#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qki s PRO 2 N 0.00 4.38 -0.17 1.43 0.04 -1.24 -4.71 135.00 134.73 2qki s PRO 2 Ca 0.00 1.68 -0.06 0.00 0.04 0.00 0.00 61.00 62.66 2qki s PRO 2 Cb 0.00 -3.50 -0.04 0.00 0.04 0.00 0.00 34.50 31.00 2qki s PRO 2 CO 0.00 -0.38 0.04 1.41 0.04 0.00 0.00 177.00 178.11 2qki s MET 3 N 1.86 3.88 -0.11 4.56 1.75 0.45 -4.97 119.30 126.72 2qki s MET 3 Ca 0.56 -0.39 -0.02 0.00 -1.25 0.00 0.00 55.69 54.60 2qki s MET 3 Cb -0.26 -3.13 -0.03 0.00 2.84 0.00 0.00 34.83 34.26 2qki s MET 3 CO 0.24 0.28 -0.03 0.71 -0.65 0.00 0.00 175.02 175.58 2qki s TYR 4 N 0.32 3.06 0.03 4.11 2.02 -1.26 0.94 117.35 126.57 2qki s TYR 4 Ca 0.01 -0.00 -0.02 0.00 -0.37 0.00 0.00 57.07 56.69 2qki s TYR 4 Cb -0.13 -1.83 -0.02 0.00 -0.40 0.00 0.00 41.96 39.58 2qki s TYR 4 CO 0.01 0.27 0.02 -1.54 -1.57 0.00 0.00 175.55 172.73 2qki s SER 5 N -0.44 0.26 -0.02 2.29 1.04 0.10 -0.41 113.70 116.53 2qki s SER 5 Ca 0.07 -0.59 0.03 0.00 0.48 0.00 0.00 55.95 55.94 2qki s SER 5 Cb -0.12 0.16 -0.00 0.00 0.10 0.00 0.00 66.02 66.16 2qki s SER 5 CO 0.02 -0.42 -0.10 0.27 0.98 0.00 0.00 173.24 173.99 2qki s ILE 6 N -2.26 0.83 -0.07 -1.02 -4.36 0.14 -1.51 121.20 112.95 2qki s ILE 6 Ca -0.08 -0.41 0.00 0.00 -0.26 0.00 0.00 60.65 59.90 2qki s ILE 6 Cb -0.04 -0.72 0.02 0.00 1.25 0.00 0.00 42.46 42.98 2qki s ILE 6 CO -0.04 0.25 -0.04 -0.63 0.24 0.00 0.00 174.94 174.72 2qki s ILE 7 N 0.03 0.62 0.18 8.37 1.01 -0.60 -1.69 121.20 129.11 2qki s ILE 7 Ca -0.01 -0.10 0.01 0.00 0.00 0.00 0.00 60.65 60.55 2qki s ILE 7 Cb -0.07 -0.67 -0.05 0.00 0.01 0.00 0.00 42.46 41.68 2qki s ILE 7 CO 0.00 0.27 0.04 0.42 0.00 0.00 0.00 174.94 175.67 2qki s THR 8 N 1.38 0.48 0.64 2.92 -4.23 -1.21 -0.58 115.64 115.03 2qki s THR 8 Ca -0.03 -1.97 -0.18 0.00 -1.18 0.00 0.00 61.69 58.33 2qki s THR 8 Cb -0.13 -2.21 -0.03 0.00 1.34 0.00 0.00 72.50 71.47 2qki s THR 8 CO -0.03 -0.36 1.09 -2.65 -0.54 0.00 0.00 174.62 172.13 2qki n PRO 9 N -0.25 0.92 -0.08 3.99 -0.02 -1.26 0.40 135.00 138.71 2qki n PRO 9 Ca -0.05 0.36 0.11 0.00 -2.02 0.00 0.00 63.50 61.91 2qki n PRO 9 Cb 0.64 -2.31 0.37 0.00 -0.02 0.00 0.00 33.50 32.18 2qki n PRO 9 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 2qki n ASN 10 N -1.33 1.83 -3.89 2.55 0.23 0.80 -4.44 115.26 111.01 2qki n ASN 10 Ca 0.15 -1.71 -0.22 0.00 -0.53 0.00 0.00 54.58 52.27 2qki n ASN 10 Cb 0.48 -0.10 -0.17 0.00 -2.08 0.00 0.00 39.78 37.91 2qki n ASN 10 CO 0.00 0.00 0.00 -0.63 -0.93 0.00 0.00 177.26 175.70 2qki s ILE 11 N -1.80 0.61 0.24 1.53 1.01 -1.26 -4.10 121.20 117.44 2qki s ILE 11 Ca 0.33 -0.13 0.06 0.00 0.00 0.00 0.00 60.65 60.92 2qki s ILE 11 Cb 0.18 -0.65 -0.03 0.00 0.01 0.00 0.00 42.46 41.97 2qki s ILE 11 CO 0.28 0.26 0.24 -0.76 0.00 0.00 0.00 174.94 174.95 2qki s LEU 12 N 1.15 3.96 0.24 2.97 1.43 0.14 -4.91 118.68 123.65 2qki s LEU 12 Ca -0.07 -0.15 0.10 0.00 -1.03 0.00 0.00 54.13 52.97 2qki s LEU 12 Cb -0.14 -2.50 -0.05 0.00 0.03 0.00 0.00 46.19 43.54 2qki s LEU 12 CO -0.01 -0.04 -0.17 -0.13 0.23 0.00 0.00 176.35 176.23 2qki s ARG 13 N -3.81 1.50 0.01 1.70 0.52 -1.26 -0.12 118.95 117.48 2qki s ARG 13 Ca 0.33 -1.67 -0.15 0.00 -0.52 0.00 0.00 55.73 53.72 2qki s ARG 13 Cb -0.08 -1.43 -0.06 0.00 0.52 0.00 0.00 34.95 33.90 2qki s ARG 13 CO 0.26 0.26 0.42 -0.51 0.02 0.00 0.00 175.30 175.75 2qki s LEU 14 N -3.40 4.48 -1.57 2.53 1.43 -1.26 -4.24 118.68 116.65 2qki s LEU 14 Ca 0.26 0.99 0.00 0.00 -1.03 0.00 0.00 54.13 54.35 2qki s LEU 14 Cb -0.03 -2.62 0.00 0.00 0.03 0.00 0.00 46.19 43.57 2qki s LEU 14 CO 0.11 0.32 0.00 -0.62 0.23 0.00 0.00 176.35 176.38 2qki n GLU 15 N 1.83 -1.34 -4.32 1.70 1.02 0.51 -4.94 120.64 115.09 2qki n GLU 15 Ca -0.14 0.91 -0.19 0.00 -0.02 0.00 0.00 57.16 57.73 2qki n GLU 15 Cb 0.52 -5.31 -0.14 0.00 -0.02 0.00 0.00 31.44 26.49 2qki n GLU 15 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2qki s SER 16 N -2.37 1.31 -0.30 1.62 1.04 -1.26 -4.97 113.70 108.77 2qki s SER 16 Ca 0.00 -0.35 -0.28 0.00 0.48 0.00 0.00 55.95 55.80 2qki s SER 16 Cb 0.00 -0.09 -0.03 0.00 0.10 0.00 0.00 66.02 66.00 2qki s SER 16 CO 0.00 0.03 1.92 -0.70 0.98 0.00 0.00 173.24 175.48 2qki s GLU 17 N -0.82 3.25 0.37 4.02 2.56 -1.26 -4.44 118.70 122.37 2qki s GLU 17 Ca 0.01 1.58 0.03 0.00 0.00 0.00 0.00 54.97 56.59 2qki s GLU 17 Cb -0.06 -4.25 -0.02 0.00 2.00 0.00 0.00 34.13 31.80 2qki s GLU 17 CO 0.00 -1.96 0.54 -1.21 -0.56 0.00 0.00 175.26 172.08 2qki s GLU 18 N 5.90 3.22 -0.02 4.30 0.41 0.87 -4.91 118.70 128.48 2qki s GLU 18 Ca 0.86 -0.64 0.04 0.00 -0.41 0.00 0.00 54.97 54.81 2qki s GLU 18 Cb -0.25 -2.70 -0.00 0.00 -1.78 0.00 0.00 34.13 29.39 2qki s GLU 18 CO 0.34 0.01 -0.13 0.99 -0.49 0.00 0.00 175.26 175.99 2qki s THR 19 N -2.31 1.03 -0.15 3.63 2.01 -1.26 -0.76 115.64 117.83 2qki s THR 19 Ca 0.44 -0.52 0.01 0.00 0.31 0.00 0.00 61.69 61.92 2qki s THR 19 Cb -0.10 -0.88 0.00 0.00 0.01 0.00 0.00 72.50 71.53 2qki s THR 19 CO 0.34 0.30 -0.17 -0.32 -0.69 0.00 0.00 174.62 174.08 2qki s MET 20 N -0.06 3.17 -0.16 4.92 1.75 0.49 -4.42 119.30 124.98 2qki s MET 20 Ca 0.00 -0.78 -0.13 0.00 -1.25 0.00 0.00 55.69 53.53 2qki s MET 20 Cb -0.08 -2.56 -0.05 0.00 2.84 0.00 0.00 34.83 34.99 2qki s MET 20 CO 0.00 0.03 0.26 0.08 -0.65 0.00 0.00 175.02 174.75 2qki s VAL 21 N 0.75 5.32 -0.10 10.11 1.01 0.25 -1.20 120.40 136.55 2qki s VAL 21 Ca -0.07 0.48 0.01 0.00 0.00 0.00 0.00 61.98 62.40 2qki s VAL 21 Cb -0.16 -3.60 -0.02 0.00 0.00 0.00 0.00 36.38 32.61 2qki s VAL 21 CO 0.01 0.40 -0.13 -0.76 0.00 0.00 0.00 175.10 174.62 2qki s LEU 22 N 0.40 2.73 -0.01 3.92 1.43 0.57 -1.55 118.68 126.17 2qki s LEU 22 Ca 0.15 -0.28 0.02 0.00 -1.03 0.00 0.00 54.13 52.99 2qki s LEU 22 Cb -0.13 -1.59 -0.00 0.00 0.03 0.00 0.00 46.19 44.50 2qki s LEU 22 CO 0.03 0.23 -0.05 -1.61 0.23 0.00 0.00 176.35 175.18 2qki s GLU 23 N -0.03 0.44 -0.49 1.70 2.02 -0.57 0.08 118.70 121.86 2qki s GLU 23 Ca -0.03 -0.17 0.04 0.00 0.02 0.00 0.00 54.97 54.82 2qki s GLU 23 Cb -0.14 -0.43 0.13 0.00 0.10 0.00 0.00 34.13 33.78 2qki s GLU 23 CO 0.04 0.09 0.23 0.00 0.02 0.00 0.00 175.26 175.64 2qki s ALA 24 N -0.02 3.11 0.40 5.21 0.00 -0.45 0.02 121.76 130.03 2qki s ALA 24 Ca 0.01 -3.10 -0.23 0.00 0.00 0.00 0.00 51.96 48.63 2qki s ALA 24 Cb -0.03 -2.10 -0.10 0.00 0.00 0.00 0.00 23.12 20.89 2qki s ALA 24 CO -0.00 -1.98 1.00 -1.01 0.00 0.00 0.00 175.76 173.76 2qki s HIS 25 N -0.07 3.35 -1.16 0.00 3.76 0.27 -3.88 115.29 117.55 2qki s HIS 25 Ca 0.16 1.66 0.00 0.00 -0.15 0.00 0.00 55.06 56.74 2qki s HIS 25 Cb -0.25 -3.01 0.00 0.00 1.11 0.00 0.00 32.58 30.43 2qki s HIS 25 CO -0.01 -0.33 0.00 -0.25 -0.85 0.00 0.00 174.74 173.30 2qki n ASP 26 N -0.16 -3.98 -4.98 1.40 8.00 -1.26 -0.41 116.55 115.17 2qki n ASP 26 Ca 0.05 0.20 -0.21 0.00 0.71 0.00 0.00 54.79 55.55 2qki n ASP 26 Cb 0.51 -3.42 -0.01 0.00 -0.02 0.00 0.00 41.12 38.18 2qki n ASP 26 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2qki s ALA 27 N -2.56 4.03 0.07 2.24 0.00 -1.25 -3.59 121.76 120.69 2qki s ALA 27 Ca 0.00 -1.29 0.09 0.00 0.00 0.00 0.00 51.96 50.76 2qki s ALA 27 Cb 0.00 -1.78 -0.03 0.00 0.00 0.00 0.00 23.12 21.31 2qki s ALA 27 CO 0.00 0.04 -0.22 -0.65 0.00 0.00 0.00 175.76 174.93 2qki s GLN 28 N -4.14 1.83 5.33 0.00 -1.52 -1.26 -5.06 119.66 114.84 2qki s GLN 28 Ca 0.41 -1.11 0.00 0.00 -1.95 0.00 0.00 55.36 52.70 2qki s GLN 28 Cb -0.09 -2.06 0.00 0.00 -0.22 0.00 0.00 33.01 30.64 2qki s GLN 28 CO 0.31 0.51 0.00 0.41 -0.25 0.00 0.00 175.29 176.27 2qki n GLY 29 N 1.44 3.08 3.85 3.09 0.00 -1.26 -4.53 105.19 110.86 2qki n GLY 29 Ca -0.17 -0.15 -0.37 0.00 0.00 0.00 0.00 46.02 45.34 2qki n GLY 29 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2qki s ASP 30 N -4.00 6.68 -0.23 1.61 1.11 -1.26 -3.90 116.67 116.68 2qki s ASP 30 Ca 0.00 0.82 -0.03 0.00 0.18 0.00 0.00 52.55 53.52 2qki s ASP 30 Cb 0.00 -2.19 0.08 0.00 1.07 0.00 0.00 42.92 41.87 2qki s ASP 30 CO 0.00 0.29 0.07 0.54 1.18 0.00 0.00 175.17 177.25 2qki s VAL 31 N -1.18 0.45 0.46 -1.27 0.11 -0.83 -5.04 120.40 113.10 2qki s VAL 31 Ca 0.25 -0.74 -0.22 0.00 -2.93 0.00 0.00 61.98 58.35 2qki s VAL 31 Cb -0.15 -1.12 -0.08 0.00 -1.53 0.00 0.00 36.38 33.49 2qki s VAL 31 CO 0.14 -0.40 1.05 -2.16 -3.33 0.00 0.00 175.10 170.40 2qki s PRO 32 N 1.87 3.90 -0.04 1.54 0.04 -1.26 -1.69 135.00 139.36 2qki s PRO 32 Ca 0.03 1.45 -0.00 0.00 0.04 0.00 0.00 61.00 62.52 2qki s PRO 32 Cb -0.17 -2.26 0.03 0.00 0.04 0.00 0.00 34.50 32.14 2qki s PRO 32 CO -0.16 -0.36 0.00 0.08 0.04 0.00 0.00 177.00 176.60 2qki s VAL 33 N -1.83 0.21 -0.11 -0.36 1.01 -0.62 -2.25 120.40 116.45 2qki s VAL 33 Ca 0.64 0.11 -0.00 0.00 0.00 0.00 0.00 61.98 62.72 2qki s VAL 33 Cb -0.19 -0.33 -0.02 0.00 0.00 0.00 0.00 36.38 35.84 2qki s VAL 33 CO 0.24 0.17 -0.09 -0.89 0.00 0.00 0.00 175.10 174.53 2qki s THR 34 N 1.27 3.50 -0.16 3.92 2.01 -1.01 -1.85 115.64 123.32 2qki s THR 34 Ca -0.06 -0.53 0.01 0.00 0.31 0.00 0.00 61.69 61.42 2qki s THR 34 Cb -0.13 -2.46 0.02 0.00 0.01 0.00 0.00 72.50 69.94 2qki s THR 34 CO -0.02 0.55 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.60 2qki s VAL 35 N -0.18 1.78 0.13 3.82 1.01 -0.37 -0.72 120.40 125.88 2qki s VAL 35 Ca 0.02 -0.77 0.10 0.00 0.00 0.00 0.00 61.98 61.33 2qki s VAL 35 Cb -0.13 -1.64 -0.04 0.00 0.00 0.00 0.00 36.38 34.57 2qki s VAL 35 CO 0.03 0.49 -0.23 0.42 0.00 0.00 0.00 175.10 175.81 2qki s THR 36 N 1.37 2.02 -0.15 3.92 -4.23 -0.05 -4.46 115.64 114.06 2qki s THR 36 Ca 0.04 -1.75 -0.00 0.00 -1.18 0.00 0.00 61.69 58.80 2qki s THR 36 Cb -0.13 -1.84 -0.01 0.00 1.34 0.00 0.00 72.50 71.86 2qki s THR 36 CO -0.11 -0.05 -0.13 -0.69 -0.54 0.00 0.00 174.62 173.10 2qki s VAL 37 N -1.33 2.93 0.35 2.29 1.01 -1.24 -0.39 120.40 124.02 2qki s VAL 37 Ca 0.13 -0.69 0.09 0.00 0.00 0.00 0.00 61.98 61.50 2qki