2qs0 h LYS 151 Ca -0.28 -0.03 0.02 0.00 -2.18 0.00 0.00 60.65 58.18 2qs0 h LYS 151 Cb 1.07 -0.11 -0.02 0.00 -1.58 0.00 0.00 32.23 31.58 2qs0 h LYS 151 CO 1.18 0.33 -0.03 -0.91 -1.08 0.00 0.00 179.45 178.94 2qs0 h ASN 152 N 0.52 -0.11 -0.52 0.86 2.35 -1.99 -0.90 115.58 115.78 2qs0 h ASN 152 Ca 0.25 0.03 -0.01 0.00 -0.55 0.00 0.00 56.30 56.02 2qs0 h ASN 152 Cb 0.17 0.07 -0.03 0.00 0.05 0.00 0.00 38.32 38.58 2qs0 h ASN 152 CO -0.18 -0.04 0.29 0.25 -1.65 0.00 0.00 177.43 176.10 2qs0 h LEU 153 N -0.02 0.67 0.22 1.61 5.85 -1.89 0.17 115.31 121.92 2qs0 h LEU 153 Ca 0.05 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 2qs0 h LEU 153 Cb 0.09 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 40.95 2qs0 h LEU 153 CO -0.11 0.54 -0.10 0.00 -0.34 0.00 0.00 178.44 178.43 2qs0 h ALA 154 N 1.57 -0.29 -0.68 1.25 0.00 -0.65 -0.04 119.26 120.43 2qs0 h ALA 154 Ca 0.19 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2qs0 h ALA 154 Cb 0.03 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 2qs0 h ALA 154 CO -0.03 -0.55 0.38 0.45 0.00 0.00 0.00 179.25 179.50 2qs0 h HIS 155 N -0.52 0.90 0.67 0.00 3.86 -0.71 0.14 115.15 119.50 2qs0 h HIS 155 Ca -0.03 -0.01 -0.03 0.00 -1.16 0.00 0.00 60.37 59.15 2qs0 h HIS 155 Cb 0.39 -0.29 -0.01 0.00 1.06 0.00 0.00 27.41 28.55 2qs0 h HIS 155 CO 0.00 0.62 -0.47 -0.92 0.86 0.00 0.00 177.93 178.02 2qs0 h TYR 156 N 0.94 -1.28 -0.67 2.45 3.20 -0.38 0.40 116.97 121.62 2qs0 h TYR 156 Ca 0.24 -0.01 0.12 0.00 3.14 0.00 0.00 58.73 62.23 2qs0 h TYR 156 Cb 0.00 0.47 -0.09 0.00 1.54 0.00 0.00 36.73 38.65 2qs0 h TYR 156 CO 0.01 -0.69 0.21 0.28 -1.64 0.00 0.00 178.16 176.33 2qs0 h VAL 157 N -1.10 0.65 0.07 1.81 2.07 -0.61 -0.85 116.25 118.29 2qs0 h VAL 157 Ca -0.09 -0.12 0.03 0.00 0.82 0.00 0.00 66.70 67.34 2qs0 h VAL 157 Cb 0.90 0.27 -0.05 0.00 -1.52 0.00 0.00 31.29 30.90 2qs0 h VAL 157 CO 0.05 0.06 -0.36 0.00 0.02 0.00 0.00 177.57 177.34 2qs0 h ALA 158 N 1.51 -0.59 -0.41 1.67 0.00 -0.33 0.14 119.26 121.25 2qs0 h ALA 158 Ca 0.36 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.28 2qs0 h ALA 158 Cb 0.53 0.62 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 2qs0 h ALA 158 CO -0.40 -0.90 0.27 0.87 0.00 0.00 0.00 179.25 179.10 2qs0 h LYS 159 N -0.56 0.31 0.05 0.00 1.57 0.00 0.70 116.57 118.64 2qs0 h LYS 159 Ca 0.04 -0.02 -0.33 0.00 -1.87 0.00 0.00 60.65 58.47 2qs0 h LYS 159 Cb 0.61 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.81 2qs0 h LYS 159 CO -0.25 0.21 -1.90 0.28 -0.57 0.00 0.00 179.45 177.22 2qs0 n VAL 160 N -4.48 1.65 -0.03 0.50 0.31 -0.41 -4.45 118.33 111.42 2qs0 n VAL 160 Ca 0.05 -0.74 -0.06 0.00 -0.01 0.00 0.00 64.34 63.58 2qs0 n VAL 160 Cb 0.24 -1.27 -0.14 0.00 -0.91 0.00 0.00 33.84 31.77 2qs0 n VAL 160 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2qs0 n THR 161 N -3.19 1.41 -0.05 2.52 -2.24 0.43 -4.97 114.28 108.18 2qs0 n THR 161 Ca -0.25 -0.78 0.00 0.00 -2.27 0.00 0.00 64.05 60.75 2qs0 n THR 161 Cb 1.06 -0.78 0.00 0.00 -2.10 0.00 0.00 70.33 68.50 2qs0 n THR 161 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2qs0 n GLY 162 N 1.56 2.81 3.66 3.38 0.00 0.23 -5.01 105.19 111.82 2qs0 n GLY 162 Ca -0.19 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.53 2qs0 n GLY 162 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qs0 s LYS 163 N -0.03 0.80 -0.64 1.61 1.02 -1.26 -4.92 119.74 116.32 2qs0 s LYS 163 Ca 0.00 1.04 -0.27 0.00 0.02 0.00 0.00 55.97 56.76 2qs0 s LYS 163 Cb 0.00 -1.74 0.04 0.00 -0.52 0.00 0.00 37.83 35.61 2qs0 s LYS 163 CO 0.00 -2.61 1.17 0.99 -0.92 0.00 0.00 175.35 173.97 2qs0 s THR 164 N -2.76 3.99 -0.40 2.17 2.01 0.67 -4.81 115.64 116.52 2qs0 s THR 164 Ca 0.65 0.50 -0.17 0.00 0.31 0.00 0.00 61.69 62.99 2qs0 s THR 164 Cb -0.21 -4.77 0.01 0.00 0.01 0.00 0.00 72.50 67.55 2qs0 s THR 164 CO 0.59 -1.51 0.43 -0.63 -0.69 0.00 0.00 174.62 172.80 2qs0 s ILE 165 N 5.01 5.09 -0.44 1.82 -1.09 -1.26 -1.03 121.20 129.29 2qs0 s ILE 165 Ca 0.36 -0.19 -0.19 0.00 -2.23 0.00 0.00 60.65 58.40 2qs0 s ILE 165 Cb -0.09 -3.99 0.03 0.00 -1.58 0.00 0.00 42.46 36.83 2qs0 s ILE 165 CO 0.19 -0.33 0.55 -0.63 -1.23 0.00 0.00 174.94 173.48 2qs0 s ILE 166 N 2.14 4.95 0.49 2.92 1.09 0.70 -4.95 121.20 128.55 2qs0 s ILE 166 Ca 0.13 -0.22 -0.19 0.00 -1.10 0.00 0.00 60.65 59.27 2qs0 s ILE 166 Cb -0.17 -4.15 -0.08 0.00 -1.06 0.00 0.00 42.46 37.00 2qs0 s ILE 166 CO 0.13 -0.56 1.00 -2.16 -0.10 0.00 0.00 174.94 173.25 2qs0 s PRO 167 N 2.47 3.88 -0.04 2.79 0.04 -1.26 -1.14 135.00 141.74 2qs0 s PRO 167 Ca 0.16 1.18 -0.02 0.00 0.04 0.00 0.00 61.00 62.36 2qs0 s PRO 167 Cb -0.16 -2.12 0.03 0.00 0.04 0.00 0.00 34.50 32.29 2qs0 s PRO 167 CO 0.15 -0.34 0.09 0.96 0.04 0.00 0.00 177.00 177.91 2qs0 s ILE 168 N -2.26 -0.05 0.67 0.56 -4.36 -0.32 -3.47 121.20 111.98 2qs0 s ILE 168 Ca 0.63 0.18 -0.17 0.00 -0.26 0.00 0.00 60.65 61.04 2qs0 s ILE 168 Cb -0.13 -0.17 0.01 0.00 1.25 0.00 0.00 42.46 43.42 2qs0 s ILE 168 CO 0.23 0.07 1.21 -2.84 0.24 0.00 0.00 174.94 173.85 2qs0 s PRO 169 N 1.03 2.51 0.41 0.37 0.02 -1.26 -3.88 135.00 134.20 2qs0 s PRO 169 Ca -0.08 1.78 -0.25 0.00 0.02 0.00 0.00 61.00 62.47 2qs0 s PRO 169 Cb -0.11 -1.88 -0.08 0.00 0.02 0.00 0.00 34.50 32.45 2qs0 s PRO 169 CO -0.04 -1.56 1.22 -1.25 -0.33 0.00 0.00 177.00 175.04 2qs0 s PRO 170 N -3.68 3.95 0.73 5.54 0.04 -1.23 -5.01 135.00 135.34 2qs0 s PRO 170 Ca 0.76 1.95 -0.07 0.00 0.04 0.00 0.00 61.00 63.68 2qs0 s PRO 170 Cb -0.30 -2.65 0.08 0.00 0.04 0.00 0.00 34.50 31.67 2qs0 s PRO 170 CO 0.40 -0.44 1.04 -1.83 0.04 0.00 0.00 177.00 176.22 2qs0 s GLU 171 N -2.35 2.01 0.00 4.56 -1.05 -1.26 -4.33 118.70 116.28 2qs0 s GLU 171 Ca 0.58 -0.33 0.00 0.00 -0.15 0.00 0.00 54.97 55.08 2qs0 s GLU 171 Cb -0.33 -2.15 0.00 0.00 -0.44 0.00 0.00 34.13 31.21 2qs0 s GLU 171 CO 0.42 -1.37 0.00 0.41 0.95 0.00 0.00 175.26 175.67 2qs0 n GLY 172 N -3.00 0.83 3.34 -3.83 0.00 -1.26 -5.06 105.19 96.22 2qs0 n GLY 172 Ca 0.09 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.93 2qs0 n GLY 172 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2qs0 s HIS 173 N -2.09 1.65 -0.09 1.61 3.76 -1.26 -5.15 115.29 113.73 2qs0 s HIS 173 Ca 0.00 -0.68 0.01 0.00 -0.15 0.00 0.00 55.06 54.24 2qs0 s HIS 173 Cb 0.00 -0.85 -0.02 0.00 1.11 0.00 0.00 32.58 32.82 2qs0 s HIS 173 CO 0.00 0.23 -0.10 0.00 -0.85 0.00 0.00 174.74 174.02 2qs0 n TYR 175 N 2.69 0.53 0.25 0.00 4.01 -1.26 -4.77 117.16 118.60 2qs0 n TYR 175 Ca -0.18 -1.13 -0.15 0.00 -0.16 0.00 0.00 57.90 56.29 2qs0 n TYR 175 Cb 0.53 -0.28 -0.08 0.00 -0.31 0.00 0.00 39.34 39.19 2qs0 n TYR 175 CO 0.00 0.00 0.00 -0.39 -0.46 0.00 0.00 176.86 176.01 2qs0 h VAL 176 N 0.92 0.00 -0.82 -0.72 -1.51 -1.98 -0.43 116.25 111.70 2qs0 h VAL 176 Ca 0.04 0.00 0.17 0.00 -1.23 0.00 0.00 66.70 65.69 2qs0 h VAL 176 Cb 1.28 0.00 -0.06 0.00 -2.13 0.00 0.00 31.29 30.38 2qs0 h VAL 176 CO 0.15 0.00 0.55 0.45 -1.23 0.00 0.00 177.57 177.49 2qs0 h HIS 177 N -0.83 0.49 -0.10 5.19 3.86 -1.87 0.31 115.15 122.21 2qs0 h HIS 177 Ca -0.06 0.01 -0.18 0.00 -1.16 0.00 0.00 60.37 58.99 2qs0 h HIS 177 Cb 0.71 -0.15 -0.01 0.00 1.06 0.00 0.00 27.41 29.02 2qs0 h HIS 177 CO -0.19 0.16 -0.68 0.87 0.86 0.00 0.00 177.93 178.95 2qs0 h LYS 178 N 0.40 0.42 0.00 2.45 1.79 -1.68 -3.06 116.57 116.90 2qs0 h LYS 178 Ca 0.41 -0.32 0.00 0.00 -2.18 0.00 0.00 60.65 58.56 2qs0 h LYS 178 Cb 1.00 0.06 0.00 0.00 -1.58 0.00 0.00 32.23 31.71 2qs0 h LYS 178 CO -0.14 0.95 0.00 1.63 -1.08 0.00 0.00 179.45 180.81 2qs0 n LYS 179 N -3.87 0.06 -2.65 3.15 4.01 0.10 -4.69 118.16 114.27 2qs0 n LYS 179 Ca -0.04 0.29 -0.32 0.00 -0.51 0.00 0.00 58.31 57.72 2qs0 n LYS 179 Cb 0.68 -1.50 -0.05 0.00 -0.51 0.00 0.00 35.03 33.65 2qs0 n LYS 179 CO 0.00 0.00 0.00 -0.06 -1.11 0.00 0.00 177.40 176.23 2qs0 s PHE 180 N -2.71 3.39 0.13 2.13 0.08 -1.15 -5.07 117.98 114.77 2qs0 s PHE 180 Ca 0.05 1.48 -0.08 0.00 0.12 0.00 0.00 56.93 58.50 2qs0 s PHE 180 Cb 0.04 -2.77 -0.01 0.00 -0.57 0.00 0.00 43.02 39.71 2qs0 s PHE 180 CO 0.09 -0.22 0.22 0.95 -0.10 0.00 0.00 175.22 176.17 2qs0 s THR 181 N -2.39 0.10 0.25 0.64 -4.23 -1.26 -4.88 115.64 103.87 2qs0 s THR 181 Ca 0.59 -1.37 -0.04 0.00 -1.18 0.00 0.00 61.69 59.70 2qs0 s THR 181 Cb -0.10 -1.66 0.21 0.00 1.34 0.00 0.00 72.50 72.29 2qs0 s THR 181 CO 0.23 -0.46 1.79 0.40 -0.54 0.00 0.00 174.62 176.04 2qs0 h ILE 182 N 2.66 0.84 -0.57 2.99 2.04 -1.95 0.19 117.51 123.72 2qs0 h ILE 182 Ca -0.33 -0.24 0.12 0.00 1.00 0.00 0.00 64.86 65.41 2qs0 h ILE 182 Cb 1.21 0.08 -0.03 0.00 -0.74 0.00 0.00 36.82 37.34 2qs0 h ILE 182 CO 0.53 0.13 0.39 -0.33 0.00 0.00 0.00 178.15 178.87 2qs0 h GLU 183 N 0.70 0.23 -0.01 2.37 3.07 -1.98 1.17 114.58 120.14 2qs0 h GLU 183 Ca 0.41 -0.01 -0.09 0.00 -0.50 0.00 0.00 59.36 59.16 2qs0 h GLU 183 Cb 0.45 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.29 2qs0 h GLU 183 CO -0.29 0.15 -0.41 -0.44 -1.40 0.00 0.00 179.01 176.62 2qs0 h ASP 184 N 0.24 0.01 0.42 1.42 3.32 -1.03 0.34 116.42 121.14 2qs0 h ASP 184 Ca 0.27 -0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.30 2qs0 h ASP 184 Cb 0.74 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.30 2qs0 h ASP 184 CO -0.05 0.42 -0.20 0.58 -1.72 0.00 0.00 179.24 178.27 2qs0 h VAL 185 N 0.01 0.00 0.06 -1.35 2.07 0.17 -1.18 116.25 116.02 2qs0 h VAL 185 Ca -0.00 -0.20 0.02 0.00 0.82 0.00 0.00 66.70 67.34 2qs0 h VAL 185 Cb 0.73 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.45 2qs0 h VAL 185 CO 0.05 0.00 -0.48 -0.33 0.02 0.00 0.00 177.57 176.84 2qs0 h GLU 186 N -0.76 -0.64 -0.68 1.57 5.08 -1.17 0.35 114.58 118.34 2qs0 h GLU 186 Ca -0.06 0.04 0.20 0.00 -1.00 0.00 0.00 59.36 58.54 2qs0 h GLU 186 Cb 0.43 0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.80 2qs0 h GLU 186 CO 0.09 -0.43 0.67 -0.09 -1.00 0.00 0.00 179.01 178.25 2qs0 h ARG 187 N -0.67 0.00 0.00 2.33 1.12 -1.01 0.57 114.38 116.72 2qs0 h ARG 187 Ca 0.02 0.00 -0.05 0.00 -1.11 0.00 0.00 59.98 58.84 2qs0 h ARG 187 Cb 0.71 0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 30.66 2qs0 h ARG 187 CO -0.31 0.00 -1.11 0.00 -3.11 0.00 0.00 179.97 175.44 2qs0 n ALA 188 N -2.41 2.36 -0.06 