s VAL 37 Cb -0.09 -2.24 -0.06 0.00 0.00 0.00 0.00 36.38 33.99 2qki s VAL 37 CO 0.06 0.51 0.03 -1.00 0.00 0.00 0.00 175.10 174.70 2qki s HIS 38 N 0.65 2.55 0.48 5.22 3.76 0.25 -0.92 115.29 127.28 2qki s HIS 38 Ca -0.07 -0.47 -0.17 0.00 -0.15 0.00 0.00 55.06 54.20 2qki s HIS 38 Cb -0.15 -1.56 -0.08 0.00 1.11 0.00 0.00 32.58 31.89 2qki s HIS 38 CO 0.03 0.44 0.96 -0.51 -0.85 0.00 0.00 174.74 174.81 2qki s ASP 39 N -3.74 6.69 0.73 1.40 1.11 -1.26 0.63 116.67 122.23 2qki s ASP 39 Ca 0.35 1.56 -0.13 0.00 0.18 0.00 0.00 52.55 54.51 2qki s ASP 39 Cb 0.01 -2.50 0.04 0.00 1.07 0.00 0.00 42.92 41.54 2qki s ASP 39 CO 0.20 -0.52 1.13 0.12 1.18 0.00 0.00 175.17 177.28 2qki s PHE 40 N -2.50 2.36 0.00 4.23 5.36 -0.91 -3.34 117.98 123.18 2qki s PHE 40 Ca 0.59 1.59 0.00 0.00 -0.96 0.00 0.00 56.93 58.15 2qki s PHE 40 Cb -0.10 -3.23 0.00 0.00 -0.34 0.00 0.00 43.02 39.35 2qki s PHE 40 CO 0.27 -2.06 0.00 -2.30 -1.46 0.00 0.00 175.22 169.67 2qki n PRO 41 N -2.94 0.00 0.00 10.12 -0.02 -1.26 -4.98 135.00 135.92 2qki n PRO 41 Ca 0.11 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.59 2qki n PRO 41 Cb 0.52 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.00 2qki n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qki n GLY 42 N 0.60 1.61 2.75 -1.23 0.00 -1.21 -4.74 105.19 102.97 2qki n GLY 42 Ca 0.00 -2.15 -0.37 0.00 0.00 0.00 0.00 46.02 43.50 2qki n GLY 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2qki n LYS 43 N -0.18 4.12 -0.31 1.61 5.02 -1.26 -4.24 118.16 122.91 2qki n LYS 43 Ca 0.00 -4.38 0.12 0.00 -2.02 0.00 0.00 58.31 52.03 2qki n LYS 43 Cb 0.00 -2.35 0.29 0.00 -0.02 0.00 0.00 35.03 32.95 2qki n LYS 43 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2qki n LYS 44 N -0.27 2.64 -2.64 1.97 4.76 -1.26 -4.98 118.16 118.38 2qki n LYS 44 Ca 0.45 -2.53 -0.03 0.00 -2.87 0.00 0.00 58.31 53.34 2qki n LYS 44 Cb 0.32 -1.55 -0.02 0.00 -1.84 0.00 0.00 35.03 31.93 2qki n LYS 44 CO 0.00 0.00 0.00 -0.11 -1.37 0.00 0.00 177.40 175.92 2qki n LEU 45 N 1.61 -5.17 0.05 -0.35 7.94 -1.26 -4.74 117.00 115.07 2qki n LEU 45 Ca 0.23 1.89 -0.22 0.00 -1.11 0.00 0.00 56.01 56.81 2qki n LEU 45 Cb 0.62 -2.60 -0.15 0.00 0.53 0.00 0.00 43.42 41.82 2qki n LEU 45 CO 0.17 -3.28 -0.24 0.58 -1.11 0.00 0.00 177.39 173.50 2qki h VAL 46 N 4.43 1.23 -1.78 1.96 2.07 -1.35 -3.47 116.25 119.33 2qki h VAL 46 Ca -0.26 -2.50 -0.08 0.00 0.82 0.00 0.00 66.70 64.68 2qki h VAL 46 Cb 0.59 2.94 -0.27 0.00 -1.52 0.00 0.00 31.29 33.03 2qki h VAL 46 CO 0.00 0.74 -0.40 -0.22 0.02 0.00 0.00 177.57 177.71 2qki s LEU 47 N -7.65 -0.82 0.17 2.57 0.20 -1.23 -4.88 118.68 107.02 2qki s LEU 47 Ca -0.16 0.53 -0.15 0.00 0.69 0.00 0.00 54.13 55.04 2qki s LEU 47 Cb 0.03 1.43 0.05 0.00 -0.43 0.00 0.00 46.19 47.27 2qki s LEU 47 CO 0.82 -0.28 1.83 0.28 -0.29 0.00 0.00 176.35 178.71 2qki h SER 48 N 8.13 0.53 0.00 3.68 0.02 -1.90 -3.30 113.55 120.71 2qki h SER 48 Ca -0.20 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.74 2qki h SER 48 Cb 1.15 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.56 2qki h SER 48 CO 0.24 0.38 0.00 -1.20 -1.14 0.00 0.00 176.83 175.11 2qki n SER 49 N -4.77 0.00 -2.53 3.07 7.64 -1.26 -4.72 113.62 111.06 2qki n SER 49 Ca 0.02 0.00 -0.04 0.00 1.01 0.00 0.00 58.87 59.86 2qki n SER 49 Cb 0.03 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.23 2qki n SER 49 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2qki n GLU 50 N 0.00 -2.16 -3.45 1.43 4.71 -1.26 -4.44 120.64 115.46 2qki n GLU 50 Ca 0.00 1.95 -0.23 0.00 -0.01 0.00 0.00 57.16 58.87 2qki n GLU 50 Cb 0.00 -4.69 -0.12 0.00 -1.01 0.00 0.00 31.44 25.63 2qki n GLU 50 CO 0.00 0.00 0.00 -1.59 0.09 0.00 0.00 177.13 175.63 2qki s LYS 51 N -1.95 0.34 0.21 3.49 -2.85 -1.26 -1.23 119.74 116.48 2qki s LYS 51 Ca 0.13 -0.52 0.02 0.00 -1.00 0.00 0.00 55.97 54.61 2qki s LYS 51 Cb -0.04 -0.93 0.02 0.00 -2.06 0.00 0.00 37.83 34.83 2qki s LYS 51 CO 0.61 -1.07 0.20 0.25 0.10 0.00 0.00 175.35 175.44 2qki n THR 52 N 5.00 0.00 -4.29 3.79 -2.24 -0.77 -4.96 114.28 110.80 2qki n THR 52 Ca -0.00 -0.78 -0.25 0.00 -2.27 0.00 0.00 64.05 60.76 2qki n THR 52 Cb 0.43 -0.48 -0.17 0.00 -2.10 0.00 0.00 70.33 68.01 2qki n THR 52 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2qki s VAL 53 N -0.79 1.00 -0.32 2.28 1.01 -1.26 -1.59 120.40 120.73 2qki s VAL 53 Ca 0.15 -0.36 -0.24 0.00 0.00 0.00 0.00 61.98 61.53 2qki s VAL 53 Cb -0.01 -0.96 0.00 0.00 0.00 0.00 0.00 36.38 35.41 2qki s VAL 53 CO 0.10 0.34 0.83 -0.76 0.00 0.00 0.00 175.10 175.60 2qki s LEU 54 N 1.06 4.07 0.31 3.92 1.43 -0.68 -4.98 118.68 123.82 2qki s LEU 54 Ca -0.07 0.67 0.09 0.00 -1.03 0.00 0.00 54.13 53.78 2qki s LEU 54 Cb -0.14 -3.13 -0.04 0.00 0.03 0.00 0.00 46.19 42.90 2qki s LEU 54 CO -0.01 -0.67 0.08 0.42 0.23 0.00 0.00 176.35 176.40 2qki s THR 55 N 3.07 3.13 0.18 5.49 -4.23 -1.26 -1.96 115.64 120.07 2qki s THR 55 Ca 0.34 -1.80 0.32 0.00 -1.18 0.00 0.00 61.69 59.37 2qki s THR 55 Cb -0.14 -2.92 0.35 0.00 1.34 0.00 0.00 72.50 71.14 2qki s THR 55 CO 0.14 -0.25 1.99 -0.65 -0.54 0.00 0.00 174.62 175.30 2qki h PRO 56 N 1.69 0.00 -0.01 3.99 0.11 -1.93 1.20 132.00 137.05 2qki h PRO 56 Ca -0.44 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.52 2qki h PRO 56 Cb 1.25 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.34 2qki h PRO 56 CO 0.63 0.06 -0.69 0.00 -0.21 0.00 0.00 178.00 177.79 2qki h ALA 57 N 1.94 0.84 -0.21 -0.75 0.00 -1.95 -1.87 119.26 117.26 2qki h ALA 57 Ca -0.00 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.29 2qki h ALA 57 Cb 0.51 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.20 2qki h ALA 57 CO 0.01 0.84 0.00 0.25 0.00 0.00 0.00 179.25 180.35 2qki n THR 58 N -3.74 0.27 -2.82 0.00 -2.24 -1.16 -4.95 114.28 99.64 2qki n THR 58 Ca -0.01 -0.39 -0.19 0.00 -2.27 0.00 0.00 64.05 61.18 2qki n THR 58 Cb 0.68 0.40 0.02 0.00 -2.10 0.00 0.00 70.33 69.33 2qki n THR 58 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2qki n ASN 59 N 0.44 -5.55 -1.94 3.42 4.13 -0.70 -3.19 115.26 111.86 2qki n ASN 59 Ca 0.16 -0.21 -0.20 0.00 1.68 0.00 0.00 54.58 56.01 2qki n ASN 59 Cb 0.35 -4.43 -0.05 0.00 -1.54 0.00 0.00 39.78 34.11 2qki n ASN 59 CO 0.00 0.00 0.00 1.41 0.28 0.00 0.00 177.26 178.95 2qki n HIS 60 N -4.31 -0.51 -4.82 3.10 8.25 0.41 -4.92 115.22 112.42 2qki n HIS 60 Ca -0.12 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.04 2qki n HIS 60 Cb 0.62 -3.55 -0.17 0.00 1.12 0.00 0.00 29.99 28.01 2qki n HIS 60 CO 0.00 0.00 0.00 1.41 0.64 0.00 0.00 176.34 178.39 2qki s MET 61 N -4.28 2.50 0.00 -0.41 0.00 -1.19 -1.34 119.30 114.58 2qki s MET 61 Ca 0.00 -0.68 0.00 0.00 0.00 0.00 0.00 55.69 55.01 2qki s MET 61 Cb 0.00 -1.98 0.00 0.00 0.00 0.00 0.00 34.83 32.85 2qki s MET 61 CO 0.00 0.06 0.00 0.41 0.00 0.00 0.00 175.02 175.49 2qki n GLY 62 N 3.81 4.13 3.60 2.11 0.00 0.11 -4.90 105.19 114.06 2qki n GLY 62 Ca -0.20 -1.31 -0.03 0.00 0.00 0.00 0.00 46.02 44.48 2qki n GLY 62 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2qki s ASN 63 N 0.46 -0.72 -0.04 1.61 2.47 -1.26 -0.31 114.94 117.15 2qki s ASN 63 Ca 0.00 1.09 0.04 0.00 0.42 0.00 0.00 52.86 54.41 2qki s ASN 63 Cb 0.00 1.47 -0.00 0.00 -1.45 0.00 0.00 41.25 41.27 2qki s ASN 63 CO 0.00 -0.17 -0.15 0.68 -3.72 0.00 0.00 177.10 173.75 2qki s VAL 64 N 1.80 1.24 -0.18 -5.21 -7.23 -0.34 -4.88 120.40 105.60 2qki s VAL 64 Ca -0.08 -0.60 -0.04 0.00 -1.81 0.00 0.00 61.98 59.45 2qki s VAL 64 Cb -0.05 -1.08 -0.02 0.00 0.56 0.00 0.00 36.38 35.79 2qki s VAL 64 CO -0.17 0.36 -0.04 0.42 -0.31 0.00 0.00 175.10 175.36 2qki s THR 65 N 0.14 3.70 0.14 5.32 -4.23 -1.26 -0.38 115.64 119.07 2qki s THR 65 Ca -0.05 -0.41 0.07 0.00 -1.18 0.00 0.00 61.69 60.12 2qki s THR 65 Cb -0.11 -2.64 -0.04 0.00 1.34 0.00 0.00 72.50 71.05 2qki s THR 65 CO 0.02 0.46 -0.16 0.72 -0.54 0.00 0.00 174.62 175.12 2qki s PHE 66 N 0.78 1.59 0.09 3.99 -0.12 0.06 -4.92 117.98 119.45 2qki s PHE 66 Ca -0.01 -0.53 0.10 0.00 -0.05 0.00 0.00 56.93 56.44 2qki s PHE 66 Cb -0.15 -0.81 -0.03 0.00 -0.63 0.00 0.00 43.02 41.40 2qki s PHE 66 CO 0.02 0.23 -0.25 0.99 -0.05 0.00 0.00 175.22 176.15 2qki s THR 67 N -2.19 2.10 -0.15 -4.49 2.01 -1.26 -0.09 115.64 111.57 2qki s THR 67 Ca 0.13 -1.54 0.02 0.00 0.31 0.00 0.00 61.69 60.60 2qki s THR 67 Cb -0.05 -1.83 0.01 0.00 0.01 0.00 0.00 72.50 70.64 2qki s THR 67 CO 0.05 0.19 -0.20 -0.63 -0.69 0.00 0.00 174.62 173.34 2qki s ILE 68 N -0.95 2.27 0.00 1.82 1.01 -1.26 -4.83 121.20 119.27 2qki s ILE 68 Ca 0.12 -0.91 0.00 0.00 0.00 0.00 0.00 60.65 59.86 2qki s ILE 68 Cb -0.10 -1.93 0.00 0.00 0.01 0.00 0.00 42.46 40.44 2qki s ILE 68 CO 0.04 0.54 0.00 -0.81 0.00 0.00 0.00 174.94 174.71 2qki n PRO 69 N 4.08 0.00 -0.03 2.79 -0.04 -1.26 0.19 135.00 140.73 2qki n PRO 69 Ca -0.20 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.24 2qki n PRO 69 Cb 0.52 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 33.97 2qki n PRO 69 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2qki n SER 76 N 0.00 0.78 -3.66 3.54 7.64 -1.26 -4.83 113.62 115.83 2qki n SER 76 Ca 0.00 0.39 -0.08 0.00 1.01 0.00 0.00 58.87 60.19 2qki n SER 76 Cb 0.00 -0.65 -0.02 0.00 -1.01 0.00 0.00 64.21 62.53 2qki n SER 76 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 2qki s GLU 77 N -1.56 1.36 0.00 1.43 -1.05 -1.26 -5.10 118.70 112.52 2qki s GLU 77 Ca -0.07 -0.66 0.00 0.00 -0.15 0.00 0.00 54.97 54.09 2qki s GLU 77 Cb 0.01 0.52 0.00 0.00 -0.44 0.00 0.00 34.13 34.22 2qki s GLU 77 CO 0.10 -0.61 0.00 1.63 0.95 0.00 0.00 175.26 177.33 2qki n LYS 78 N -0.41 0.00 -0.03 -4.83 4.76 -1.26 -5.19 118.16 111.20 2qki n LYS 78 Ca -0.09 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.35 2qki n LYS 78 Cb 0.61 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.80 2qki n