2.80 0.00 0.82 -3.66 120.51 120.36 2qs0 n ALA 188 Ca 0.14 -0.31 -0.02 0.00 0.00 0.00 0.00 53.44 53.24 2qs0 n ALA 188 Cb 0.91 -1.07 -0.01 0.00 0.00 0.00 0.00 19.45 19.28 2qs0 n ALA 188 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2qs0 h LYS 189 N 0.00 0.00 0.00 0.00 1.57 0.37 -3.32 116.57 115.19 2qs0 h LYS 189 Ca -0.04 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2qs0 h LYS 189 Cb 1.16 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.47 2qs0 h LYS 189 CO 0.01 0.03 0.15 0.87 -0.57 0.00 0.00 179.45 179.94 2qs0 h LYS 190 N -1.00 0.00 -5.99 3.15 6.56 -1.55 -2.88 116.57 114.86 2qs0 h LYS 190 Ca -0.00 0.00 -0.68 0.00 -1.06 0.00 0.00 60.65 58.91 2qs0 h LYS 190 Cb 0.21 0.00 -0.20 0.00 -0.57 0.00 0.00 32.23 31.67 2qs0 h LYS 190 CO -0.00 0.00 -0.69 -1.17 -2.06 0.00 0.00 179.45 175.53 2qs0 s LEU 191 N -4.79 3.17 -1.37 2.94 2.96 -1.24 -4.46 118.68 115.90 2qs0 s LEU 191 Ca -0.03 -0.04 -0.09 0.00 -0.22 0.00 0.00 54.13 53.75 2qs0 s LEU 191 Cb 0.07 -1.70 0.02 0.00 0.50 0.00 0.00 46.19 45.07 2qs0 s LEU 191 CO 0.21 0.33 1.13 1.41 -1.32 0.00 0.00 176.35 178.11 2qs0 n HIS 192 N 2.45 -2.73 0.31 5.38 8.25 -1.26 -4.66 115.22 122.96 2qs0 n HIS 192 Ca -0.18 0.99 0.11 0.00 -0.26 0.00 0.00 57.72 58.38 2qs0 n HIS 192 Cb 0.53 -4.88 0.58 0.00 1.12 0.00 0.00 29.99 27.34 2qs0 n HIS 192 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 2qs0 h PRO 193 N -2.54 0.00 -3.56 -0.41 0.11 -1.72 -3.23 132.00 120.64 2qs0 h PRO 193 Ca -0.57 0.00 -0.80 0.00 0.11 0.00 0.00 66.00 64.74 2qs0 h PRO 193 Cb 1.37 0.00 -0.28 0.00 0.11 0.00 0.00 31.00 32.20 2qs0 h PRO 193 CO 0.57 0.00 0.44 -0.80 -0.21 0.00 0.00 178.00 178.01 2qs0 s ASN 194 N -3.97 7.31 0.00 -2.05 0.01 -1.26 -4.93 114.94 110.05 2qs0 s ASN 194 Ca -0.02 -3.60 0.00 0.00 -0.71 0.00 0.00 52.86 48.53 2qs0 s ASN 194 Cb 0.06 -2.21 0.00 0.00 0.41 0.00 0.00 41.25 39.51 2qs0 s ASN 194 CO 0.19 -0.29 0.00 0.00 -1.51 0.00 0.00 177.10 175.50 2qs0 n ALA 195 N 2.70 0.00 -2.39 0.60 0.00 -1.22 -4.97 120.51 115.23 2qs0 n ALA 195 Ca 0.24 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.33 2qs0 n ALA 195 Cb 0.39 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.79 2qs0 n ALA 195 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2qs0 s LYS 196 N -1.84 3.93 0.22 0.00 -0.14 -1.26 -4.93 119.74 115.72 2qs0 s LYS 196 Ca 0.00 0.42 -0.24 0.00 -1.36 0.00 0.00 55.97 54.79 2qs0 s LYS 196 Cb 0.00 -2.91 -0.09 0.00 -1.68 0.00 0.00 37.83 33.16 2qs0 s LYS 196 CO 0.00 0.47 0.81 -0.51 -0.76 0.00 0.00 175.35 175.36 2qs0 s LEU 197 N -2.05 4.47 -0.22 3.17 1.43 -1.26 -3.35 118.68 120.87 2qs0 s LEU 197 Ca 0.38 1.65 -0.03 0.00 -1.03 0.00 0.00 54.13 55.10 2qs0 s LEU 197 Cb -0.14 -3.56 0.00 0.00 0.03 0.00 0.00 46.19 42.52 2qs0 s LEU 197 CO 0.19 0.09 -0.06 -0.32 0.23 0.00 0.00 176.35 176.48 2qs0 s MET 198 N -1.59 3.23 0.13 1.70 1.75 -0.55 -3.90 119.30 120.07 2qs0 s MET 198 Ca 0.41 -0.72 0.09 0.00 -1.25 0.00 0.00 55.69 54.23 2qs0 s MET 198 Cb -0.20 -2.96 -0.04 0.00 2.84 0.00 0.00 34.83 34.47 2qs0 s MET 198 CO 0.25 -0.24 -0.19 0.08 -0.65 0.00 0.00 175.02 174.27 2qs0 s VAL 199 N 1.43 2.76 -0.03 10.11 1.01 -0.40 0.10 120.40 135.38 2qs0 s VAL 199 Ca 0.05 -1.61 -0.01 0.00 0.00 0.00 0.00 61.98 60.41 2qs0 s VAL 199 Cb -0.15 -2.28 -0.04 0.00 0.00 0.00 0.00 36.38 33.92 2qs0 s VAL 199 CO -0.05 0.05 0.06 -2.28 0.00 0.00 0.00 175.10 172.89 2qs0 s HIS 200 N -1.25 3.26 0.31 5.22 5.65 -1.25 -1.18 115.29 126.05 2qs0 s HIS 200 Ca 0.19 0.22 0.07 0.00 0.25 0.00 0.00 55.06 55.78 2qs0 s HIS 200 Cb -0.10 -1.76 0.82 0.00 -1.18 0.00 0.00 32.58 30.36 2qs0 s HIS 200 CO 0.10 0.54 1.71 -1.35 -0.65 0.00 0.00 174.74 175.09 2qs0 h PRO 201 N 4.42 0.48 0.00 2.88 0.11 -1.90 -2.28 132.00 135.71 2qs0 h PRO 201 Ca -0.50 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.58 2qs0 h PRO 201 Cb 1.19 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.19 2qs0 h PRO 201 CO 0.60 0.32 0.00 0.39 -0.21 0.00 0.00 178.00 179.09 2qs0 n GLU 202 N -4.96 0.44 -2.81 1.05 1.02 -1.26 -4.74 120.64 109.37 2qs0 n GLU 202 Ca 0.25 0.00 -0.41 0.00 -0.02 0.00 0.00 57.16 56.98 2qs0 n GLU 202 Cb 0.71 -1.31 -0.04 0.00 -0.02 0.00 0.00 31.44 30.78 2qs0 n GLU 202 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2qs0 n ASN 204 N 3.22 0.95 -0.33 0.00 3.02 -1.26 -4.47 115.26 116.39 2qs0 n ASN 204 Ca 0.02 1.00 0.24 0.00 -0.03 0.00 0.00 54.58 55.81 2qs0 n ASN 204 Cb 0.50 -1.32 0.47 0.00 -0.61 0.00 0.00 39.78 38.82 2qs0 n ASN 204 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 2qs0 h PRO 205 N 1.37 0.28 -0.95 3.52 0.11 -1.94 0.23 132.00 134.62 2qs0 h PRO 205 Ca -0.44 -0.02 0.30 0.00 0.11 0.00 0.00 66.00 65.95 2qs0 h PRO 205 Cb 1.35 -0.06 -0.16 0.00 0.11 0.00 0.00 31.00 32.23 2qs0 h PRO 205 CO 0.56 0.18 0.30 0.93 -0.21 0.00 0.00 178.00 179.76 2qs0 h GLU 206 N 0.29 0.12 0.00 1.05 5.08 -2.00 0.40 114.58 119.52 2qs0 h GLU 206 Ca 0.73 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 59.08 2qs0 h GLU 206 Cb 1.67 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.89 2qs0 h GLU 206 CO -0.63 0.08 -1.95 1.55 -1.00 0.00 0.00 179.01 177.06 2qs0 n VAL 207 N -5.28 0.03 0.00 3.13 3.14 0.54 -4.68 118.33 115.21 2qs0 n VAL 207 Ca 0.27 -0.50 0.00 0.00 -2.96 0.00 0.00 64.34 61.15 2qs0 n VAL 207 Cb 0.88 -0.01 0.00 0.00 -1.06 0.00 0.00 33.84 33.65 2qs0 n VAL 207 CO 0.00 0.00 0.00 1.67 -6.46 0.00 0.00 176.83 172.04 2qs0 n GLN 208 N -2.27 0.00 -0.33 1.45 -0.06 0.14 -3.14 117.38 113.17 2qs0 n GLN 208 Ca -0.04 0.45 0.24 0.00 -2.00 0.00 0.00 57.00 55.65 2qs0 n GLN 208 Cb 0.57 -1.16 0.47 0.00 -4.06 0.00 0.00 30.24 26.06 2qs0 n GLN 208 CO 0.00 0.00 0.00 1.05 -0.20 0.00 0.00 177.06 177.91 2qs0 h GLU 209 N 0.00 0.23 0.00 3.69 4.11 -1.79 0.53 114.58 121.35 2qs0 h GLU 209 Ca 0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.42 2qs0 h GLU 209 Cb 0.00 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.20 2qs0 h GLU 209 CO 0.00 0.15 0.00 0.72 0.07 0.00 0.00 179.01 179.95 2qs0 n HIS 210 N -5.13 0.00 -3.24 2.06 8.25 -1.19 -4.63 115.22 111.34 2qs0 n HIS 210 Ca 0.31 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.36 2qs0 n HIS 210 Cb 1.00 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 32.03 2qs0 n HIS 210 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2qs0 s ALA 211 N -2.00 3.46 0.20 -1.41 0.00 0.18 -4.92 121.76 117.27 2qs0 s ALA 211 Ca 0.06 -1.11 0.35 0.00 0.00 0.00 0.00 51.96 51.27 2qs0 s ALA 211 Cb 0.03 -3.04 1.70 0.00 0.00 0.00 0.00 23.12 21.80 2qs0 s ALA 211 CO 0.05 -1.32 2.06 0.38 0.00 0.00 0.00 175.76 176.92 2qs0 h ASP 212 N 8.54 0.00 -2.75 0.00 3.04 -1.82 -3.40 116.42 120.03 2qs0 h ASP 212 Ca -0.27 0.00 -0.28 0.00 -3.24 0.00 0.00 57.03 53.24 2qs0 h ASP 212 Cb 1.12 0.00 -0.35 0.00 -1.04 0.00 0.00 39.33 39.06 2qs0 h ASP 212 CO 0.78 0.00 -0.59 -0.63 -2.04 0.00 0.00 179.24 176.76 2qs0 s ILE 213 N -3.79 -0.35 -0.56 4.15 1.01 -1.25 -5.06 121.20 115.36 2qs0 s ILE 213 Ca -0.01 0.12 -0.08 0.00 0.00 0.00 0.00 60.65 60.68 2qs0 s ILE 213 Cb 0.10 -0.52 0.15 0.00 0.01 0.00 0.00 42.46 42.20 2qs0 s ILE 213 CO 0.43 -0.02 0.43 -0.63 0.00 0.00 0.00 174.94 175.15 2qs0 s ILE 214 N 2.35 4.24 -0.00 2.92 1.01 -1.26 -1.28 121.20 129.18 2qs0 s ILE 214 Ca 0.04 -2.22 -0.01 0.00 0.00 0.00 0.00 60.65 58.46 2qs0 s ILE 214 Cb -0.14 -3.76 -0.00 0.00 0.01 0.00 0.00 42.46 38.57 2qs0 s ILE 214 CO -0.10 -0.84 0.02 0.54 0.00 0.00 0.00 174.94 174.57 2qs0 s VAL 215 N 0.78 0.03 1.09 2.92 0.11 -0.32 -4.87 120.40 120.14 2qs0 s VAL 215 Ca 0.11 -0.26 -0.18 0.00 -2.93 0.00 0.00 61.98 58.72 2qs0 s VAL 215 Cb -0.22 -0.12 0.25 0.00 -1.53 0.00 0.00 36.38 34.76 2qs0 s VAL 215 CO -0.03 -0.14 1.21 -0.55 -3.33 0.00 0.00 175.10 172.26 2qs0 s SER 216 N -0.41 1.93 0.22 3.54 0.15 -1.26 -4.00 113.70 113.87 2qs0 s SER 216 Ca -0.05 0.45 -0.09 0.00 0.70 0.00 0.00 55.95 56.96 2qs0 s SER 216 Cb -0.03 -0.59 0.35 0.00 -1.71 0.00 0.00 66.02 64.04 2qs0 s SER 216 CO -0.00 -3.48 1.67 0.71 1.20 0.00 0.00 173.24 173.33 2qs0 h THR 217 N -2.15 0.50 0.38 6.45 1.35 -1.96 0.34 112.91 117.83 2qs0 h THR 217 Ca -0.44 -0.06 -0.01 0.00 -0.55 0.00 0.00 66.41 65.35 2qs0 h THR 217 Cb 1.26 0.32 -0.02 0.00 -1.73 0.00 0.00 68.15 67.98 2qs0 h THR 217 CO 0.35 0.03 -0.42 1.23 -0.25 0.00 0.00 175.52 176.47 2qs0 h GLY 218 N 0.17 -1.17 2.00 5.82 0.00 -2.00 -1.84 103.07 106.05 2qs0 h GLY 218 Ca 0.35 0.55 -0.05 0.00 0.00 0.00 0.00 47.33 48.18 2qs0 h GLY 218 CO -0.52 -0.35 -0.23 -1.33 0.00 0.00 0.00 176.54 174.11 2qs0 h GLY 219 N -0.81 0.00 2.00 4.60 0.00 -1.87 -1.37 103.07 105.62 2qs0 h GLY 219 Ca -0.05 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.28 2qs0 h GLY 219 CO -0.07 0.00 -0.00 1.98 0.00 0.00 0.00 176.54 178.45 2qs0 h MET 220 N 0.00 0.00 0.00 4.80 4.05 0.19 -1.30 114.93 122.67 2qs0 h MET 220 Ca -0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 2qs0 h MET 220 Cb 0.46 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.26 2qs0 h MET 220 CO 0.03 0.00 -1.67 -0.89 0.23 0.00 0.00 176.91 174.61 2qs0 n ILE 221 N -3.10 0.10 0.40 1.77 -0.00 -0.53 -4.33 119.36 113.67 2qs0 n ILE 221 Ca -0.02 -0.43 0.11 0.00 -0.00 0.00 0.00 62.75 62.41 2qs0 n ILE 221 Cb 0.11 0.07 -0.02 0.00 -0.00 0.00 0.00 39.64 39.80 2qs0 n ILE 221 CO 0.00 0.00 0.00 -2.11 -0.00 0.00 0.00 176.55 174.44 2qs0 n ARG 222 N -2.22 0.40 -1.19 0.38 1.85 -0.58 -4.18 116.66 111.13 2qs0 n ARG 222 Ca -0.02 -0.02 -0.20 0.00 -1.00 0.00 0.00 57.85 56.61 2qs0 n ARG 222 Cb 0.53 -1.62 0.15 0.00 -1.05 0.00 0.00 32.46 30.47 2qs0 n ARG 222 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 2qs0 n ARG 223 N -2.13 2.33 0.00 2.89 1.74 -0.71 -4.62 116.66 116.17 2qs0 n ARG 223 Ca 0.01 -3.23 0.10 0.00 -0.77 0.00 0.00 57.85 53.95 2qs0 n ARG 223 Cb 0.48 -2.10 0.51 0.00 -1.02 0.00 0.00 32.46 30.32 2qs0 n ARG 223 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2qs0 n ALA 224 N -1.06 2.06 0.38 7.54 0.00 -1.26 -2.69 120.51 125.49 2qs0 n ALA 224 Ca 0.51 -0.10 0.10 0.00 0.00 0.00 0.00 53.44 53.96 2qs0 n ALA 224 Cb 1.20 -1.32 -0.15 0.00 0.00 0.00 0.00 19.45 19.18 2qs0 n ALA 224 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qs0 n GLU 226 