LYS 78 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2qki n GLY 79 N -1.13 0.46 0.39 0.72 0.00 -1.26 -4.42 105.19 99.96 2qki n GLY 79 Ca 0.00 -1.24 0.15 0.00 0.00 0.00 0.00 46.02 44.93 2qki n GLY 79 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2qki h ARG 80 N 0.00 0.00 -1.71 1.61 0.11 -2.04 -3.37 114.38 108.97 2qki h ARG 80 Ca 0.00 0.00 0.03 0.00 0.10 0.00 0.00 59.98 60.11 2qki h ARG 80 Cb 0.00 0.00 -0.25 0.00 1.11 0.00 0.00 29.97 30.83 2qki h ARG 80 CO 0.00 0.00 0.37 1.21 0.10 0.00 0.00 179.97 181.65 2qki s ASN 81 N -3.90 -0.53 -0.03 0.08 3.84 -1.26 -5.17 114.94 107.98 2qki s ASN 81 Ca -0.02 0.99 -0.21 0.00 0.21 0.00 0.00 52.86 53.82 2qki s ASN 81 Cb 0.09 0.99 -0.05 0.00 -0.55 0.00 0.00 41.25 41.73 2qki s ASN 81 CO 0.29 -0.20 0.61 -0.75 -2.79 0.00 0.00 177.10 174.26 2qki s LYS 82 N 0.16 4.36 0.10 0.43 2.20 -1.26 -5.03 119.74 120.69 2qki s LYS 82 Ca 0.02 0.75 0.05 0.00 -0.36 0.00 0.00 55.97 56.43 2qki s LYS 82 Cb -0.05 -3.38 -0.04 0.00 -1.51 0.00 0.00 37.83 32.86 2qki s LYS 82 CO -0.04 0.27 -0.12 -0.06 -0.36 0.00 0.00 175.35 175.04 2qki s PHE 83 N 0.14 1.20 0.31 4.03 0.08 -1.26 -1.31 117.98 121.16 2qki s PHE 83 Ca 0.32 -0.60 0.04 0.00 0.12 0.00 0.00 56.93 56.82 2qki s PHE 83 Cb -0.18 -0.64 -0.06 0.00 -0.57 0.00 0.00 43.02 41.57 2qki s PHE 83 CO 0.17 0.06 0.03 0.14 -0.10 0.00 0.00 175.22 175.51 2qki s VAL 84 N -2.20 1.29 -0.22 -0.44 -7.23 -0.26 -2.13 120.40 109.21 2qki s VAL 84 Ca 0.06 -2.03 -0.02 0.00 -1.81 0.00 0.00 61.98 58.18 2qki s VAL 84 Cb -0.04 -2.68 0.01 0.00 0.56 0.00 0.00 36.38 34.23 2qki s VAL 84 CO 0.01 -0.10 -0.08 -0.89 -0.31 0.00 0.00 175.10 173.73 2qki s THR 85 N -3.23 2.91 -0.27 5.32 2.01 0.20 -0.53 115.64 122.05 2qki s THR 85 Ca 0.34 -0.78 -0.17 0.00 0.31 0.00 0.00 61.69 61.39 2qki s THR 85 Cb 0.07 -2.36 -0.03 0.00 0.01 0.00 0.00 72.50 70.19 2qki s THR 85 CO 0.14 0.37 0.48 -0.69 -0.69 0.00 0.00 174.62 174.22 2qki s VAL 86 N 1.38 5.09 -0.19 3.82 1.01 0.28 -0.58 120.40 131.21 2qki s VAL 86 Ca 0.04 0.75 -0.01 0.00 0.00 0.00 0.00 61.98 62.75 2qki s VAL 86 Cb -0.15 -3.80 0.00 0.00 0.00 0.00 0.00 36.38 32.43 2qki s VAL 86 CO -0.06 0.08 -0.13 -1.58 0.00 0.00 0.00 175.10 173.41 2qki s GLN 87 N 2.25 3.19 -0.14 2.72 0.74 0.48 -1.41 119.66 127.49 2qki s GLN 87 Ca 0.19 -0.73 -0.02 0.00 0.05 0.00 0.00 55.36 54.85 2qki s GLN 87 Cb -0.16 -2.76 -0.02 0.00 1.10 0.00 0.00 33.01 31.17 2qki s GLN 87 CO 0.10 -0.17 -0.07 0.00 -0.55 0.00 0.00 175.29 174.60 2qki s ALA 88 N 1.29 2.87 -0.27 1.58 0.00 0.17 -0.87 121.76 126.52 2qki s ALA 88 Ca 0.04 -0.85 -0.01 0.00 0.00 0.00 0.00 51.96 51.14 2qki s ALA 88 Cb -0.14 -1.41 0.04 0.00 0.00 0.00 0.00 23.12 21.61 2qki s ALA 88 CO -0.07 0.26 -0.04 -0.08 0.00 0.00 0.00 175.76 175.83 2qki s THR 89 N 0.26 2.82 -0.98 0.00 -1.32 0.10 0.71 115.64 117.23 2qki s THR 89 Ca -0.05 -1.26 -0.09 0.00 -1.21 0.00 0.00 61.69 59.08 2qki s THR 89 Cb -0.15 -2.53 0.25 0.00 -1.51 0.00 0.00 72.50 68.56 2qki s THR 89 CO 0.04 0.05 0.94 -0.36 -2.21 0.00 0.00 174.62 173.07 2qki s PHE 90 N 1.26 4.04 0.00 9.09 0.08 0.10 -2.41 117.98 130.14 2qki s PHE 90 Ca -0.03 -2.56 0.00 0.00 0.12 0.00 0.00 56.93 54.46 2qki s PHE 90 Cb -0.18 -3.71 0.00 0.00 -0.57 0.00 0.00 43.02 38.55 2qki s PHE 90 CO -0.03 -0.93 0.00 0.41 -0.10 0.00 0.00 175.22 174.57 2qki n GLY 91 N 3.03 1.82 0.44 4.36 0.00 -0.95 -2.45 105.19 111.43 2qki n GLY 91 Ca 0.20 -0.25 0.09 0.00 0.00 0.00 0.00 46.02 46.05 2qki n GLY 91 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2qki n THR 92 N 0.00 0.00 -2.86 2.61 -2.24 -1.26 -4.91 114.28 105.62 2qki n THR 92 Ca 0.00 -0.34 -0.43 0.00 -2.27 0.00 0.00 64.05 61.01 2qki n THR 92 Cb 0.00 1.23 -0.04 0.00 -2.10 0.00 0.00 70.33 69.42 2qki n THR 92 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 2qki s GLN 93 N -1.98 3.21 -0.00 -0.78 2.00 -1.03 -5.02 119.66 116.07 2qki s GLN 93 Ca 0.15 -0.58 -0.29 0.00 -2.00 0.00 0.00 55.36 52.65 2qki s GLN 93 Cb 0.14 -4.14 -0.03 0.00 0.80 0.00 0.00 33.01 29.78 2qki s GLN 93 CO 0.42 -1.64 0.92 0.08 -0.50 0.00 0.00 175.29 174.57 2qki s VAL 94 N 3.94 4.86 -0.12 1.34 1.01 -1.26 0.01 120.40 130.19 2qki s VAL 94 Ca 0.25 1.93 0.02 0.00 0.00 0.00 0.00 61.98 64.18 2qki s VAL 94 Cb -0.15 -4.26 0.01 0.00 0.00 0.00 0.00 36.38 31.98 2qki s VAL 94 CO 0.14 0.20 -0.16 -0.69 0.00 0.00 0.00 175.10 174.59 2qki s VAL 95 N 0.84 1.60 0.11 2.92 1.01 0.22 -4.94 120.40 122.15 2qki s VAL 95 Ca 0.48 -0.70 0.03 0.00 0.00 0.00 0.00 61.98 61.80 2qki s VAL 95 Cb -0.21 -1.45 -0.04 0.00 0.00 0.00 0.00 36.38 34.68 2qki s VAL 95 CO 0.26 0.46 -0.09 -1.83 0.00 0.00 0.00 175.10 173.90 2qki s GLU 96 N 0.98 0.91 -0.19 2.72 -1.05 -1.26 0.44 118.70 121.24 2qki s GLU 96 Ca -0.06 -1.29 -0.11 0.00 -0.15 0.00 0.00 54.97 53.36 2qki s GLU 96 Cb -0.15 -0.48 0.06 0.00 -0.44 0.00 0.00 34.13 33.13 2qki s GLU 96 CO -0.02 0.05 0.46 0.21 0.95 0.00 0.00 175.26 176.91 2qki s LYS 97 N -3.33 0.45 -0.09 -4.83 2.47 -0.50 -5.01 119.74 108.91 2qki s LYS 97 Ca 0.10 0.84 -0.25 0.00 -1.56 0.00 0.00 55.97 55.11 2qki s LYS 97 Cb 0.01 0.02 -0.03 0.00 -1.46 0.00 0.00 37.83 36.37 2qki s LYS 97 CO -0.01 -0.15 0.77 0.14 0.16 0.00 0.00 175.35 176.26 2qki s VAL 98 N 1.34 4.98 0.00 4.02 -7.23 -1.26 -0.55 120.40 121.70 2qki s VAL 98 Ca -0.09 1.56 0.07 0.00 -1.81 0.00 0.00 61.98 61.71 2qki s VAL 98 Cb -0.07 -4.10 -0.02 0.00 0.56 0.00 0.00 36.38 32.75 2qki s VAL 98 CO -0.13 0.18 -0.22 -0.69 -0.31 0.00 0.00 175.10 173.94 2qki s VAL 99 N 1.19 1.74 0.27 1.32 1.01 0.31 -4.85 120.40 121.38 2qki s VAL 99 Ca 0.39 -1.02 -0.29 0.00 0.00 0.00 0.00 61.98 61.05 2qki s VAL 99 Cb -0.18 -1.46 -0.09 0.00 0.00 0.00 0.00 36.38 34.65 2qki s VAL 99 CO 0.18 0.41 1.10 -0.22 0.00 0.00 0.00 175.10 176.57 2qki s LEU 100 N -0.72 4.55 -0.10 3.92 2.96 -1.26 -1.10 118.68 126.93 2qki s LEU 100 Ca 0.08 2.26 0.03 0.00 -0.22 0.00 0.00 54.13 56.28 2qki s LEU 100 Cb -0.09 -3.63 -0.01 0.00 0.50 0.00 0.00 46.19 42.97 2qki s LEU 100 CO -0.00 -0.15 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.00 2qki s VAL 101 N -1.09 2.57 0.22 1.68 1.01 -0.43 -0.69 120.40 123.67 2qki s VAL 101 Ca 0.45 -0.85 -0.28 0.00 0.00 0.00 0.00 61.98 61.30 2qki s VAL 101 Cb -0.32 -2.02 -0.09 0.00 0.00 0.00 0.00 36.38 33.95 2qki s VAL 101 CO 0.41 0.55 0.87 -0.55 0.00 0.00 0.00 175.10 176.38 2qki s SER 102 N 0.17 7.52 0.00 3.32 0.15 0.83 -4.46 113.70 121.23 2qki s SER 102 Ca -0.10 1.81 0.22 0.00 0.70 0.00 0.00 55.95 58.58 2qki s SER 102 Cb -0.16 -2.56 0.51 0.00 -1.71 0.00 0.00 66.02 62.10 2qki s SER 102 CO 0.06 0.16 1.44 0.18 1.20 0.00 0.00 173.24 176.28 2qki n LEU 103 N 1.45 2.92 -4.89 3.45 4.32 -1.26 -4.14 117.00 118.85 2qki n LEU 103 Ca -0.03 -1.25 -0.32 0.00 -0.02 0.00 0.00 56.01 54.39 2qki n LEU 103 Cb 0.48 -0.21 -0.05 0.00 -1.62 0.00 0.00 43.42 42.02 2qki n LEU 103 CO 0.48 0.63 0.08 0.00 -1.22 0.00 0.00 177.39 177.36 2qki s GLN 104 N -1.58 3.68 0.04 3.23 -2.07 -1.26 -4.59 119.66 117.11 2qki s GLN 104 Ca 0.37 0.04 0.23 0.00 -1.82 0.00 0.00 55.36 54.17 2qki s GLN 104 Cb 0.21 -2.82 -0.02 0.00 -1.09 0.00 0.00 33.01 29.29 2qki s GLN 104 CO 0.30 0.44 0.96 0.43 -1.32 0.00 0.00 175.29 176.09 2qki n SER 105 N 0.13 0.60 0.00 12.60 7.64 -1.26 -4.73 113.62 128.60 2qki n SER 105 Ca -0.02 -0.28 0.00 0.00 1.01 0.00 0.00 58.87 59.57 2qki n SER 105 Cb 0.52 0.94 0.00 0.00 -1.01 0.00 0.00 64.21 64.66 2qki n SER 105 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2qki n GLY 106 N 1.37 0.51 3.30 0.23 0.00 -1.26 -4.24 105.19 105.10 2qki n GLY 106 Ca 0.02 -1.14 -0.19 0.00 0.00 0.00 0.00 46.02 44.70 2qki n GLY 106 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2qki s TYR 107 N -2.18 1.62 -0.10 1.61 2.02 -0.67 -4.90 117.35 114.75 2qki s TYR 107 Ca 0.00 -0.53 0.02 0.00 -0.37 0.00 0.00 57.07 56.19 2qki s TYR 107 Cb 0.00 -0.81 0.01 0.00 -0.40 0.00 0.00 41.96 40.76 2qki s TYR 107 CO 0.00 0.25 -0.16 -0.51 -1.57 0.00 0.00 175.55 173.56 2qki s LEU 108 N -2.73 1.79 -0.15 -1.29 1.43 -1.26 -2.65 118.68 113.81 2qki s LEU 108 Ca 0.14 -0.43 -0.01 0.00 -1.03 0.00 0.00 54.13 52.80 2qki s LEU 108 Cb -0.04 -1.11 -0.01 0.00 0.03 0.00 0.00 46.19 45.06 2qki s LEU 108 CO 0.05 0.04 -0.12 -0.36 0.23 0.00 0.00 176.35 176.20 2qki s PHE 109 N 0.82 2.84 -0.20 0.29 0.08 -0.99 -4.89 117.98 115.92 2qki s PHE 109 Ca -0.10 -0.78 -0.06 0.00 0.12 0.00 0.00 56.93 56.12 2qki s PHE 109 Cb -0.16 -1.90 -0.03 0.00 -0.57 0.00 0.00 43.02 40.36 2qki s PHE 109 CO 0.01 -0.32 0.02 0.42 -0.10 0.00 0.00 175.22 175.24 2qki s ILE 110 N 0.65 4.15 -0.15 0.64 1.01 -1.26 -0.58 121.20 125.66 2qki s ILE 110 Ca -0.06 -0.25 -0.02 0.00 0.00 0.00 0.00 60.65 60.32 2qki s ILE 110 Cb -0.15 -2.88 -0.02 0.00 0.01 0.00 0.00 42.46 39.42 2qki s ILE 110 CO 0.02 0.43 -0.09 -1.58 0.00 0.00 0.00 174.94 173.72 2qki s GLN 111 N 0.90 3.47 0.12 2.79 0.74 0.35 -4.83 119.66 123.20 2qki s GLN 111 Ca 0.02 -0.62 0.03 0.00 0.05 0.00 0.00 55.36 54.83 2qki s GLN 111 Cb -0.14 -2.78 -0.04 0.00 1.10 0.00 0.00 33.01 31.15 2qki s GLN 111 CO 0.02 0.16 0.16 0.95 -0.55 0.00 0.00 175.29 176.03 2qki s THR 112 N 0.53 4.81 0.31 -0.34 -4.23 -1.26 0.15 115.64 115.61 2qki s THR 112 Ca -0.06 -0.79 0.01 0.00 -1.18 0.00 0.00 61.69 59.66 2qki s THR 112 Cb -0.15 -3.40 0.20 0.00 1.34 0.00 0.00 72.50 70.49 2qki s THR 112 CO 0.03 0.01 1.91 -2.24 -0.54 0.00 0.00 174.62 173.79 2qki h ASP 113 N 2.75 0.73 -4.13 3.99 2.03 -1.20 -3.45 116.42 117.13 2qki h ASP 113 Ca -0.47 -0.08 -0.46 0.00 -0.73 0.00 0.00 57.03 55.29 2qki h ASP 113 Cb 1.18 -0.19 -0.14 0.00 -0.83 0.00 0.00 39.33 39.36 2qki h ASP 113 CO 0.67 0.65 -0.55 -0.54 -1.03 0.00 0.00 179.24 178.43 2qki s LYS 114 N -5.40 1.69 0.10 4.15 1.02 -1.26 -4.89 119.74 115.15 2qki s LYS 114 Ca -0.10 -1.98 0.22 0.00 0.02 0.00 0.00 55.97 54.14 2qki s LYS 114 Cb 0.16 -0.33 -0.13 0.00 -0.52 