N -1.94 0.00 0.00 0.00 4.07 -1.09 -5.23 120.64 116.44 2qs0 n GLU 226 Ca -0.01 0.04 0.00 0.00 -0.06 0.00 0.00 57.16 57.14 2qs0 n GLU 226 Cb 0.46 -1.54 0.00 0.00 -0.06 0.00 0.00 31.44 30.30 2qs0 n GLU 226 CO 0.00 0.00 0.00 0.91 -0.06 0.00 0.00 177.13 177.98 2qs0 n TRP 227 N -0.85 0.00 -3.07 4.31 8.01 -1.26 -5.00 117.44 119.59 2qs0 n TRP 227 Ca 0.00 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.19 2qs0 n TRP 227 Cb 0.04 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.34 2qs0 n TRP 227 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 177.69 177.59 2qs0 n TRP 230 N 0.00 -0.03 -3.62 -5.99 7.02 -1.26 -5.03 117.44 108.54 2qs0 n TRP 230 Ca 0.00 0.00 -0.29 0.00 -1.02 0.00 0.00 57.50 56.19 2qs0 n TRP 230 Cb 0.00 0.00 -0.12 0.00 -2.42 0.00 0.00 31.31 28.77 2qs0 n TRP 230 CO 0.00 0.00 0.00 0.08 -2.02 0.00 0.00 177.69 175.75 2qs0 s VAL 231 N -2.14 1.11 -0.38 -0.99 1.01 -1.21 -0.18 120.40 117.62 2qs0 s VAL 231 Ca 0.00 -2.63 -0.29 0.00 0.00 0.00 0.00 61.98 59.07 2qs0 s VAL 231 Cb 0.00 -1.77 0.01 0.00 0.00 0.00 0.00 36.38 34.62 2qs0 s VAL 231 CO 0.00 -1.00 1.34 0.54 0.00 0.00 0.00 175.10 175.97 2qs0 s VAL 232 N 0.20 4.03 -1.45 2.92 0.11 -1.13 -1.48 120.40 123.61 2qs0 s VAL 232 Ca 0.22 1.10 -0.09 0.00 -2.93 0.00 0.00 61.98 60.28 2qs0 s VAL 232 Cb -0.15 -4.23 0.04 0.00 -1.53 0.00 0.00 36.38 30.50 2qs0 s VAL 232 CO -0.06 -0.67 2.47 0.49 -3.33 0.00 0.00 175.10 173.99 2qs0 n PHE 233 N 8.23 2.78 -3.53 1.54 3.01 0.29 -2.96 117.46 126.81 2qs0 n PHE 233 Ca 0.15 -2.94 -0.02 0.00 1.01 0.00 0.00 57.45 55.65 2qs0 n PHE 233 Cb 0.48 -2.22 -0.00 0.00 -0.01 0.00 0.00 39.48 37.72 2qs0 n PHE 233 CO 0.00 0.00 0.00 -2.37 1.01 0.00 0.00 176.76 175.40 2qs0 n THR 234 N 3.30 0.00 -1.65 4.37 5.66 -1.26 -3.77 114.28 120.94 2qs0 n THR 234 Ca 0.62 -0.26 -0.48 0.00 -3.05 0.00 0.00 64.05 60.87 2qs0 n THR 234 Cb 0.29 0.18 -0.05 0.00 -1.55 0.00 0.00 70.33 69.20 2qs0 n THR 234 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 2qs0 n GLU 235 N -0.09 1.83 -0.35 1.09 1.02 -1.26 -4.83 120.64 118.05 2qs0 n GLU 235 Ca -0.00 0.66 0.14 0.00 -0.02 0.00 0.00 57.16 57.94 2qs0 n GLU 235 Cb 0.10 -2.40 0.29 0.00 -0.02 0.00 0.00 31.44 29.41 2qs0 n GLU 235 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2qs0 n ARG 236 N 3.45 -0.08 -0.44 3.49 5.12 -1.26 0.51 116.66 127.45 2qs0 n ARG 236 Ca 0.18 1.49 0.37 0.00 -1.93 0.00 0.00 57.85 57.96 2qs0 n ARG 236 Cb 0.26 -2.37 0.65 0.00 -1.16 0.00 0.00 32.46 29.83 2qs0 n ARG 236 CO 0.00 0.00 0.00 0.93 -1.93 0.00 0.00 177.63 176.63 2qs0 h GLU 237 N 0.00 0.07 0.00 5.56 3.07 -2.00 0.68 114.58 121.95 2qs0 h GLU 237 Ca 0.60 -0.00 -0.07 0.00 -0.50 0.00 0.00 59.36 59.39 2qs0 h GLU 237 Cb 1.22 -0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 29.11 2qs0 h GLU 237 CO -0.94 0.04 -0.32 1.98 -1.40 0.00 0.00 179.01 178.37 2qs0 h MET 238 N 0.07 0.00 -0.05 2.33 4.05 -0.28 -2.47 114.93 118.58 2qs0 h MET 238 Ca 0.83 0.00 -0.21 0.00 -0.28 0.00 0.00 59.70 60.05 2qs0 h MET 238 Cb 2.59 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 33.39 2qs0 h MET 238 CO -0.46 0.32 -0.83 0.28 0.23 0.00 0.00 176.91 176.45 2qs0 h VAL 239 N 0.00 1.37 -0.42 -5.77 2.07 0.26 0.71 116.25 114.47 2qs0 h VAL 239 Ca -0.00 -2.25 -0.00 0.00 0.82 0.00 0.00 66.70 65.27 2qs0 h VAL 239 Cb 0.57 2.23 -0.02 0.00 -1.52 0.00 0.00 31.29 32.55 2qs0 h VAL 239 CO 0.04 0.68 0.25 0.22 0.02 0.00 0.00 177.57 178.78 2qs0 h TYR 240 N 0.30 0.54 0.00 1.57 5.03 -1.23 -2.47 116.97 120.71 2qs0 h TYR 240 Ca -0.06 0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.26 2qs0 h TYR 240 Cb 1.44 -0.18 0.00 0.00 1.55 0.00 0.00 36.73 39.54 2qs0 h TYR 240 CO 0.06 0.36 -0.36 0.00 -1.32 0.00 0.00 178.16 176.90 2qs0 h ARG 241 N 0.57 0.00 -1.04 1.82 3.08 -1.36 -3.37 114.38 114.08 2qs0 h ARG 241 Ca 0.15 0.00 0.39 0.00 0.07 0.00 0.00 59.98 60.59 2qs0 h ARG 241 Cb -0.02 0.00 -0.13 0.00 0.08 0.00 0.00 29.97 29.89 2qs0 h ARG 241 CO -0.03 0.00 0.63 -0.11 -1.07 0.00 0.00 179.97 179.39 2qs0 n LEU 242 N -4.33 0.23 -0.22 3.04 7.94 0.23 0.24 117.00 124.13 2qs0 n LEU 242 Ca -0.05 1.27 -0.06 0.00 -1.11 0.00 0.00 56.01 56.06 2qs0 n LEU 242 Cb 0.19 -0.62 0.04 0.00 0.53 0.00 0.00 43.42 43.55 2qs0 n LEU 242 CO 0.08 -1.40 1.11 0.77 -1.11 0.00 0.00 177.39 176.83 2qs0 h SER 243 N 0.00 0.73 0.01 1.96 4.64 -1.61 -2.22 113.55 117.06 2qs0 h SER 243 Ca 0.74 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 62.01 2qs0 h SER 243 Cb 2.21 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 64.12 2qs0 h SER 243 CO -0.50 0.57 0.00 0.29 -0.87 0.00 0.00 176.83 176.32 2qs0 n LYS 244 N -4.62 0.13 -0.03 4.77 5.02 0.66 -1.45 118.16 122.64 2qs0 n LYS 244 Ca 0.04 0.04 0.11 0.00 -2.02 0.00 0.00 58.31 56.48 2qs0 n LYS 244 Cb 0.04 -1.50 0.11 0.00 -0.02 0.00 0.00 35.03 33.66 2qs0 n LYS 244 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2qs0 n LEU 245 N -1.05 2.88 0.00 -0.35 4.77 -0.84 -5.02 117.00 117.40 2qs0 n LEU 245 Ca 0.03 -1.09 -0.12 0.00 -0.03 0.00 0.00 56.01 54.80 2qs0 n LEU 245 Cb 0.02 -0.04 -0.04 0.00 -2.33 0.00 0.00 43.42 41.02 2qs0 n LEU 245 CO 0.03 0.52 -0.01 -1.22 -1.33 0.00 0.00 177.39 175.37 2qs0 n TYR 246 N 1.23 -0.73 0.00 -1.77 0.53 -0.53 -5.01 117.16 110.88 2qs0 n TYR 246 Ca 0.13 -1.85 0.00 0.00 -1.02 0.00 0.00 57.90 55.16 2qs0 n TYR 246 Cb 0.54 0.26 0.00 0.00 -1.03 0.00 0.00 39.34 39.11 2qs0 n TYR 246 CO 0.00 0.00 0.00 -2.30 -1.02 0.00 0.00 176.86 173.54 2qs0 n PRO 247 N -0.43 0.00 0.00 -0.72 -0.02 -1.26 -4.96 135.00 127.62 2qs0 n PRO 247 Ca 0.04 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.52 2qs0 n PRO 247 Cb 0.42 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.90 2qs0 n PRO 247 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2qs0 n PHE 251 N -2.36 0.00 -5.10 6.00 3.72 -1.26 -4.97 117.46 113.50 2qs0 n PHE 251 Ca 0.00 0.00 -0.32 0.00 -0.05 0.00 0.00 57.45 57.08 2qs0 n PHE 251 Cb 0.00 0.00 -0.15 0.00 -0.94 0.00 0.00 39.48 38.39 2qs0 n PHE 251 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 176.76 177.42 2qs0 s TYR 252 N 0.00 2.51 0.44 1.38 2.02 0.75 -4.82 117.35 119.63 2qs0 s TYR 252 Ca 0.00 -0.30 -0.25 0.00 -0.37 0.00 0.00 57.07 56.15 2qs0 s TYR 252 Cb 0.00 -1.56 -0.08 0.00 -0.40 0.00 0.00 41.96 39.92 2qs0 s TYR 252 CO 0.00 0.08 1.38 -2.14 -1.57 0.00 0.00 175.55 173.30 2qs0 s PRO 253 N -0.68 3.74 0.24 -1.71 0.02 -1.26 -2.83 135.00 132.52 2qs0 s PRO 253 Ca 0.11 2.32 -0.07 0.00 0.02 0.00 0.00 61.00 63.38 2qs0 s PRO 253 Cb -0.10 -2.66 0.26 0.00 0.02 0.00 0.00 34.50 32.02 2qs0 s PRO 253 CO -0.00 -0.74 1.90 0.00 -0.33 0.00 0.00 177.00 177.83 2qs0 h ALA 254 N 2.38 1.19 -2.81 -1.55 0.00 -1.82 -3.43 119.26 113.21 2qs0 h ALA 254 Ca -0.50 -0.05 -0.59 0.00 0.00 0.00 0.00 54.91 53.77 2qs0 h ALA 254 Cb 1.26 -0.34 -0.08 0.00 0.00 0.00 0.00 17.79 18.64 2qs0 h ALA 254 CO 0.61 0.49 -0.59 0.15 0.00 0.00 0.00 179.25 179.92 2qs0 s LYS 255 N -6.10 2.82 0.53 0.00 1.02 -1.26 -4.88 119.74 111.87 2qs0 s LYS 255 Ca -0.13 -0.88 -0.06 0.00 0.02 0.00 0.00 55.97 54.92 2qs0 s LYS 255 Cb 0.17 -2.61 -0.02 0.00 -0.52 0.00 0.00 37.83 34.85 2qs0 s LYS 255 CO 0.80 0.49 0.85 -1.21 -0.92 0.00 0.00 175.35 175.37 2qs0 s GLU 256 N -2.97 3.32 0.05 1.68 2.02 -1.26 -5.02 118.70 116.52 2qs0 s GLU 256 Ca 0.30 0.17 -0.21 0.00 0.02 0.00 0.00 54.97 55.26 2qs0 s GLU 256 Cb -0.10 -2.31 -0.10 0.00 0.10 0.00 0.00 34.13 31.72 2qs0 s GLU 256 CO 0.22 -0.42 1.32 -0.44 0.02 0.00 0.00 175.26 175.96 2qs0 h ASP 257 N 0.03 -0.84 -3.74 -0.19 3.45 -1.99 -3.43 116.42 109.70 2qs0 h ASP 257 Ca -0.46 0.07 -0.56 0.00 0.43 0.00 0.00 57.03 56.51 2qs0 h ASP 257 Cb 1.22 0.29 0.17 0.00 -0.56 0.00 0.00 39.33 40.45 2qs0 h ASP 257 CO 0.61 -0.37 0.16 0.00 -1.57 0.00 0.00 179.24 178.07 2qs0 n ALA 258 N -2.62 0.09 -2.65 3.45 0.00 -1.26 -5.00 120.51 112.51 2qs0 n ALA 258 Ca -0.06 -0.09 -0.31 0.00 0.00 0.00 0.00 53.44 52.98 2qs0 n ALA 258 Cb 0.26 -2.14 -0.04 0.00 0.00 0.00 0.00 19.45 17.53 2qs0 n ALA 258 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2qs0 s VAL 259 N -1.64 5.14 -1.45 0.00 -7.23 -1.26 -4.58 120.40 109.38 2qs0 s VAL 259 Ca 0.76 0.03 -0.06 0.00 -1.81 0.00 0.00 61.98 60.90 2qs0 s VAL 259 Cb -0.38 -3.64 0.01 0.00 0.56 0.00 0.00 36.38 32.93 2qs0 s VAL 259 CO 0.47 -0.02 0.23 0.00 -0.31 0.00 0.00 175.10 175.48 2qs0 s VAL 261 N -4.12 3.29 0.00 0.00 1.01 -1.26 -3.13 120.40 116.19 2qs0 s VAL 261 Ca 0.09 0.46 0.00 0.00 0.00 0.00 0.00 61.98 62.53 2qs0 s VAL 261 Cb -0.04 -2.95 0.00 0.00 0.00 0.00 0.00 36.38 33.39 2qs0 s VAL 261 CO 0.96 -0.51 0.00 0.61 0.00 0.00 0.00 175.10 176.16 2qs0 n GLY 262 N -1.03 2.70 3.63 4.51 0.00 -1.26 -4.98 105.19 108.75 2qs0 n GLY 262 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 2qs0 n GLY 262 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2qs0 n MET 263 N -0.26 1.56 -4.60 1.61 0.00 -1.18 -4.99 117.12 109.26 2qs0 n MET 263 Ca 0.00 0.55 -0.23 0.00 0.00 0.00 0.00 57.70 58.03 2qs0 n MET 263 Cb 0.00 -2.08 -0.16 0.00 0.00 0.00 0.00 33.22 30.98 2qs0 n MET 263 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 175.97 176.12 2qs0 s LYS 264 N -1.89 1.28 0.39 2.12 1.02 -1.26 -5.12 119.74 116.29 2qs0 s LYS 264 Ca 0.60 -0.45 -0.27 0.00 0.02 0.00 0.00 55.97 55.87 2qs0 s LYS 264 Cb -0.59 -1.17 -0.10 0.00 -0.52 0.00 0.00 37.83 35.45 2qs0 s LYS 264 CO 0.59 0.20 1.48 0.00 -0.92 0.00 0.00 175.35 176.69 2qs0 s ALA 265 N 0.04 3.51 0.37 5.17 0.00 -1.26 -4.94 121.76 124.65 2qs0 s ALA 265 Ca -0.02 1.56 -0.26 0.00 0.00 0.00 0.00 51.96 53.24 2qs0 s ALA 265 Cb -0.09 -3.61 -0.09 0.00 0.00 0.00 0.00 23.12 19.34 2qs0 s ALA 265 CO 0.01 -1.09 1.15 0.42 0.00 0.00 0.00 175.76 176.25 2qs0 s ILE 266 N -1.14 3.25 0.18 0.00 1.01 -1.26 -5.03 121.20 118.22 2qs0 s ILE 266 Ca 0.54 1.09 -0.01 0.00 0.00 0.00 0.00 60.65 62.27 2qs0 s ILE 266 Cb -0.46 -3.63 -0.04 0.00 0.01 0.00 0.00 42.46 38.34 2qs0 s ILE 266 CO 0.62 0.14 0.12 0.42 0.00 0.00 0.00 174.94 176.24 2qs0 s THR 267 N -1.37 0.03 0.18 2.92 -4.23 -1.26 -4.72 115.64 107.18 2qs0 s THR 267 Ca 0.54 -1.94 -0.27 0.00 -1.18 0.00 0.00 61.69 58.84 2qs0 s THR 267 Cb -0.31 -2.34 0.03 0.00 1.34 0.00 0.00 72.50 71.22 2qs0 s THR 