0.00 0.00 37.83 37.01 2qki s LYS 114 CO 0.78 -0.42 0.82 0.25 -0.92 0.00 0.00 175.35 175.86 2qki n THR 115 N -0.68 0.35 -3.72 2.17 -2.24 -1.26 -4.96 114.28 103.93 2qki n THR 115 Ca -0.01 -0.51 -0.14 0.00 -2.27 0.00 0.00 64.05 61.12 2qki n THR 115 Cb 0.65 -0.16 -0.08 0.00 -2.10 0.00 0.00 70.33 68.64 2qki n THR 115 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 2qki s ILE 116 N -3.41 0.04 0.00 2.28 2.07 -1.26 -1.97 121.20 118.96 2qki s ILE 116 Ca -0.03 -0.35 -0.09 0.00 -1.41 0.00 0.00 60.65 58.77 2qki s ILE 116 Cb 0.12 -0.68 0.01 0.00 0.13 0.00 0.00 42.46 42.03 2qki s ILE 116 CO 0.84 -0.19 0.18 -0.31 -1.91 0.00 0.00 174.94 173.54 2qki s TYR 117 N -1.17 0.00 0.27 3.50 2.02 0.13 -4.94 117.35 117.16 2qki s TYR 117 Ca -0.12 -0.07 -0.05 0.00 -0.37 0.00 0.00 57.07 56.46 2qki s TYR 117 Cb -0.04 -0.02 -0.05 0.00 -0.40 0.00 0.00 41.96 41.45 2qki s TYR 117 CO 0.05 -0.32 0.54 0.95 -1.57 0.00 0.00 175.55 175.20 2qki s THR 118 N -1.50 5.02 0.29 -0.71 -4.23 -1.25 -0.68 115.64 112.59 2qki s THR 118 Ca -0.14 0.10 -0.29 0.00 -1.18 0.00 0.00 61.69 60.18 2qki s THR 118 Cb -0.06 -3.71 -0.13 0.00 1.34 0.00 0.00 72.50 69.93 2qki s THR 118 CO 0.02 -0.26 1.24 -2.65 -0.54 0.00 0.00 174.62 172.43 2qki n PRO 119 N -0.76 1.85 0.00 3.99 -0.02 -1.26 -2.44 135.00 136.35 2qki n PRO 119 Ca -0.01 0.65 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 2qki n PRO 119 Cb 0.54 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.82 2qki n PRO 119 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qki n GLY 120 N 1.33 1.08 2.20 -1.23 0.00 -0.46 -4.82 105.19 103.30 2qki n GLY 120 Ca 0.08 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.98 2qki n GLY 120 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2qki n SER 121 N 0.00 0.88 -4.12 1.61 3.41 -1.02 -4.76 113.62 109.61 2qki n SER 121 Ca 0.00 -1.71 -0.32 0.00 -0.26 0.00 0.00 58.87 56.59 2qki n SER 121 Cb 0.00 -0.33 -0.16 0.00 -0.26 0.00 0.00 64.21 63.45 2qki n SER 121 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2qki s THR 122 N -1.48 1.93 -0.20 6.66 2.01 -1.26 0.64 115.64 123.94 2qki s THR 122 Ca 0.37 -0.89 -0.27 0.00 0.31 0.00 0.00 61.69 61.21 2qki s THR 122 Cb -0.02 -1.73 -0.00 0.00 0.01 0.00 0.00 72.50 70.75 2qki s THR 122 CO 0.24 0.52 0.93 -0.69 -0.69 0.00 0.00 174.62 174.94 2qki s VAL 123 N 1.05 4.78 -0.16 3.82 1.01 0.50 -4.92 120.40 126.49 2qki s VAL 123 Ca -0.02 1.83 -0.05 0.00 0.00 0.00 0.00 61.98 63.74 2qki s VAL 123 Cb -0.14 -4.22 -0.03 0.00 0.00 0.00 0.00 36.38 31.98 2qki s VAL 123 CO -0.06 -0.07 -0.01 -0.76 0.00 0.00 0.00 175.10 174.20 2qki s LEU 124 N 2.66 3.43 -0.02 3.92 1.43 -1.26 -0.45 118.68 128.40 2qki s LEU 124 Ca 0.41 -0.05 -0.09 0.00 -1.03 0.00 0.00 54.13 53.37 2qki s LEU 124 Cb -0.16 -1.84 0.01 0.00 0.03 0.00 0.00 46.19 44.23 2qki s LEU 124 CO 0.10 0.19 0.19 -0.72 0.23 0.00 0.00 176.35 176.33 2qki s TYR 125 N 0.27 -0.05 -0.00 0.29 -0.85 -0.14 -0.52 117.35 116.34 2qki s TYR 125 Ca -0.01 0.07 0.05 0.00 -0.52 0.00 0.00 57.07 56.67 2qki s TYR 125 Cb -0.13 0.01 -0.01 0.00 0.38 0.00 0.00 41.96 42.20 2qki s TYR 125 CO 0.02 -0.28 -0.17 -0.98 -1.52 0.00 0.00 175.55 172.63 2qki s ARG 126 N -1.11 1.31 -0.18 -3.49 3.03 0.12 0.42 118.95 119.06 2qki s ARG 126 Ca -0.12 -0.63 -0.09 0.00 2.03 0.00 0.00 55.73 56.92 2qki s ARG 126 Cb -0.06 -1.28 -0.05 0.00 -1.03 0.00 0.00 34.95 32.53 2qki s ARG 126 CO 0.02 0.35 0.11 0.42 -1.13 0.00 0.00 175.30 175.06 2qki s ILE 127 N -0.46 5.21 -0.28 4.99 1.09 0.60 -0.50 121.20 131.85 2qki s ILE 127 Ca 0.06 0.11 -0.10 0.00 -1.10 0.00 0.00 60.65 59.63 2qki s ILE 127 Cb -0.07 -3.35 -0.03 0.00 -1.06 0.00 0.00 42.46 37.96 2qki s ILE 127 CO -0.00 0.48 0.15 -0.36 -0.10 0.00 0.00 174.94 175.10 2qki s PHE 128 N 0.11 3.17 -0.41 3.97 0.08 0.25 -0.47 117.98 124.67 2qki s PHE 128 Ca 0.08 -0.27 -0.10 0.00 0.12 0.00 0.00 56.93 56.75 2qki s PHE 128 Cb -0.12 -2.34 0.07 0.00 -0.57 0.00 0.00 43.02 40.06 2qki s PHE 128 CO -0.00 -0.32 0.26 0.95 -0.10 0.00 0.00 175.22 176.00 2qki s THR 129 N 1.67 4.41 0.27 0.64 -4.23 -0.56 -2.35 115.64 115.48 2qki s THR 129 Ca 0.06 -1.24 0.08 0.00 -1.18 0.00 0.00 61.69 59.42 2qki s THR 129 Cb -0.16 -3.63 -0.05 0.00 1.34 0.00 0.00 72.50 69.99 2qki s THR 129 CO 0.07 -0.45 -0.11 0.68 -0.54 0.00 0.00 174.62 174.28 2qki s VAL 130 N 1.48 1.88 0.01 2.29 -7.23 -1.09 -1.15 120.40 116.59 2qki s VAL 130 Ca 0.03 -2.20 0.00 0.00 -1.81 0.00 0.00 61.98 57.99 2qki s VAL 130 Cb -0.22 -2.35 0.00 0.00 0.56 0.00 0.00 36.38 34.37 2qki s VAL 130 CO 0.04 -0.38 0.01 -0.46 -0.31 0.00 0.00 175.10 174.00 2qki n ASN 131 N -0.57 0.02 0.24 4.85 0.23 0.54 -1.67 115.26 118.91 2qki n ASN 131 Ca -0.06 -1.02 0.12 0.00 -0.53 0.00 0.00 54.58 53.10 2qki n ASN 131 Cb 0.62 -0.01 0.52 0.00 -2.08 0.00 0.00 39.78 38.83 2qki n ASN 131 CO 0.00 0.00 0.00 0.45 -0.93 0.00 0.00 177.26 176.78 2qki h HIS 132 N -0.32 0.00 0.00 -2.53 3.86 -1.89 0.40 115.15 114.67 2qki h HIS 132 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2qki h HIS 132 Cb 0.02 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.49 2qki h HIS 132 CO 0.00 0.15 0.00 1.63 0.86 0.00 0.00 177.93 180.57 2qki n LYS 133 N -3.30 0.58 -1.12 2.45 5.02 -1.26 -4.90 118.16 115.63 2qki n LYS 133 Ca 0.00 0.02 -0.04 0.00 -2.02 0.00 0.00 58.31 56.27 2qki n LYS 133 Cb 0.39 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 33.89 2qki n LYS 133 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2qki n LEU 134 N -1.17 0.01 -4.78 -0.35 4.77 0.13 -5.02 117.00 110.59 2qki n LEU 134 Ca 0.16 0.10 -0.38 0.00 -0.03 0.00 0.00 56.01 55.86 2qki n LEU 134 Cb 0.17 -1.56 -0.06 0.00 -2.33 0.00 0.00 43.42 39.64 2qki n LEU 134 CO 0.19 -0.51 0.57 -0.76 -1.33 0.00 0.00 177.39 175.54 2qki s LEU 135 N -0.92 4.46 0.32 2.23 1.43 -1.26 -4.70 118.68 120.23 2qki s LEU 135 Ca 0.00 1.74 -0.29 0.00 -1.03 0.00 0.00 54.13 54.55 2qki s LEU 135 Cb 0.00 -3.69 -0.11 0.00 0.03 0.00 0.00 46.19 42.43 2qki s LEU 135 CO 0.00 0.06 1.44 -2.16 0.23 0.00 0.00 176.35 175.92 2qki s PRO 136 N -1.66 4.23 0.03 1.29 0.04 -1.26 -0.34 135.00 137.33 2qki s PRO 136 Ca 0.44 2.39 0.08 0.00 0.04 0.00 0.00 61.00 63.95 2qki s PRO 136 Cb -0.21 -3.05 -0.02 0.00 0.04 0.00 0.00 34.50 31.26 2qki s PRO 136 CO 0.25 -0.42 -0.24 0.14 0.04 0.00 0.00 177.00 176.78 2qki s VAL 137 N -0.65 1.94 -0.60 -0.36 -7.23 -0.30 -4.81 120.40 108.38 2qki s VAL 137 Ca 0.55 -1.23 -0.23 0.00 -1.81 0.00 0.00 61.98 59.27 2qki s VAL 137 Cb -0.43 -1.65 0.06 0.00 0.56 0.00 0.00 36.38 34.92 2qki s VAL 137 CO 0.52 0.37 0.92 -0.83 -0.31 0.00 0.00 175.10 175.78 2qki s GLY 138 N -1.02 1.43 0.11 2.32 0.00 -1.26 -4.53 107.32 104.37 2qki s GLY 138 Ca 0.10 -1.61 -0.05 0.00 0.00 0.00 0.00 44.72 43.16 2qki s GLY 138 CO 0.01 2.00 0.12 0.50 0.00 0.00 0.00 173.10 175.73 2qki s ARG 139 N 3.88 0.89 -0.06 2.90 1.81 -1.26 -4.62 118.95 122.49 2qki s ARG 139 Ca 0.24 -1.22 -0.16 0.00 -1.72 0.00 0.00 55.73 52.88 2qki s ARG 139 Cb -0.16 0.29 -0.05 0.00 -0.45 0.00 0.00 34.95 34.58 2qki s ARG 139 CO 0.14 -0.26 0.42 0.95 -0.68 0.00 0.00 175.30 175.86 2qki s THR 140 N -3.96 5.11 -0.04 0.02 -4.23 -1.26 -0.79 115.64 110.49 2qki s THR 140 Ca 0.14 0.84 0.07 0.00 -1.18 0.00 0.00 61.69 61.56 2qki s THR 140 Cb 0.06 -3.74 -0.01 0.00 1.34 0.00 0.00 72.50 70.15 2qki s THR 140 CO -0.04 0.47 -0.24 -0.69 -0.54 0.00 0.00 174.62 173.58 2qki s VAL 141 N -0.34 1.96 -0.28 2.29 1.01 0.18 -1.07 120.40 124.16 2qki s VAL 141 Ca 0.24 -1.03 -0.12 0.00 0.00 0.00 0.00 61.98 61.06 2qki s VAL 141 Cb -0.16 -1.65 -0.05 0.00 0.00 0.00 0.00 36.38 34.53 2qki s VAL 141 CO 0.11 0.55 0.24 -0.04 0.00 0.00 0.00 175.10 175.96 2qki s MET 142 N -0.30 3.97 -0.08 2.72 -1.94 0.30 -1.88 119.30 122.09 2qki s MET 142 Ca 0.01 -0.22 0.05 0.00 -1.71 0.00 0.00 55.69 53.81 2qki s MET 142 Cb -0.12 -3.65 -0.01 0.00 2.01 0.00 0.00 34.83 33.06 2qki s MET 142 CO 0.02 -0.19 -0.22 0.54 -0.01 0.00 0.00 175.02 175.15 2qki s VAL 143 N 1.81 2.26 -0.06 -6.03 0.11 -0.37 -1.24 120.40 116.88 2qki s VAL 143 Ca 0.09 -0.98 0.02 0.00 -2.93 0.00 0.00 61.98 58.18 2qki s VAL 143 Cb -0.16 -1.85 0.02 0.00 -1.53 0.00 0.00 36.38 32.85 2qki s VAL 143 CO 0.10 0.56 -0.10 0.20 -3.33 0.00 0.00 175.10 172.54 2qki s ASN 144 N 0.01 1.59 -0.08 3.54 0.01 -0.13 -1.24 114.94 118.64 2qki s ASN 144 Ca -0.08 -0.25 -0.20 0.00 -0.71 0.00 0.00 52.86 51.62 2qki s ASN 144 Cb -0.15 -0.73 -0.04 0.00 0.41 0.00 0.00 41.25 40.74 2qki s ASN 144 CO 0.05 0.00 0.56 -0.63 -1.51 0.00 0.00 177.10 175.57 2qki s ILE 145 N 0.80 5.09 -0.06 0.60 1.01 -0.10 -0.68 121.20 127.85 2qki s ILE 145 Ca -0.12 1.15 0.06 0.00 0.00 0.00 0.00 60.65 61.73 2qki s ILE 145 Cb -0.15 -3.90 -0.01 0.00 0.01 0.00 0.00 42.46 38.41 2qki s ILE 145 CO 0.02 0.33 -0.24 -1.61 0.00 0.00 0.00 174.94 173.44 2qki s GLU 146 N 0.45 2.46 1.08 2.79 2.02 0.12 -0.51 118.70 127.10 2qki s GLU 146 Ca 0.30 -0.87 -0.17 0.00 0.02 0.00 0.00 54.97 54.25 2qki s GLU 146 Cb -0.17 -2.09 0.23 0.00 0.10 0.00 0.00 34.13 32.21 2qki s GLU 146 CO 0.14 0.36 1.17 0.54 0.02 0.00 0.00 175.26 177.50 2qki s ASN 147 N -0.14 2.01 0.43 -0.19 2.20 -0.17 -1.78 114.94 117.31 2qki s ASN 147 Ca -0.04 0.61 0.30 0.00 -0.94 0.00 0.00 52.86 52.79 2qki s ASN 147 Cb -0.13 -0.87 1.42 0.00 -2.00 0.00 0.00 41.25 39.66 2qki s ASN 147 CO 0.04 -3.45 1.91 -0.65 -2.94 0.00 0.00 177.10 172.01 2qki h PRO 148 N -2.12 0.00 -0.20 3.55 0.11 -1.90 -0.79 132.00 130.64 2qki h PRO 148 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2qki h PRO 148 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 2qki h PRO 148 CO 0.41 0.00 0.00 -0.85 -0.21 0.00 0.00 178.00 177.35 2qki n GLU 149 N -2.64 2.02 -0.38 1.05 0.28 -1.26 -4.96 120.64 114.75 2qki n GLU 149 Ca -0.00 -1.53 0.00 0.00 -0.16 0.00 0.00 57.16 55.47 2qki n GLU 149 Cb 0.18 -1.45 0.00 0.00 1.43 0.00 0.00 31.44 31.60 2qki n GLU 149 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2qki n GLY 150 N 1.27 0.78 3.68 -1.84 0.00 -0.30 -5.06 105.19 103.73 2qki n GLY 150 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 2qki n GLY 150 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qki s ILE 151 N -2.16 4.96 0.48 -0.61 1.01 -1.26 -4.75 121.20 118.87 2qki s ILE 151 Ca 0.00 1.47 -0.23 0.00 0.00 0.00 0.00 60.65 61.89 2qki s ILE 151 Cb 0.00 -4.06 -0.07 0.00 0.01 0.00 0.00 42.46 38.34 2qki s ILE 151 CO 0.00 0.11 1.19 -2.84 0.00 0.00 0.00 174.94 173.40 2qki s PRO 152 N 1.69 3.66 0.00 2.79 0.02 -1.26 -1.00 135.00 140.89 2qki s PRO 152 Ca 0.36 1.82 0.00 0.00 0.02 0.00 0.00 61.00 63.20 2qki s PRO 152 Cb -0.17 -2.36 0.00 0.00 0.02 0.00 0.00 34.50 31.99 2qki s PRO 152 CO 0.14 -0.65 0.00 0.28 -0.33 0.00 0.00 177.00 176.44 2qki n VAL 153 N -0.60 0.00 -3.75 3.83 0.31 0.33 -4.90 118.33 113.55 2qki n VAL 153 Ca 0.08 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.28 2qki n VAL 153 Cb 0.48 0.12 -0.13 0.00 -0.91 0.00 0.00 33.84 33.40 2qki n VAL 153 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 2qki s LYS 154 N -0.93 0.21 0.13 5.55 2.20 -1.19 -5.00 119.74 120.71 2qki s LYS 154 Ca 0.00 0.46 0.08 0.00 -0.36 0.00 0.00 55.97 56.15 2qki s LYS 154 Cb 0.00 -0.06 -0.04 0.00 -1.51 0.00 0.00 37.83 36.22 2qki s LYS 154 CO 0.00 -0.13 -0.18 1.14 -0.36 0.00 0.00 175.35 175.82 2qki s GLN 155 N 0.96 1.13 -0.04 4.03 1.03 -1.26 -0.93 119.66 124.58 2qki s GLN 155 Ca -0.07 -1.24 -0.10 0.00 0.04 0.00 0.00 55.36 53.99 2qki s GLN 155 Cb -0.08 -1.23 0.02 0.00 0.03 0.00 0.00 33.01 31.74 2qki s GLN 155 CO -0.06 0.27 0.24 -0.51 -2.54 0.00 0.00 175.29 172.68 2qki s ASP 156 N -2.26 -0.15 -0.22 12.60 1.01 -0.37 -5.01 116.67 122.27 2qki s ASP 156 Ca 0.09 0.16 0.01 0.00 0.71 0.00 0.00 52.55 53.52 2qki s ASP 156 Cb -0.08 0.36 0.05 0.00 1.01 0.00 0.00 42.92 44.27 2qki s ASP 156 CO 0.05 -0.29 -0.07 -0.44 0.21 0.00 0.00 175.17 174.63 2qki s SER 157 N -0.79 3.75 0.10 0.27 0.01 -1.26 -1.23 113.70 114.55 2qki s SER 157 Ca -0.09 -1.10 0.05 0.00 1.31 0.00 0.00 55.95 56.12 2qki s SER 157 Cb -0.05 -1.22 -0.03 0.00 0.21 0.00 0.00 66.02 64.93 2qki s SER 157 CO 0.02 -0.20 -0.12 -0.76 0.41 0.00 0.00 173.24 172.58 2qki s LEU 158 N 1.37 2.37 -0.00 2.44 1.02 -0.79 -4.92 118.68 120.17 2qki s LEU 158 Ca -0.05 -0.75 -0.05 0.00 0.02 0.00 0.00 54.13 53.31 2qki s LEU 158 Cb -0.18 -0.43 -0.04 0.00 0.02 0.00 0.00 46.19 45.55 2qki s LEU 158 CO -0.07 -0.17 0.22 -0.55 0.02 0.00 0.00 176.35 175.80 2qki s SER 159 N -2.23 6.43 0.00 2.29 0.15 -1.26 0.50 113.70 119.58 2qki s SER 159 Ca 0.04 0.45 0.21 0.00 0.70 0.00 0.00 55.95 57.35 2qki s SER 159 Cb -0.06 -2.04 0.39 0.00 -1.71 0.00 0.00 66.02 62.60 2qki s SER 159 CO 0.02 0.26 1.35 -1.54 1.20 0.00 0.00 173.24 174.52 2qki n SER 160 N 1.03 3.32 -4.62 5.45 3.41 0.03 -4.94 113.62 117.29 2qki n SER 160 Ca -0.11 -1.96 -0.58 0.00 -0.26 0.00 0.00 58.87 55.96 2qki n SER 160 Cb 0.53 -0.23 -0.08 0.00 -0.26 0.00 0.00 64.21 64.17 2qki n SER 160 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 2qki n GLN 161 N 1.36 0.60 -1.78 4.33 -0.06 -1.26 -1.34 117.38 119.24 2qki n GLN 161 Ca 0.18 0.22 -0.16 0.00 -2.00 0.00 0.00 57.00 55.23 2qki n GLN 161 Cb 0.57 -1.80 -0.05 0.00 -4.06 0.00 0.00 30.24 24.90 2qki n GLN 161 CO 0.00 0.00 0.00 0.09 -0.20 0.00 0.00 177.06 176.95 2qki n ASN 162 N 3.18 -4.90 -1.62 1.69 3.02 -1.26 -4.91 115.26 110.46 2qki n ASN 162 Ca 0.23 0.25 -0.05 0.00 -0.03 0.00 0.00 54.58 54.98 2qki n ASN 162 Cb 0.10 -3.90 0.09 0.00 -0.61 0.00 0.00 39.78 35.45 2qki n ASN 162 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2qki n GLN 163 N -2.54 1.95 -3.63 3.52 6.02 -0.45 -4.97 117.38 117.28 2qki n GLN 163 Ca -0.17 -3.37 -0.20 0.00 -0.01 0.00 0.00 57.00 53.24 2qki n GLN 163 Cb 0.57 -1.52 -0.06 0.00 1.02 0.00 0.00 30.24 30.25 2qki n GLN 163 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2qki n LEU 164 N -0.59 -0.60 -2.97 1.08 7.99 -1.26 -1.79 117.00 118.85 2qki n LEU 164 Ca 0.22 -0.81 -0.21 0.00 -0.01 0.00 0.00 56.01 55.20 2qki n LEU 164 Cb 0.88 -1.01 0.01 0.00 -0.11 0.00 0.00 43.42 43.20 2qki n LEU 164 CO 0.12 0.27 -0.07 0.61 -1.51 0.00 0.00 177.39 176.81 2qki n GLY 165 N -1.88 -0.51 3.11 -0.72 0.00 -1.26 -4.91 105.19 99.03 2qki n GLY 165 Ca -0.18 0.08 -0.33 0.00 0.00 0.00 0.00 46.02 45.60 2qki n GLY 165 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qki s VAL 166 N -3.00 2.07 -0.30 1.61 1.01 -0.74 -1.50 120.40 119.55 2qki s VAL 166 Ca 0.25 -1.03 -0.04 0.00 0.00 0.00 0.00 61.98 61.16 2qki s VAL 166 Cb -0.12 -1.91 0.04 0.00 0.00 0.00 0.00 36.38 34.38 2qki s VAL 166 CO 0.31 0.47 0.04 -0.76 0.00 0.00 0.00 175.10 175.16 2qki s LEU 167 N 1.27 3.92 -0.16 3.92 1.02 0.38 -4.93 118.68 124.11 2qki s LEU 167 Ca 0.03 -1.07 -0.08 0.00 0.02 0.00 0.00 54.13 53.03 2qki s LEU 167 Cb -0.14 -1.79 -0.04 0.00 0.02 0.00 0.00 46.19 44.24 2qki s LEU 167 CO -0.12 -0.25 0.13 -2.16 0.02 0.00 0.00 176.35 173.97 2qki s PRO 168 N 1.36 3.77 0.19 1.29 0.04 -1.26 -0.29 135.00 140.09 2qki s PRO 168 Ca -0.02 -0.19 -0.01 0.00 0.04 0.00 0.00 61.00 60.82 2qki s PRO 168 Cb -0.19 -3.28 -0.04 0.00 0.04 0.00 0.00 34.50 31.04 2qki s PRO 168 CO 0.00 0.55 0.13 -0.51 0.04 0.00 0.00 177.00 177.21 2qki s LEU 169 N -0.37 1.24 -0.11 -3.56 1.43 0.17 -5.00 118.68 112.48 2qki s LEU 169 Ca 0.11 -1.33 -0.17 0.00 -1.03 0.00 0.00 54.13 51.71 2qki s LEU 169 Cb -0.12 0.42 0.04 0.00 0.03 0.00 0.00 46.19 46.56 2qki s LEU 169 CO 0.01 -0.83 0.42 -0.94 0.23 0.00 0.00 176.35 175.24 2qki s SER 170 N -3.13 -0.40 -0.07 2.29 1.04 -1.26 -0.96 113.70 111.21 2qki s SER 170 Ca 0.35 0.63 -0.02 0.00 0.48 0.00 0.00 55.95 57.39 2qki s SER 170 Cb 0.07 0.69 0.04 0.00 0.10 0.00 0.00 66.02 66.91 2qki s SER 170 CO 0.10 -0.28 0.05 0.86 0.98 0.00 0.00 173.24 174.95 2qki s TRP 171 N -0.36 0.21 -0.30 5.02 -0.00 0.41 -4.98 118.94 118.94 2qki s TRP 171 Ca -0.05 0.06 -0.29 0.00 -0.00 0.00 0.00 56.10 55.82 2qki s TRP 171 Cb -0.03 -0.58 -0.01 0.00 -0.00 0.00 0.00 33.47 32.84 2qki s TRP 171 CO 0.03 -0.28 1.58 -0.51 -0.00 0.00 0.00 176.95 177.77 2qki s ASP 172 N 2.12 6.27 0.01 5.86 1.01 -1.26 -0.37 116.67 130.32 2qki s ASP 172 Ca 0.04 1.30 -0.30 0.00 0.71 0.00 0.00 52.55 54.31 2qki s ASP 172 Cb -0.13 -2.53 -0.06 0.00 1.01 0.00 0.00 42.92 41.21 2qki s ASP 172 CO -0.05 -1.40 1.44 -0.63 0.21 0.00 0.00 175.17 174.74 2qki s ILE 173 N 5.60 3.61 0.89 0.77 1.01 0.21 -4.98 121.20 128.31 2qki s ILE 173 Ca 0.70 1.00 -0.10 0.00 0.00 0.00 0.00 60.65 62.25 2qki s ILE 173 Cb -0.21 -3.65 0.13 0.00 0.01 0.00 0.00 42.46 38.74 2qki s ILE 173 CO 0.31 -0.00 1.12 -2.84 0.00 0.00 0.00 174.94 173.52 2qki s PRO 174 N 2.42 1.28 0.17 2.79 0.02 -1.26 -1.35 135.00 139.06 2qki s PRO 174 Ca 0.65 1.33 0.01 0.00 0.02 0.00 0.00 61.00 63.02 2qki s PRO 174 Cb -0.33 -1.77 0.02 0.00 0.02 0.00 0.00 34.50 32.44 2qki s PRO 174 CO 0.27 -2.38 1.40 0.93 -0.33 0.00 0.00 177.00 176.89 2qki h GLU 175 N -1.68 0.25 -2.12 5.54 4.39 -1.93 -2.96 114.58 116.07 2qki h GLU 175 Ca -0.45 -0.25 -0.79 0.00 0.34 0.00 0.00 59.36 58.22 2qki h GLU 175 Cb 1.26 0.07 -0.27 0.00 -0.10 0.00 0.00 28.75 29.71 2qki h GLU 175 CO 0.46 0.95 1.06 -0.11 -1.16 0.00 0.00 179.01 180.21 2qki n LEU 176 N -3.71 7.46 -4.85 1.33 7.94 -1.26 -4.78 117.00 119.12 2qki n LEU 176 Ca -0.04 -5.08 -0.22 0.00 -1.11 0.00 0.00 56.01 49.55 2qki n LEU 176 Cb 0.78 -1.12 -0.04 0.00 0.53 0.00 0.00 43.42 43.57 2qki n LEU 176 CO 0.48 1.89 -0.02 0.54 -1.11 0.00 0.00 177.39 179.17 2qki s VAL 177 N -4.69 2.45 -0.13 1.96 0.11 -1.26 -5.11 120.40 113.73 2qki s VAL 177 Ca 0.46 -1.43 -0.19 0.00 -2.93 0.00 0.00 61.98 57.89 2qki s VAL 177 Cb 0.32 -2.88 -0.04 0.00 -1.53 0.00 0.00 36.38 32.25 2qki s VAL 177 CO -0.28 0.00 0.50 0.20 -3.33 0.00 0.00 175.10 172.19 2qki s ASN 178 N -4.11 6.68 0.67 3.54 0.01 -1.26 -5.08 114.94 115.39 2qki s ASN 178 Ca 0.45 0.81 -0.12 0.00 -0.71 0.00 0.00 52.86 53.29 2qki s ASN 178 Cb -0.02 -2.30 -0.01 0.00 0.41 0.00 0.00 41.25 39.34 2qki s ASN 178 CO 0.26 -0.05 1.06 -0.04 -1.51 0.00 0.00 177.10 176.81 2qki s MET 179 N 0.88 3.08 0.00 -0.60 -1.94 -1.26 -4.87 119.30 114.58 2qki s MET 179 Ca 0.26 0.99 0.00 0.00 -1.71 0.00 0.00 55.69 55.23 2qki s MET 179 Cb -0.15 -2.01 0.00 0.00 2.01 0.00 0.00 34.83 34.68 2qki s MET 179 CO 0.11 -0.99 0.00 0.41 -0.01 0.00 0.00 175.02 174.54 2qki n GLY 180 N -1.84 0.89 3.60 -0.03 0.00 -0.63 -4.89 105.19 102.29 2qki n GLY 180 Ca 0.08 -1.92 -0.41 0.00 0.00 0.00 0.00 46.02 43.77 2qki n GLY 180 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2qki s GLN 181 N -1.68 3.94 0.25 1.61 -1.52 -1.26 -0.49 119.66 120.52 2qki s GLN 181 Ca 0.00 0.25 0.04 0.00 -1.95 0.00 0.00 55.36 53.70 2qki s GLN 181 Cb 0.00 -3.70 -0.03 0.00 -0.22 0.00 0.00 33.01 29.06 2qki s GLN 181 CO 0.00 -0.47 0.38 -1.58 -0.25 0.00 0.00 175.29 173.37 2qki s TRP 182 N 2.43 3.46 0.05 0.91 0.52 0.21 -3.78 118.94 122.75 2qki s TRP 182 Ca 0.22 0.05 0.05 0.00 0.02 0.00 0.00 56.10 56.44 2qki s TRP 182 Cb -0.15 -1.63 -0.03 0.00 -1.15 0.00 0.00 33.47 30.52 2qki s TRP 182 CO 0.11 0.40 -0.14 0.15 0.02 0.00 0.00 176.95 177.48 2qki s LYS 183 N -3.98 0.88 -0.20 4.98 -0.14 -0.74 -2.26 119.74 118.28 2qki s LYS 183 Ca 0.35 -0.85 -0.04 0.00 -1.36 0.00 0.00 55.97 54.07 2qki s LYS 183 Cb -0.09 -0.90 -0.02 0.00 -1.68 0.00 0.00 37.83 35.14 2qki s LYS 183 CO 0.30 0.21 -0.02 0.42 -0.76 0.00 0.00 175.35 175.50 2qki s ILE 184 N -1.04 3.77 -0.00 2.17 1.01 -0.96 0.11 121.20 126.27 2qki s ILE 184 Ca 0.00 -0.37 0.06 0.00 0.00 0.00 0.00 60.65 60.34 2qki s ILE 184 Cb -0.09 -2.70 -0.03 0.00 0.01 0.00 0.00 42.46 39.65 2qki s ILE 184 CO 0.02 0.43 -0.18 -0.13 0.00 0.00 0.00 174.94 175.08 2qki s ARG 185 N 1.04 2.24 -0.01 2.79 0.52 0.14 -1.17 118.95 124.50 2qki