267 CO 0.39 -0.15 1.55 -0.07 -0.54 0.00 0.00 174.62 175.80 2qs0 h LEU 268 N 2.68 -1.81 -0.90 4.79 3.38 -1.96 0.33 115.31 121.82 2qs0 h LEU 268 Ca -0.35 0.30 0.21 0.00 0.09 0.00 0.00 57.88 58.13 2qs0 h LEU 268 Cb 1.23 0.83 -0.12 0.00 0.09 0.00 0.00 40.66 42.70 2qs0 h LEU 268 CO 0.54 -0.28 0.42 -0.61 0.09 0.00 0.00 178.44 178.60 2qs0 h GLN 269 N -0.08 0.43 0.44 1.13 4.15 -1.97 0.97 115.11 120.18 2qs0 h GLN 269 Ca 0.21 -0.03 -0.02 0.00 0.77 0.00 0.00 58.65 59.58 2qs0 h GLN 269 Cb 0.51 -0.10 0.00 0.00 0.21 0.00 0.00 27.48 28.10 2qs0 h GLN 269 CO -0.87 0.29 -0.24 0.45 -1.93 0.00 0.00 178.83 176.53 2qs0 h HIS 270 N 0.45 -0.62 -0.64 3.99 3.86 -0.73 1.00 115.15 122.46 2qs0 h HIS 270 Ca 0.56 -0.01 0.05 0.00 -1.16 0.00 0.00 60.37 59.80 2qs0 h HIS 270 Cb 1.03 0.21 -0.05 0.00 1.06 0.00 0.00 27.41 29.66 2qs0 h HIS 270 CO -0.12 -0.37 0.36 0.28 0.86 0.00 0.00 177.93 178.94 2qs0 h VAL 271 N -0.63 1.00 0.67 2.45 2.07 0.09 0.55 116.25 122.45 2qs0 h VAL 271 Ca -0.06 -0.23 -0.03 0.00 0.82 0.00 0.00 66.70 67.20 2qs0 h VAL 271 Cb 0.50 0.25 0.00 0.00 -1.52 0.00 0.00 31.29 30.52 2qs0 h VAL 271 CO 0.08 0.12 -0.36 0.22 0.02 0.00 0.00 177.57 177.66 2qs0 h TYR 272 N 0.68 -0.94 0.00 1.57 3.20 0.14 -2.46 116.97 119.17 2qs0 h TYR 272 Ca 0.28 -0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.11 2qs0 h TYR 272 Cb 0.13 0.32 -0.00 0.00 1.54 0.00 0.00 36.73 38.72 2qs0 h TYR 272 CO -0.07 -0.56 -0.12 0.93 -1.64 0.00 0.00 178.16 176.70 2qs0 h GLU 273 N -0.95 0.00 -0.32 1.82 5.08 0.14 -1.74 114.58 118.61 2qs0 h GLU 273 Ca -0.09 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.14 2qs0 h GLU 273 Cb 0.75 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.99 2qs0 h GLU 273 CO 0.12 0.12 -0.34 1.03 -1.00 0.00 0.00 179.01 178.94 2qs0 h SER 274 N 0.00 0.74 -0.08 1.42 0.87 0.31 -0.30 113.55 116.51 2qs0 h SER 274 Ca -0.00 -0.31 -0.09 0.00 -1.23 0.00 0.00 61.79 60.16 2qs0 h SER 274 Cb 0.22 -0.21 0.00 0.00 -0.44 0.00 0.00 62.40 61.97 2qs0 h SER 274 CO 0.02 1.02 -0.28 -0.07 -0.53 0.00 0.00 176.83 176.98 2qs0 h LEU 275 N 0.59 0.39 -0.05 2.23 3.38 -0.99 0.31 115.31 121.18 2qs0 h LEU 275 Ca 0.06 -0.62 -0.00 0.00 0.09 0.00 0.00 57.88 57.41 2qs0 h LEU 275 Cb 0.86 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.50 2qs0 h LEU 275 CO 0.08 0.94 0.03 -0.09 0.09 0.00 0.00 178.44 179.48 2qs0 h ARG 276 N -0.13 0.07 -0.03 1.13 2.43 -1.32 -3.13 114.38 113.40 2qs0 h ARG 276 Ca -0.01 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 2qs0 h ARG 276 Cb 0.91 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.45 2qs0 h ARG 276 CO 0.06 0.14 0.00 -0.25 -1.51 0.00 0.00 179.97 178.41 2qs0 n ASP 277 N -5.00 2.31 -3.71 -3.80 8.00 -0.13 -4.93 116.55 109.29 2qs0 n ASP 277 Ca -0.06 -1.77 -0.22 0.00 0.71 0.00 0.00 54.79 53.45 2qs0 n ASP 277 Cb 0.07 -0.01 0.03 0.00 -0.02 0.00 0.00 41.12 41.20 2qs0 n ASP 277 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 2qs0 n MET 278 N 0.81 -4.99 -2.88 -1.24 2.81 0.94 -4.90 117.12 107.66 2qs0 n MET 278 Ca 0.16 0.62 -0.40 0.00 -1.81 0.00 0.00 57.70 56.28 2qs0 n MET 278 Cb 0.49 -5.21 -0.06 0.00 -0.71 0.00 0.00 33.22 27.73 2qs0 n MET 278 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 2qs0 s LYS 279 N -6.01 4.69 -0.57 0.03 1.02 -0.26 -4.56 119.74 114.08 2qs0 s LYS 279 Ca 0.04 1.30 -0.11 0.00 0.02 0.00 0.00 55.97 57.22 2qs0 s LYS 279 Cb -0.02 -3.27 0.01 0.00 -0.52 0.00 0.00 37.83 34.03 2qs0 s LYS 279 CO 0.81 0.54 0.64 0.66 -0.92 0.00 0.00 175.35 177.09 2qs0 n TYR 280 N 1.58 -3.16 -2.83 3.18 0.53 -1.26 -4.13 117.16 111.06 2qs0 n TYR 280 Ca -0.04 1.26 -0.40 0.00 -1.02 0.00 0.00 57.90 57.69 2qs0 n TYR 280 Cb 0.48 -3.83 -0.05 0.00 -1.03 0.00 0.00 39.34 34.91 2qs0 n TYR 280 CO 0.00 0.00 0.00 -2.00 -1.02 0.00 0.00 176.86 173.84 2qs0 s GLU 281 N -2.88 4.66 -0.26 -0.72 2.12 -1.26 -0.52 118.70 119.84 2qs0 s GLU 281 Ca 0.16 1.32 -0.18 0.00 0.36 0.00 0.00 54.97 56.63 2qs0 s GLU 281 Cb -0.04 -3.34 -0.03 0.00 0.26 0.00 0.00 34.13 30.98 2qs0 s GLU 281 CO 0.78 0.33 0.51 0.08 -0.54 0.00 0.00 175.26 176.42 2qs0 s VAL 282 N -0.37 5.07 0.07 3.70 1.01 0.22 -4.91 120.40 125.19 2qs0 s VAL 282 Ca 0.42 0.88 0.08 0.00 0.00 0.00 0.00 61.98 63.36 2qs0 s VAL 282 Cb -0.23 -3.83 -0.03 0.00 0.00 0.00 0.00 36.38 32.29 2qs0 s VAL 282 CO 0.28 0.09 -0.22 0.42 0.00 0.00 0.00 175.10 175.67 2qs0 s THR 283 N 2.26 1.78 -0.08 3.92 -4.23 -1.26 -4.62 115.64 113.41 2qs0 s THR 283 Ca 0.21 -1.39 -0.03 0.00 -1.18 0.00 0.00 61.69 59.30 2qs0 s THR 283 Cb -0.16 -1.57 0.04 0.00 1.34 0.00 0.00 72.50 72.16 2qs0 s THR 283 CO 0.09 0.12 0.16 -0.69 -0.54 0.00 0.00 174.62 173.76 2qs0 s VAL 284 N -0.95 -0.14 -0.48 2.29 1.01 -1.26 -5.09 120.40 115.78 2qs0 s VAL 284 Ca 0.08 0.24 -0.42 0.00 0.00 0.00 0.00 61.98 61.88 2qs0 s VAL 284 Cb -0.09 -0.28 -0.18 0.00 0.00 0.00 0.00 36.38 35.83 2qs0 s VAL 284 CO 0.03 0.10 2.04 -2.65 0.00 0.00 0.00 175.10 174.63 2qs0 n PRO 285 N 4.63 0.00 -0.35 2.72 -0.02 -1.26 -4.61 135.00 136.12 2qs0 n PRO 285 Ca -0.18 0.00 0.10 0.00 -2.02 0.00 0.00 63.50 61.39 2qs0 n PRO 285 