s ARG 185 Ca 0.01 -0.87 -0.05 0.00 -0.52 0.00 0.00 55.73 54.31 2qki s ARG 185 Cb -0.14 -2.23 0.00 0.00 0.52 0.00 0.00 34.95 33.09 2qki s ARG 185 CO 0.01 0.57 0.09 0.00 0.02 0.00 0.00 175.30 176.00 2qki s ALA 186 N -0.80 -0.22 -0.02 2.13 0.00 0.20 -0.96 121.76 122.09 2qki s ALA 186 Ca 0.13 -0.08 -0.19 0.00 0.00 0.00 0.00 51.96 51.82 2qki s ALA 186 Cb -0.10 0.02 0.04 0.00 0.00 0.00 0.00 23.12 23.07 2qki s ALA 186 CO 0.03 -0.15 0.41 1.52 0.00 0.00 0.00 175.76 177.57 2qki s TYR 187 N -0.91 -0.31 0.30 0.00 -0.85 -0.37 -0.35 117.35 114.87 2qki s TYR 187 Ca -0.10 0.50 -0.29 0.00 -0.52 0.00 0.00 57.07 56.66 2qki s TYR 187 Cb -0.06 0.18 -0.11 0.00 0.38 0.00 0.00 41.96 42.36 2qki s TYR 187 CO 0.01 -0.45 1.44 0.71 -1.52 0.00 0.00 175.55 175.74 2qki s TYR 188 N -1.29 2.89 0.25 -3.49 1.51 -1.26 -0.54 117.35 115.43 2qki s TYR 188 Ca -0.13 1.11 -0.03 0.00 -1.01 0.00 0.00 57.07 57.01 2qki s TYR 188 Cb -0.04 -3.87 0.44 0.00 -0.11 0.00 0.00 41.96 38.38 2qki s TYR 188 CO 0.06 -2.69 1.79 1.49 -1.11 0.00 0.00 175.55 175.09 2qki h GLU 189 N 4.17 0.70 -0.02 -0.62 4.81 -1.45 -2.37 114.58 119.80 2qki h GLU 189 Ca -0.48 -0.04 -0.12 0.00 -0.13 0.00 0.00 59.36 58.59 2qki h GLU 189 Cb 1.22 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 30.43 2qki h GLU 189 CO 0.72 0.46 -0.56 -0.91 -0.73 0.00 0.00 179.01 178.00 2qki h ASN 190 N 0.72 0.07 -2.52 1.04 -0.26 -1.92 -3.33 115.58 109.37 2qki h ASN 190 Ca 0.42 -0.04 -0.70 0.00 -0.56 0.00 0.00 56.30 55.42 2qki h ASN 190 Cb 0.47 -0.02 -0.35 0.00 -1.06 0.00 0.00 38.32 37.36 2qki h ASN 190 CO -0.29 0.61 0.08 -1.20 -1.06 0.00 0.00 177.43 175.57 2qki n SER 191 N -3.89 5.10 0.00 5.81 7.64 -0.90 -4.89 113.62 122.50 2qki n SER 191 Ca -0.02 -3.45 0.08 0.00 1.01 0.00 0.00 58.87 56.50 2qki n SER 191 Cb 0.57 -0.95 0.47 0.00 -1.01 0.00 0.00 64.21 63.29 2qki n SER 191 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 2qki n PRO 192 N 1.00 0.76 -0.05 1.43 -0.02 -1.18 -3.37 135.00 133.58 2qki n PRO 192 Ca 0.29 0.00 -0.11 0.00 -2.02 0.00 0.00 63.50 61.66 2qki n PRO 192 Cb 0.37 -1.32 -0.14 0.00 -0.02 0.00 0.00 33.50 32.38 2qki n PRO 192 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qki n GLN 193 N -0.82 0.66 -3.34 -0.52 0.00 -1.26 -4.77 117.38 107.33 2qki n GLN 193 Ca 0.12 0.20 -0.42 0.00 0.00 0.00 0.00 57.00 56.90 2qki n GLN 193 Cb 0.05 -1.70 -0.09 0.00 0.00 0.00 0.00 30.24 28.51 2qki n GLN 193 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.06 178.20 2qki s GLN 194 N -2.56 3.39 -0.19 2.61 -2.07 -1.22 -5.05 119.66 114.57 2qki s GLN 194 Ca -0.09 -0.51 -0.05 0.00 -1.82 0.00 0.00 55.36 52.89 2qki s GLN 194 Cb 0.07 -3.87 -0.03 0.00 -1.09 0.00 0.00 33.01 28.10 2qki s GLN 194 CO 0.81 -0.68 -0.00 0.08 -1.32 0.00 0.00 175.29 174.18 2qki s VAL 195 N 2.14 4.01 -0.08 3.63 1.01 -1.26 -4.58 120.40 125.27 2qki s VAL 195 Ca 0.13 -0.30 -0.04 0.00 0.00 0.00 0.00 61.98 61.77 2qki s VAL 195 Cb -0.16 -2.80 -0.04 0.00 0.00 0.00 0.00 36.38 33.38 2qki s VAL 195 CO 0.13 0.45 0.11 -0.36 0.00 0.00 0.00 175.10 175.42 2qki s PHE 196 N 0.76 3.45 0.09 5.22 0.40 0.53 -4.92 117.98 123.52 2qki s PHE 196 Ca 0.00 0.39 0.06 0.00 -0.60 0.00 0.00 56.93 56.78 2qki s PHE 196 Cb -0.14 -1.86 -0.03 0.00 0.51 0.00 0.00 43.02 41.49 2qki s PHE 196 CO 0.02 0.64 -0.17 -1.12 0.70 0.00 0.00 175.22 175.29 2qki s SER 197 N -1.20 2.08 0.29 1.36 0.01 -1.26 0.61 113.70 115.59 2qki s SER 197 Ca 0.17 -0.68 0.03 0.00 1.31 0.00 0.00 55.95 56.78 2qki s SER 197 Cb -0.12 -0.09 -0.04 0.00 0.21 0.00 0.00 66.02 65.99 2qki s SER 197 CO 0.07 -0.04 0.18 0.28 0.41 0.00 0.00 173.24 174.14 2qki s THR 198 N -1.39 0.20 0.07 1.44 -1.32 -0.31 -4.89 115.64 109.42 2qki s THR 198 Ca 0.03 -2.00 0.03 0.00 -1.21 0.00 0.00 61.69 58.55 2qki s THR 198 Cb -0.09 -2.50 -0.03 0.00 -1.51 0.00 0.00 72.50 68.37 2qki s THR 198 CO 0.03 0.00 -0.10 -0.70 -2.21 0.00 0.00 174.62 171.64 2qki s GLU 199 N -3.79 0.73 0.01 7.08 2.12 -1.26 -2.25 118.70 121.33 2qki s GLU 199 Ca 0.37 -0.98 -0.11 0.00 0.36 0.00 0.00 54.97 54.62 2qki s GLU 199 Cb 0.05 -0.50 0.01 0.00 0.26 0.00 0.00 34.13 33.94 2qki s GLU 199 CO 0.19 0.09 0.22 -0.59 -0.54 0.00 0.00 175.26 174.63 2qki s PHE 200 N -1.84 -0.03 -0.02 5.30 -0.12 -0.96 -4.81 117.98 115.50 2qki s PHE 200 Ca -0.02 -0.05 -0.11 0.00 -0.05 0.00 0.00 56.93 56.71 2qki s PHE 200 Cb -0.07 0.01 -0.05 0.00 -0.63 0.00 0.00 43.02 42.29 2qki s PHE 200 CO 0.00 -0.38 0.31 -2.00 -0.05 0.00 0.00 175.22 173.11 2qki s GLU 201 N -1.84 3.71 -0.15 1.99 2.12 -0.83 -0.62 118.70 123.09 2qki s GLU 201 Ca -0.11 0.16 -0.01 0.00 0.36 0.00 0.00 54.97 55.37 2qki s GLU 201 Cb -0.04 -3.16 -0.01 0.00 0.26 0.00 0.00 34.13 31.18 2qki s GLU 201 CO 0.00 0.69 -0.12 0.08 -0.54 0.00 0.00 175.26 175.38 2qki s VAL 202 N -1.14 3.06 -0.01 3.70 1.01 0.36 -0.69 120.40 126.68 2qki s VAL 202 Ca 0.23 -0.64 -0.26 0.00 0.00 0.00 0.00 61.98 61.31 2qki s VAL 202 Cb -0.15 -2.31 0.06 0.00 0.00 0.00 0.00 36.38 33.99 2qki s VAL 202 CO 0.12 0.50 0.58 -0.75 0.00 0.00 0.00 175.10 175.55 2qki s LYS 203 N 0.64 1.01 -0.13 2.72 2.20 0.15 -1.61 119.74 124.71 2qki s LYS 203 Ca -0.06 0.02 -0.23 0.00 -0.36 0.00 0.00 55.97 55.34 2qki s LYS 203 Cb -0.15 0.47 -0.03 0.00 -1.51 0.00 0.00 37.83 36.61 2qki s LYS 203 CO 0.03 -0.33 0.70 -1.21 -0.36 0.00 0.00 175.35 174.17 2qki s GLU 204 N -1.70 4.34 0.08 4.03 2.02 -1.26 -3.82 118.70 122.39 2qki s GLU 204 Ca -0.09 0.81 -0.26 0.00 0.02 0.00 0.00 54.97 55.45 2qki s GLU 204 Cb -0.01 -3.51 0.08 0.00 0.10 0.00 0.00 34.13 30.79 2qki s GLU 204 CO 0.05 -0.11 0.79 1.52 0.02 0.00 0.00 175.26 177.53 2qki s TYR 205 N 1.41 -0.38 0.15 1.61 -0.85 -1.26 -5.11 117.35 112.91 2qki s TYR 205 Ca 0.34 0.19 0.10 0.00 -0.52 0.00 0.00 57.07 57.19 2qki s TYR 205 Cb -0.17 0.56 -0.04 0.00 0.38 0.00 0.00 41.96 42.70 2qki s TYR 205 CO 0.14 -0.71 -0.23 0.14 -1.52 0.00 0.00 175.55 173.37 2qki s VAL 206 N -3.40 2.49 0.18 -3.49 -7.23 -1.26 -5.00 120.40 102.69 2qki s VAL 206 Ca 0.05 -1.76 -0.30 0.00 -1.81 0.00 0.00 61.98 58.16 2qki s VAL 206 Cb -0.01 -2.14 -0.08 0.00 0.56 0.00 0.00 36.38 34.70 2qki s VAL 206 CO -0.08 0.03 1.28 -0.76 -0.31 0.00 0.00 175.10 175.26 2qki s LEU 207 N -2.28 4.42 0.81 1.32 1.43 -1.26 -5.04 118.68 118.07 2qki s LEU 207 Ca 0.17 2.33 -0.12 0.00 -1.03 0.00 0.00 54.13 55.48 2qki s LEU 207 Cb -0.10 -3.60 0.08 0.00 0.03 0.00 0.00 46.19 42.60 2qki s LEU 207 CO 0.09 -0.50 1.10 -2.16 0.23 0.00 0.00 176.35 175.11 2qki s PRO 208 N 0.06 1.99 0.00 1.29 0.04 -1.26 -5.01 135.00 132.11 2qki s PRO 208 Ca 0.57 0.59 0.10 0.00 0.04 0.00 0.00 61.00 62.29 2qki s PRO 208 Cb -0.35 -1.91 0.04 0.00 0.04 0.00 0.00 34.50 32.32 2qki s PRO 208 CO 0.36 -1.67 0.72 -1.13 0.04 0.00 0.00 177.00 175.33 2qki n SER 209 N -3.46 1.54 -4.10 6.66 3.41 -1.26 -4.75 113.62 111.65 2qki n SER 209 Ca 0.07 -1.27 -0.10 0.00 -0.26 0.00 0.00 58.87 57.32 2qki n SER 209 Cb 0.57 0.22 -0.09 0.00 -0.26 0.00 0.00 64.21 64.64 2qki n SER 209 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 2qki s PHE 210 N -1.06 0.74 0.15 7.33 -0.12 -1.26 -1.20 117.98 122.56 2qki s PHE 210 Ca 0.10 -1.12 0.08 0.00 -0.05 0.00 0.00 56.93 55.94 2qki s PHE 210 Cb 0.08 -0.39 -0.04 0.00 -0.63 0.00 0.00 43.02 42.04 2qki s PHE 210 CO 0.18 -0.56 -0.11 -1.83 -0.05 0.00 0.00 175.22 172.85 2qki s GLU 211 N -4.02 2.02 -0.15 1.99 -1.05 0.58 -4.85 118.70 113.21 2qki s GLU 211 Ca 0.22 -1.18 0.02 0.00 -0.15 0.00 0.00 54.97 53.88 2qki s GLU 211 Cb 0.07 -2.19 0.01 0.00 -0.44 0.00 0.00 34.13 31.58 2qki s GLU 211 CO 0.01 0.46 -0.21 0.08 0.95 0.00 0.00 175.26 176.56 2qki s VAL 212 N -1.45 2.01 -0.16 1.83 1.01 -1.26 -1.97 120.40 120.41 2qki s VAL 212 Ca 0.22 -0.94 -0.04 0.00 0.00 0.00 0.00 61.98 61.23 2qki s VAL 212 Cb -0.10 -1.79 -0.03 0.00 0.00 0.00 0.00 36.38 34.46 2qki s VAL 212 CO 0.14 0.54 -0.04 -0.63 0.00 0.00 0.00 175.10 175.10 2qki s ILE 213 N 0.99 3.85 -0.32 2.22 -1.09 0.32 -4.79 121.20 122.38 2qki s ILE 213 Ca -0.03 -0.37 -0.00 0.00 -2.23 0.00 0.00 60.65 58.02 2qki s ILE 213 Cb -0.15 -2.69 0.07 0.00 -1.58 0.00 0.00 42.46 38.12 2qki s ILE 213 CO -0.06 0.49 0.03 -0.69 -1.23 0.00 0.00 174.94 173.48 2qki s VAL 214 N 0.39 2.80 -0.25 2.92 1.01 -1.26 -0.94 120.40 125.07 2qki s VAL 214 Ca -0.04 -1.70 0.01 0.00 0.00 0.00 0.00 61.98 60.25 2qki s VAL 214 Cb -0.14 -2.74 0.07 0.00 0.00 0.00 0.00 36.38 33.56 2qki s VAL 214 CO 0.03 -0.28 -0.03 -0.70 0.00 0.00 0.00 175.10 174.12 2qki s GLU 215 N 1.15 1.51 0.58 2.72 2.56 -0.35 -4.66 118.70 122.21 2qki s GLU 215 Ca -0.01 -1.03 -0.19 0.00 0.00 0.00 0.00 54.97 53.73 2qki s GLU 215 Cb -0.20 -2.57 -0.04 0.00 2.00 0.00 0.00 34.13 33.31 2qki s GLU 215 CO -0.03 -0.65 1.19 -1.25 -0.56 0.00 0.00 175.26 173.96 2qki s PRO 216 N 1.39 3.10 0.43 4.30 0.04 -1.26 -1.62 135.00 141.38 2qki s PRO 216 Ca -0.04 1.78 0.27 0.00 0.04 0.00 0.00 61.00 63.05 2qki s PRO 216 Cb -0.19 -1.97 0.79 0.00 0.04 0.00 0.00 34.50 33.18 2qki s PRO 216 CO -0.08 -1.09 1.76 1.79 0.04 0.00 0.00 177.00 179.42 2qki h THR 217 N 1.00 0.00 -3.46 1.26 1.35 -1.55 -3.42 112.91 108.10 2qki h THR 217 Ca -0.50 -0.70 -0.47 0.00 -0.55 0.00 0.00 66.41 64.18 2qki h THR 217 Cb 1.29 1.68 -0.18 0.00 -1.73 0.00 0.00 68.15 69.20 2qki h THR 217 CO 0.56 0.00 -0.77 -1.61 -0.25 0.00 0.00 175.52 173.44 2qki s GLU 218 N -3.35 1.15 -0.27 4.72 0.41 -1.26 -5.05 118.70 115.05 2qki s GLU 218 Ca 0.05 -1.32 0.06 0.00 -0.41 0.00 0.00 54.97 53.36 2qki s GLU 218 Cb 0.08 -1.14 0.55 0.00 -1.78 0.00 0.00 34.13 31.84 2qki s GLU 218 CO 0.59 0.23 1.58 1.63 -0.49 0.00 0.00 175.26 178.81 2qki n LYS 219 N 0.44 2.79 -3.87 1.61 5.02 -1.26 -4.87 118.16 118.01 2qki n LYS 219 Ca -0.14 -2.31 -0.08 0.00 -2.02 0.00 0.00 58.31 53.76 2qki n LYS 219 Cb 0.57 -1.97 -0.03 0.00 -0.02 0.00 0.00 35.03 33.58 2qki n LYS 219 CO 0.00 0.00 0.00 -0.59 -0.52 0.00 0.00 177.40 176.29 2qki s PHE 220 N -2.41 -0.05 -0.19 2.13 -0.12 -1.26 -4.23 117.98 111.85 2qki s PHE 220 Ca 0.42 -0.37 0.01 0.00 -0.05 0.00 0.00 56.93 56.94 2qki s PHE 220 Cb 0.34 0.54 0.03 0.00 -0.63 0.00 0.00 43.02 43.30 2qki s PHE 220 CO 0.10 -1.14 -0.16 -0.47 -0.05 0.00 0.00 175.22 173.50 2qki s TYR 221 N -3.94 2.73 -0.24 3.49 5.04 0.22 -4.91 117.35 119.74 2qki s TYR 221 Ca 0.14 -1.71 -0.29 0.00 -2.44 0.00 0.00 57.07 52.77 2qki s TYR 221 Cb -0.04 -1.83 -0.01 0.00 0.35 0.00 0.00 41.96 40.43 2qki s TYR 221 CO 0.06 -0.79 1.34 -0.47 -1.34 0.00 0.00 175.55 174.35 2qki s TYR 222 N 1.30 2.64 0.64 4.97 5.04 -1.26 -0.74 117.35 129.94 2qki s TYR 222 Ca 0.01 0.85 0.34 0.00 -2.44 0.00 0.00 57.07 55.84 2qki s TYR 222 Cb -0.15 -3.78 1.90 0.00 0.35 0.00 0.00 41.96 40.29 2qki s TYR 222 CO -0.10 -1.94 2.12 0.97 -1.34 0.00 0.00 175.55 175.26 2qki h ILE 223 N 5.81 0.15 -0.02 3.14 6.09 -1.76 -0.95 117.51 129.96 2qki h ILE 223 Ca -0.28 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.21 2qki h ILE 223 Cb 1.11 0.82 0.00 0.00 0.47 0.00 0.00 36.82 39.22 2qki h ILE 223 CO 1.00 0.00 -0.25 -1.22 -3.07 0.00 0.00 178.15 174.62 2qki n TYR 224 N -3.23 0.00 -2.37 2.19 4.01 -1.26 -4.95 117.16 111.54 2qki n TYR 224 Ca -0.01 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.30 2qki n TYR 224 Cb 0.27 -0.01 -0.02 0.00 -0.31 0.00 0.00 39.34 39.27 2qki n TYR 224 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 2qki s ASN 225 N -2.26 6.52 0.57 7.72 2.47 -0.37 -4.91 114.94 124.68 2qki s ASN 225 Ca 0.24 1.07 0.35 0.00 0.42 0.00 0.00 52.86 54.94 2qki s ASN 225 Cb 0.19 -2.54 1.64 0.00 -1.45 0.00 0.00 41.25 39.09 2qki s ASN 225 CO 0.45 -1.23 2.09 -0.08 -3.72 0.00 0.00 177.10 174.61 2qki h GLU 226 N 9.95 0.00 0.00 0.43 4.57 -1.92 -2.90 114.58 124.70 2qki h GLU 226 Ca -0.27 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.91 2qki h GLU 226 Cb 1.10 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.69 2qki h GLU 226 CO 1.05 0.03 0.00 0.87 -1.18 0.00 0.00 179.01 179.78 2qki h LYS 227 N 0.00 0.00 0.00 1.92 1.57 -1.96 -3.41 116.57 114.69 2qki h LYS 227 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2qki h LYS 227 Cb 0.36 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.67 2qki h LYS 227 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.29 2qki n GLY 228 N 0.15 -0.78 3.34 3.86 0.00 -1.10 -4.63 105.19 106.02 2qki n GLY 228 Ca 0.02 -1.16 -0.42 0.00 0.00 0.00 0.00 46.02 44.46 2qki n GLY 228 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2qki s LEU 229 N 0.00 5.38 -0.19 0.99 2.96 0.63 -4.94 118.68 123.50 2qki s LEU 229 Ca 0.00 -1.38 -0.26 0.00 -0.22 0.00 0.00 54.13 52.27 2qki s LEU 229 Cb 0.00 -2.09 -0.01 0.00 0.50 0.00 0.00 46.19 44.59 2qki s LEU 229 CO 0.00 -0.59 0.88 -1.61 -1.32 0.00 0.00 176.35 173.71 2qki s GLU 230 N 1.55 4.27 -0.03 1.98 2.02 -1.26 -1.33 118.70 125.89 2qki s GLU 230 Ca 0.04 1.08 0.04 0.00 0.02 0.00 0.00 54.97 56.14 2qki s GLU 230 Cb -0.23 -3.60 -0.00 0.00 0.10 0.00 0.00 34.13 30.39 2qki s GLU 230 CO 0.05 -0.43 -0.13 0.08 0.02 0.00 0.00 175.26 174.85 2qki s VAL 231 N 2.50 1.12 -0.05 2.63 1.01 0.89 -1.22 120.40 127.27 2qki s VAL 231 Ca 0.39 -0.55 0.01 0.00 0.00 0.00 0.00 61.98 61.83 2qki s VAL 231 Cb -0.16 -0.97 -0.03 0.00 0.00 0.00 0.00 36.38 35.22 2qki s VAL 231 CO 0.10 0.33 -0.07 0.42 0.00 0.00 0.00 175.10 175.89 2qki s THR 232 N 0.07 3.69 -0.19 3.92 -4.23 -0.64 -1.14 115.64 117.12 2qki s THR 232 Ca -0.03 -0.53 -0.07 0.00 -1.18 0.00 0.00 61.69 59.88 2qki s THR 232 Cb -0.10 -2.53 -0.04 0.00 1.34 0.00 0.00 72.50 71.18 2qki s THR 232 CO 0.01 0.56 0.06 -0.63 -0.54 0.00 0.00 174.62 174.08 2qki s ILE 233 N -0.85 4.70 0.09 2.99 1.09 0.81 -1.22 121.20 128.81 2qki s ILE 233 Ca 0.13 -0.06 0.10 0.00 -1.10 0.00 0.00 60.65 59.72 2qki s ILE 233 Cb -0.11 -3.12 -0.03 0.00 -1.06 0.00 0.00 42.46 38.13 2qki s ILE 233 CO 0.03 0.45 -0.25 0.42 -0.10 0.00 0.00 174.94 175.48 2qki s THR 234 N 0.49 2.09 -0.08 2.92 -4.23 -0.11 -0.76 115.64 115.96 2qki s THR 234 Ca 0.03 -1.55 -0.03 0.00 -1.18 0.00 0.00 61.69 58.96 2qki s THR 234 Cb -0.13 -1.83 0.05 0.00 1.34 0.00 0.00 72.50 71.93 2qki s THR 234 CO 0.01 0.19 0.15 0.00 -0.54 0.00 0.00 174.62 174.43 2qki s ALA 235 N -0.95 -0.15 0.05 3.99 0.00 -0.17 -0.52 121.76 124.02 2qki s ALA 235 Ca 0.12 0.55 0.04 0.00 0.00 0.00 0.00 51.96 52.67 2qki s ALA 235 Cb -0.10 -0.77 -0.03 0.00 0.00 0.00 0.00 23.12 22.23 2qki s ALA 235 CO 0.04 -0.52 -0.13 1.03 0.00 0.00 0.00 175.76 176.18 2qki s ARG 236 N 2.17 0.78 0.62 0.00 0.52 -0.83 -1.82 118.95 120.39 2qki s ARG 236 Ca 0.02 -0.84 -0.16 0.00 -0.52 0.00 0.00 55.73 54.23 2qki s ARG 236 Cb -0.12 -0.74 -0.02 0.00 0.52 0.00 0.00 34.95 34.59 2qki s ARG 236 CO -0.06 0.17 1.10 -0.06 0.02 0.00 0.00 175.30 176.47 2qki s PHE 237 N -1.13 2.73 0.51 -0.53 0.40 0.12 -0.31 117.98 119.77 2qki s PHE 237 Ca -0.02 1.54 0.39 0.00 -0.60 0.00 0.00 56.93 58.24 2qki s PHE 237 Cb -0.09 -3.14 2.05 0.00 0.51 0.00 0.00 43.02 42.35 2qki s PHE 237 CO 0.02 -1.50 2.25 -0.07 0.70 0.00 0.00 175.22 176.61 2qki h LEU 238 N 0.35 0.00 -2.58 -0.37 3.38 -1.49 -1.41 115.31 113.19 2qki h LEU 238 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 2qki h LEU 238 Cb 1.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.99 2qki h LEU 238 CO 0.55 0.01 0.00 0.00 0.09 0.00 0.00 178.44 179.10 2qki n TYR 239 N -3.20 1.19 0.00 1.13 0.18 -1.26 -4.96 117.16 110.23 2qki n TYR 239 Ca -0.02 -0.48 0.00 0.00 1.88 0.00 0.00 57.90 59.28 2qki n TYR 239 Cb 0.14 -0.19 0.00 0.00 -0.38 0.00 0.00 39.34 38.91 2qki n TYR 239 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 2qki n GLY 240 N 1.05 1.27 3.82 -7.48 0.00 -0.53 -5.10 105.19 98.22 2qki n GLY 240 Ca 0.21 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.89 2qki n GLY 240 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qki s LYS 241 N -0.04 4.24 0.52 1.61 -0.14 -1.26 -4.73 119.74 119.95 2qki s LYS 241 Ca 0.00 0.97 -0.21 0.00 -1.36 0.00 0.00 55.97 55.37 2qki s LYS 241 Cb 0.00 -2.57 -0.06 0.00 -1.68 0.00 0.00 37.83 33.52 2qki s LYS 241 CO 0.00 0.20 1.17 0.15 -0.76 0.00 0.00 175.35 176.11 2qki s LYS 242 N -2.56 3.43 -0.02 1.68 1.02 -1.26 0.13 119.74 122.16 2qki s LYS 242 Ca 0.52 1.74 -0.05 0.00 0.02 0.00 0.00 55.97 58.20 2qki s LYS 242 Cb -0.13 -2.16 -0.04 0.00 -0.52 0.00 0.00 37.83 34.98 2qki s LYS 242 CO 0.19 -0.81 0.22 0.08 -0.92 0.00 0.00 175.35 174.10 2qki s VAL 243 N -1.63 5.38 -0.18 3.17 1.01 -0.76 -4.73 120.40 122.66 2qki s VAL 243 Ca 0.70 0.06 -0.03 0.00 0.00 0.00 0.00 61.98 62.72 2qki s VAL 243 Cb -0.28 -3.53 -0.01 0.00 0.00 0.00 0.00 36.38 32.56 2qki s VAL 243 CO 0.32 0.39 -0.07 -1.61 0.00 0.00 0.00 175.10 174.13 2qki s GLU 244 N -1.70 3.41 0.00 2.72 0.41 -1.26 -0.95 118.70 121.34 2qki s GLU 244 Ca 0.25 -0.63 0.00 0.00 -0.41 0.00 0.00 54.97 54.18 2qki s GLU 244 Cb -0.13 -2.86 0.00 0.00 -1.78 0.00 0.00 34.13 29.36 2qki s GLU 244 CO 0.15 -0.00 0.00 0.41 -0.49 0.00 0.00 175.26 175.33 2qki n GLY 245 N 4.20 1.25 3.23 -1.39 0.00 -0.78 -3.08 105.19 108.62 2qki n GLY 245 Ca -0.18 -0.62 -0.28 0.00 0.00 0.00 0.00 46.02 44.94 2qki n GLY 245 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2qki s THR 246 N -2.20 1.67 -0.06 2.61 2.01 -0.19 0.09 115.64 119.57 2qki s THR 246 Ca 0.00 -0.90 0.04 0.00 0.31 0.00 0.00 61.69 61.14 2qki s THR 246 Cb 0.00 -1.39 -0.02 0.00 0.01 0.00 0.00 72.50 71.10 2qki s THR 246 CO 0.00 0.47 -0.20 0.00 -0.69 0.00 0.00 174.62 174.20 2qki s ALA 247 N -0.47 2.39 -0.28 7.40 0.00 0.32 -0.59 121.76 130.54 2qki s ALA 247 Ca 0.07 -1.01 -0.09 0.00 0.00 0.00 0.00 51.96 50.94 2qki s ALA 247 Cb -0.08 -0.85 -0.03 0.00 0.00 0.00 0.00 23.12 22.16 2qki s ALA 247 CO -0.01 0.44 0.13 -0.06 0.00 0.00 0.00 175.76 176.27 2qki s PHE 248 N -0.28 3.15 -0.07 0.00 0.08 0.53 -1.02 117.98 120.37 2qki s PHE 248 Ca 0.01 -0.28 0.05 0.00 0.12 0.00 0.00 56.93 56.82 2qki s PHE 248 Cb -0.13 -2.32 -0.01 0.00 -0.57 0.00 0.00 43.02 39.99 2qki s PHE 248 CO 0.03 -0.32 -0.22 0.08 -0.10 0.00 0.00 175.22 174.68 2qki s VAL 249 N 1.66 2.29 0.03 -0.44 1.01 -0.29 -0.66 120.40 124.00 2qki s VAL 249 Ca 0.06 -0.97 0.02 0.00 0.00 0.00 0.00 61.98 61.09 2qki s VAL 249 Cb -0.16 -1.86 -0.02 0.00 0.00 0.00 0.00 36.38 34.34 2qki s VAL 249 CO 0.07 0.57 -0.07 -0.51 0.00 0.00 0.00 175.10 175.15 2qki s ILE 250 N -0.11 0.51 0.24 2.22 2.07 -0.62 -0.93 121.20 124.57 2qki s ILE 250 Ca -0.04 -0.85 0.10 0.00 -1.41 0.00 0.00 60.65 58.44 2qki s ILE 250 Cb -0.14 -0.54 -0.04 0.00 0.13 0.00 0.00 42.46 41.86 2qki s ILE 250 CO 0.04 -0.25 -0.06 -0.36 -1.91 0.00 0.00 174.94 172.40 2qki s PHE 251 N -1.04 2.61 0.28 3.50 0.08 -1.26 -1.32 117.98 120.84 2qki s PHE 251 Ca -0.07 -0.24 -0.10 0.00 0.12 0.00 0.00 56.93 56.64 2qki s PHE 251 Cb -0.08 -1.19 0.00 0.00 -0.57 0.00 0.00 43.02 41.18 2qki s PHE 251 CO 0.00 0.60 0.50 0.20 -0.10 0.00 0.00 175.22 176.42 2qki s GLY 252 N -3.37 0.78 -0.05 4.36 0.00 -0.71 -0.91 107.32 107.42 2qki s GLY 252 Ca 0.29 -1.04 0.06 0.00 0.00 0.00 0.00 44.72 44.03 2qki s GLY 252 CO 0.18 -0.70 -0.23 -0.42 0.00 0.00 0.00 173.10 171.92 2qki s ILE 253 N -3.62 1.91 -0.19 0.90 1.01 -0.12 -1.79 121.20 119.31 2qki s ILE 253 Ca 0.24 -0.99 -0.03 0.00 0.00 0.00 0.00 60.65 59.87 2qki s ILE 253 Cb -0.01 -1.62 -0.01 0.00 0.01 0.00 0.00 42.46 40.83 2qki s ILE 253 CO 0.12 0.54 -0.07 -1.58 0.00 0.00 0.00 174.94 173.95 2qki s GLN 254 N -0.14 3.41 -0.48 2.79 0.74 0.24 -0.48 119.66 125.74 2qki s GLN 254 Ca -0.03 -0.63 0.04 0.00 0.05 0.00 0.00 55.36 54.79 2qki s GLN 254 Cb -0.13 -2.89 0.12 0.00 1.10 0.00 0.00 33.01 31.21 2qki s GLN 254 CO 0.03 -0.04 0.21 0.34 -0.55 0.00 0.00 175.29 175.28 2qki s ASP 255 N 1.04 4.42 -1.16 6.67 2.15 0.32 -1.90 116.67 128.22 2qki s ASP 255 Ca 0.00 -2.81 -0.27 0.00 0.43 0.00 0.00 52.55 