Cb 0.51 -1.43 0.20 0.00 -0.02 0.00 0.00 33.50 32.76 2qs0 n PRO 285 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2qs0 n GLU 286 N 7.16 -0.08 0.03 -0.52 2.13 -1.26 0.08 120.64 128.18 2qs0 n GLU 286 Ca 0.53 1.51 -0.06 0.00 0.66 0.00 0.00 57.16 59.79 2qs0 n GLU 286 Cb -0.04 -2.31 -0.04 0.00 0.27 0.00 0.00 31.44 29.33 2qs0 n GLU 286 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 2qs0 h GLU 287 N 0.00 -0.25 -0.68 5.31 5.08 -2.01 -1.47 114.58 120.56 2qs0 h GLU 287 Ca 0.52 0.02 0.12 0.00 -1.00 0.00 0.00 59.36 59.02 2qs0 h GLU 287 Cb 0.93 0.06 -0.04 0.00 0.50 0.00 0.00 28.75 30.19 2qs0 h GLU 287 CO -0.98 -0.17 0.46 0.82 -1.00 0.00 0.00 179.01 178.14 2qs0 h ILE 288 N -0.26 0.84 0.21 3.13 2.04 -1.56 -2.96 117.51 118.95 2qs0 h ILE 288 Ca -0.00 -0.14 -0.01 0.00 1.00 0.00 0.00 64.86 65.71 2qs0 h ILE 288 Cb 0.27 0.39 0.00 0.00 -0.74 0.00 0.00 36.82 36.75 2qs0 h ILE 288 CO -0.11 0.08 -0.10 0.00 0.00 0.00 0.00 178.15 178.02 2qs0 h ALA 289 N 1.67 -0.28 0.00 1.87 0.00 0.36 -1.09 119.26 121.79 2qs0 h ALA 289 Ca 0.32 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.10 2qs0 h ALA 289 Cb 0.70 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 2qs0 h ALA 289 CO -0.10 -0.60 -0.16 0.93 0.00 0.00 0.00 179.25 179.32 2qs0 h GLU 290 N -0.39 0.00 0.11 0.00 4.39 -1.13 -1.52 114.58 116.04 2qs0 h GLU 290 Ca -0.03 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.67 2qs0 h GLU 290 Cb 0.30 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.95 2qs0 h GLU 290 CO 0.05 0.16 -0.05 0.87 -1.16 0.00 0.00 179.01 178.88 2qs0 h LYS 291 N 0.00 -0.15 -0.42 2.33 1.57 -1.42 -3.27 116.57 115.21 2qs0 h LYS 291 Ca -0.00 0.01 0.11 0.00 -1.87 0.00 0.00 60.65 58.90 2qs0 h LYS 291 Cb 0.44 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.76 2qs0 h LYS 291 CO 0.02 0.34 0.30 0.00 -0.57 0.00 0.00 179.45 179.54 2qs0 h ALA 292 N -0.24 2.33 -0.94 3.86 0.00 -1.01 -2.70 119.26 120.56 2qs0 h ALA 292 Ca -0.02 -0.01 0.13 0.00 0.00 0.00 0.00 54.91 55.01 2qs0 h ALA 292 Cb 0.56 0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.28 2qs0 h ALA 292 CO 0.03 -0.44 0.60 -0.09 0.00 0.00 0.00 179.25 179.34 2qs0 h ARG 293 N 0.06 0.81 -0.06 0.00 2.43 -1.32 -3.00 114.38 113.28 2qs0 h ARG 293 Ca 0.20 -0.05 0.04 0.00 -0.81 0.00 0.00 59.98 59.36 2qs0 h ARG 293 Cb 0.73 -0.18 -0.05 0.00 -0.42 0.00 0.00 29.97 30.04 2qs0 h ARG 293 CO -0.01 0.53 -0.27 0.87 -1.51 0.00 0.00 179.97 179.59 2qs0 h LYS 294 N 0.83 -0.36 -0.92 0.20 1.57 -1.61 -1.73 116.57 114.55 2qs0 h LYS 294 Ca 0.47 0.02 0.12 0.00 -1.87 0.00 0.00 60.65 59.40 2qs0 h LYS 294 Cb 0.61 0.08 -0.07 0.00 0.08 0.00 0.00 32.23 32.93 2qs0 h LYS 294 CO -0.24 -0.24 0.59 0.00 -0.57 0.00 0.00 179.45 179.00 2qs0 h ALA 295 N 0.49 1.69 -0.16 3.86 0.00 -1.71 -0.38 119.26 123.04 2qs0 h ALA 295 Ca 0.08 0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.88 2qs0 h ALA 295 Cb 0.49 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2qs0 h ALA 295 CO -0.28 0.09 -0.39 0.82 0.00 0.00 0.00 179.25 179.49 2qs0 h ILE 296 N 0.83 1.35 -0.62 0.00 2.04 -1.52 -1.94 117.51 117.65 2qs0 h ILE 296 Ca 0.45 -1.65 -0.05 0.00 1.00 0.00 0.00 64.86 64.62 2qs0 h ILE 296 Cb 0.56 1.98 -0.03 0.00 -0.74 0.00 0.00 36.82 38.60 2qs0 h ILE 296 CO -0.21 0.50 0.21 -0.33 0.00 0.00 0.00 178.15 178.31 2qs0 h GLU 297 N 0.19 0.94 -0.86 2.37 5.08 -0.70 -1.75 114.58 119.84 2qs0 h GLU 297 Ca -0.00 -0.17 -0.03 0.00 -1.00 0.00 0.00 59.36 58.16 2qs0 h GLU 297 Cb 1.00 -0.15 -0.04 0.00 0.50 0.00 0.00 28.75 30.06 2qs0 h GLU 297 CO 0.08 0.80 0.44 -0.09 -1.00 0.00 0.00 179.01 179.24 2qs0 h ARG 298 N 0.91 1.23 -0.49 2.33 2.43 -1.02 -0.47 114.38 119.30 2qs0 h ARG 298 Ca 0.21 -0.17 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 2qs0 h ARG 298 Cb 0.24 -0.23 -0.02 0.00 -0.42 0.00 0.00 29.97 29.54 2qs0 h ARG 298 CO -0.01 0.92 0.31 1.98 -1.51 0.00 0.00 179.97 181.67 2qs0 h MET 299 N 1.22 0.65 -0.09 0.20 4.05 -0.59 0.30 114.93 120.67 2qs0 h MET 299 Ca 0.30 -0.04 -0.14 0.00 -0.28 0.00 0.00 59.70 59.53 2qs0 h MET 299 Cb 0.08 -0.14 -0.01 0.00 -0.80 0.00 0.00 31.60 30.73 2qs0 h MET 299 CO -0.04 0.44 -0.58 -0.07 0.23 0.00 0.00 176.91 176.89 2qs0 h LEU 300 N 0.66 0.33 0.13 3.39 3.38 -0.55 -0.69 115.31 121.97 2qs0 h LEU 300 Ca 0.18 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2qs0 h LEU 300 Cb -0.06 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.60 2qs0 h LEU 300 CO -0.04 0.83 -0.06 -0.33 0.09 0.00 0.00 178.44 178.93 2qs0 h GLU 301 N 0.22 -0.17 0.00 1.13 3.07 0.45 -3.18 114.58 116.10 2qs0 h GLU 301 Ca -0.00 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 2qs0 h GLU 301 Cb 1.08 0.04 0.00 0.00 -0.84 0.00 0.00 28.75 29.02 2qs0 h GLU 301 CO 0.09 0.21 0.00 0.52 -1.40 0.00 0.00 179.01 178.43 2qs0 h MET 302 N -0.58 0.00 -0.02 2.33 2.86 -1.03 -3.51 114.93 114.98 2qs0 h MET 302 Ca -0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 2qs0 h MET 302 Cb 0.45 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.11 2qs0 h MET 302 CO 0.03 0.00 0.00 0.43 1.06 0.00 0.00 176.91 178.43