49.90 2qki s ASP 255 Cb -0.15 -1.64 0.02 0.00 -0.30 0.00 0.00 42.92 40.86 2qki s ASP 255 CO -0.01 -0.27 0.73 0.61 -0.17 0.00 0.00 175.17 176.07 2qki n GLY 256 N 3.39 -0.93 0.66 2.66 0.00 -1.26 -1.95 105.19 107.75 2qki n GLY 256 Ca 0.05 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.47 2qki n GLY 256 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2qki n GLU 257 N -4.55 0.00 -2.75 1.61 1.02 -1.26 -5.04 120.64 109.66 2qki n GLU 257 Ca -0.11 0.00 -0.41 0.00 -0.02 0.00 0.00 57.16 56.63 2qki n GLU 257 Cb 0.58 -0.00 -0.05 0.00 -0.02 0.00 0.00 31.44 31.95 2qki n GLU 257 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 2qki s GLN 258 N -0.00 4.76 -0.14 3.49 0.74 -0.82 -5.07 119.66 122.61 2qki s GLN 258 Ca 0.00 1.45 0.02 0.00 0.05 0.00 0.00 55.36 56.87 2qki s GLN 258 Cb 0.00 -3.33 0.00 0.00 1.10 0.00 0.00 33.01 30.78 2qki s GLN 258 CO 0.00 0.36 -0.19 1.03 -0.55 0.00 0.00 175.29 175.94 2qki s ARG 259 N -0.56 3.12 -0.28 1.67 0.52 -1.26 -0.52 118.95 121.63 2qki s ARG 259 Ca 0.44 -0.81 -0.00 0.00 -0.52 0.00 0.00 55.73 54.83 2qki s ARG 259 Cb -0.24 -2.50 0.05 0.00 0.52 0.00 0.00 34.95 32.77 2qki s ARG 259 CO 0.30 0.03 -0.04 0.42 0.02 0.00 0.00 175.30 176.04 2qki s ILE 260 N 0.73 2.72 0.60 1.52 -1.09 0.37 -4.97 121.20 121.09 2qki s ILE 260 Ca -0.08 -1.42 -0.18 0.00 -2.23 0.00 0.00 60.65 56.73 2qki s ILE 260 Cb -0.16 -2.56 -0.03 0.00 -1.58 0.00 0.00 42.46 38.13 2qki s ILE 260 CO 0.00 -0.05 1.18 -0.55 -1.23 0.00 0.00 174.94 174.30 2qki s SER 261 N 1.21 5.24 -0.70 3.58 0.15 -1.26 -0.94 113.70 120.98 2qki s SER 261 Ca -0.06 2.30 0.01 0.00 0.70 0.00 0.00 55.95 58.91 2qki s SER 261 Cb -0.19 -2.59 0.17 0.00 -1.71 0.00 0.00 66.02 61.70 2qki s SER 261 CO -0.03 -1.56 0.51 -0.76 1.20 0.00 0.00 173.24 172.61 2qki s LEU 262 N -4.15 5.02 0.58 3.45 1.43 -0.09 -4.87 118.68 120.06 2qki s LEU 262 Ca 0.75 -3.41 0.28 0.00 -1.03 0.00 0.00 54.13 50.73 2qki s LEU 262 Cb -0.28 -1.76 1.78 0.00 0.03 0.00 0.00 46.19 45.95 2qki s LEU 262 CO 0.33 -0.21 2.25 1.55 0.23 0.00 0.00 176.35 180.50 2qki h PRO 263 N 6.18 0.00 0.00 1.29 0.13 -1.95 0.23 132.00 137.88 2qki h PRO 263 Ca 0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.19 2qki h PRO 263 Cb 0.85 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.98 2qki h PRO 263 CO 0.75 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.91 2qki n GLU 264 N -3.91 0.68 0.00 0.86 -0.58 -1.26 -2.99 120.64 113.44 2qki n GLU 264 Ca -0.03 0.01 0.12 0.00 -0.42 0.00 0.00 57.16 56.84 2qki n GLU 264 Cb 0.08 -1.50 0.28 0.00 -0.57 0.00 0.00 31.44 29.73 2qki n GLU 264 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 2qki n SER 265 N -1.14 1.35 -4.61 1.62 3.41 0.80 -4.91 113.62 110.15 2qki n SER 265 Ca 0.18 -1.11 -0.43 0.00 -0.26 0.00 0.00 58.87 57.25 2qki n SER 265 Cb 0.16 0.22 -0.03 0.00 -0.26 0.00 0.00 64.21 64.30 2qki n SER 265 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2qki s LEU 266 N -2.46 3.66 0.06 1.04 2.96 -1.16 -4.58 118.68 118.20 2qki s LEU 266 Ca 0.24 1.76 0.09 0.00 -0.22 0.00 0.00 54.13 55.99 2qki s LEU 266 Cb 0.19 -3.52 -0.03 0.00 0.50 0.00 0.00 46.19 43.33 2qki s LEU 266 CO 0.52 -1.65 -0.25 -0.54 -1.32 0.00 0.00 176.35 173.11 2qki s LYS 267 N 5.61 1.61 -0.22 1.98 -0.14 -0.11 -4.98 119.74 123.48 2qki s LYS 267 Ca 0.87 -1.11 -0.02 0.00 -1.36 0.00 0.00 55.97 54.36 2qki s LYS 267 Cb -0.29 -1.82 0.01 0.00 -1.68 0.00 0.00 37.83 34.05 2qki s LYS 267 CO 0.34 0.46 -0.09 0.50 -0.76 0.00 0.00 175.35 175.81 2qki s ARG 268 N -1.37 3.06 0.06 1.68 3.52 -1.26 -1.14 118.95 123.50 2qki s ARG 268 Ca 0.11 -0.82 0.05 0.00 -0.13 0.00 0.00 55.73 54.94 2qki s ARG 268 Cb -0.10 -2.89 -0.03 0.00 -1.56 0.00 0.00 34.95 30.37 2qki s ARG 268 CO 0.03 -0.29 -0.14 0.96 -0.81 0.00 0.00 175.30 175.05 2qki s ILE 269 N 1.37 1.14 0.23 4.11 -4.36 -0.19 -4.97 121.20 118.52 2qki s ILE 269 Ca 0.03 -1.21 -0.30 0.00 -0.26 0.00 0.00 60.65 58.91 2qki s ILE 269 Cb -0.15 -1.07 -0.09 0.00 1.25 0.00 0.00 42.46 42.40 2qki s ILE 269 CO -0.06 -0.14 1.10 -2.84 0.24 0.00 0.00 174.94 173.24 2qki s PRO 270 N -1.54 4.62 -0.45 0.37 0.02 -1.26 -0.52 135.00 136.23 2qki s PRO 270 Ca -0.00 1.76 -0.16 0.00 0.02 0.00 0.00 61.00 62.62 2qki s PRO 270 Cb -0.09 -3.23 0.05 0.00 0.02 0.00 0.00 34.50 31.25 2qki s PRO 270 CO 0.02 0.15 0.40 0.42 -0.33 0.00 0.00 177.00 177.66 2qki s ILE 271 N -0.74 5.19 -0.18 2.83 -1.09 0.11 -4.45 121.20 122.87 2qki s ILE 271 Ca 0.47 -0.83 0.01 0.00 -2.23 0.00 0.00 60.65 58.07 2qki s ILE 271 Cb -0.31 -4.08 0.02 0.00 -1.58 0.00 0.00 42.46 36.51 2qki s ILE 271 CO 0.38 -0.52 -0.18 -1.61 -1.23 0.00 0.00 174.94 171.78 2qki s GLU 272 N 1.80 2.83 -0.96 2.79 2.02 -0.09 -1.86 118.70 125.23 2qki s GLU 272 Ca 0.06 -0.85 -0.03 0.00 0.02 0.00 0.00 54.97 54.18 2qki s GLU 272 Cb -0.22 -2.54 0.00 0.00 0.10 0.00 0.00 34.13 31.47 2qki s GLU 272 CO 0.09 -0.25 0.35 -3.47 0.02 0.00 0.00 175.26 172.00 2qki n ASP 273 N 4.62 -4.32 -0.35 -0.19 2.03 -1.25 -2.40 116.55 114.69 2qki n ASP 273 Ca -0.20 -0.16 -0.05 0.00 0.52 0.00 0.00 54.79 54.90 2qki n ASP 273 Cb 0.49 -3.21 -0.02 0.00 -0.72 0.00 0.00 41.12 37.66 2qki n ASP 273 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2qki n GLY 274 N -1.21 0.67 2.97 0.27 0.00 -0.12 -4.76 105.19 103.01 2qki n GLY 274 Ca -0.07 -0.28 -0.10 0.00 0.00 0.00 0.00 46.02 45.57 2qki n GLY 274 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2qki s SER 275 N -2.42 0.16 0.06 1.61 0.15 -1.01 -1.00 113.70 111.25 2qki s SER 275 Ca 0.00 -0.34 -0.17 0.00 0.70 0.00 0.00 55.95 56.14 2qki s SER 275 Cb 0.00 0.10 0.03 0.00 -1.71 0.00 0.00 66.02 64.44 2qki s SER 275 CO 0.00 -0.24 0.39 -0.83 1.20 0.00 0.00 173.24 173.76 2qki s GLY 276 N -1.10 -0.24 0.11 9.45 0.00 0.07 -0.91 107.32 114.69 2qki s GLY 276 Ca -0.12 0.17 0.09 0.00 0.00 0.00 0.00 44.72 44.86 2qki s GLY 276 CO -0.00 -0.08 -0.23 -0.54 0.00 0.00 0.00 173.10 172.24 2qki s GLU 277 N -2.79 1.23 -0.06 2.90 8.01 -1.26 -0.14 118.70 126.59 2qki s GLU 277 Ca -0.03 -1.23 -0.19 0.00 0.01 0.00 0.00 54.97 53.53 2qki s GLU 277 Cb -0.00 -1.58 0.04 0.00 -4.31 0.00 0.00 34.13 28.28 2qki s GLU 277 CO -0.05 0.37 0.43 0.54 0.01 0.00 0.00 175.26 176.57 2qki s VAL 278 N -1.12 0.03 0.02 2.63 0.11 -0.29 -4.98 120.40 116.79 2qki s VAL 278 Ca 0.09 -0.25 0.06 0.00 -2.93 0.00 0.00 61.98 58.96 2qki s VAL 278 Cb -0.10 -0.71 -0.02 0.00 -1.53 0.00 0.00 36.38 34.02 2qki s VAL 278 CO 0.05 -0.14 -0.19 -0.69 -3.33 0.00 0.00 175.10 170.80 2qki s VAL 279 N -0.91 1.52 -0.38 2.04 1.01 -1.26 -0.08 120.40 122.34 2qki s VAL 279 Ca -0.10 -1.02 -0.16 0.00 0.00 0.00 0.00 61.98 60.71 2qki s VAL 279 Cb -0.04 -1.31 0.00 0.00 0.00 0.00 0.00 36.38 35.04 2qki s VAL 279 CO 0.05 0.26 0.37 -0.22 0.00 0.00 0.00 175.10 175.56 2qki s LEU 280 N -0.89 4.69 0.47 3.92 2.96 -0.44 -4.97 118.68 124.42 2qki s LEU 280 Ca 0.07 -0.50 -0.22 0.00 -0.22 0.00 0.00 54.13 53.26 2qki s LEU 280 Cb -0.08 -2.32 -0.07 0.00 0.50 0.00 0.00 46.19 44.22 2qki s LEU 280 CO 0.01 -0.43 1.11 -0.94 -1.32 0.00 0.00 176.35 174.78 2qki s SER 281 N 1.75 6.20 0.37 3.68 1.04 -1.26 -0.27 113.70 125.21 2qki s SER 281 Ca 0.10 2.16 0.08 0.00 0.48 0.00 0.00 55.95 58.78 2qki s SER 281 Cb -0.17 -2.59 0.80 0.00 0.10 0.00 0.00 66.02 64.16 2qki s SER 281 CO 0.12 -0.89 1.92 -0.09 0.98 0.00 0.00 173.24 175.29 2qki h ARG 282 N 1.85 0.68 0.04 4.02 2.43 -1.86 -1.93 114.38 119.61 2qki h ARG 282 Ca -0.49 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 58.63 2qki h ARG 282 Cb 1.24 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.64 2qki h ARG 282 CO 0.60 0.45 -0.02 -0.22 -1.51 0.00 0.00 179.97 179.27 2qki h LYS 283 N 0.70 -0.05 -0.46 0.20 3.64 -1.93 -1.34 116.57 117.34 2qki h LYS 283 Ca 0.37 0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.79 2qki h LYS 283 Cb 0.49 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.28 2qki h LYS 283 CO -0.14 0.29 0.23 0.28 -2.27 0.00 0.00 179.45 177.84 2qki h VAL 284 N -0.39 0.95 -0.16 2.00 2.07 -1.92 0.15 116.25 118.95 2qki h VAL 284 Ca -0.00 -0.15 0.03 0.00 0.82 0.00 0.00 66.70 67.39 2qki h VAL 284 Cb 0.36 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 2qki h VAL 284 CO 0.01 0.08 -0.03 0.25 0.02 0.00 0.00 177.57 177.90 2qki h LEU 285 N 0.45 -0.13 -0.67 2.57 5.85 -1.32 -0.69 115.31 121.37 2qki h LEU 285 Ca 0.20 0.05 -0.14 0.00 0.84 0.00 0.00 57.88 58.83 2qki h LEU 285 Cb 0.12 0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 2qki h LEU 285 CO -0.15 -0.04 -0.49 -0.07 -0.34 0.00 0.00 178.44 177.34 2qki h LEU 286 N 0.01 0.47 -0.50 2.25 3.38 -1.00 -3.07 115.31 116.84 2qki h LEU 286 Ca 0.08 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.82 2qki h LEU 286 Cb 0.12 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.73 2qki h LEU 286 CO -0.16 0.89 0.00 0.44 0.09 0.00 0.00 178.44 179.70 2qki h ASP 287 N 0.34 0.00 0.54 -0.43 5.19 -0.60 -3.15 116.42 118.31 2qki h ASP 287 Ca 0.02 0.00 -0.22 0.00 -0.62 0.00 0.00 57.03 56.20 2qki h ASP 287 Cb 0.99 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.50 2qki h ASP 287 CO 0.09 0.00 -0.99 1.23 -3.12 0.00 0.00 179.24 176.45 2qki h GLY 288 N 3.34 0.30 1.39 2.75 0.00 -1.02 -3.31 103.07 106.52 2qki h GLY 288 Ca 0.00 -0.60 -0.26 0.00 0.00 0.00 0.00 47.33 46.47 2qki h GLY 288 CO 0.00 0.52 -1.42 -0.24 0.00 0.00 0.00 176.54 175.40 2qki h VAL 289 N 0.13 1.20 -0.50 4.60 3.04 -1.64 -3.50 116.25 119.59 2qki h VAL 289 Ca -0.07 -2.99 0.00 0.00 -1.01 0.00 0.00 66.70 62.63 2qki h VAL 289 Cb 1.65 2.61 0.00 0.00 -2.01 0.00 0.00 31.29 33.54 2qki h VAL 289 CO 0.16 0.70 0.00 0.00 -1.01 0.00 0.00 177.57 177.42 2qki n GLN 290 N -3.19 0.00 0.00 4.17 1.13 -1.19 -5.01 117.38 113.29 2qki n GLN 290 Ca -0.10 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.96 2qki n GLN 290 Cb 1.01 -0.08 0.00 0.00 0.11 0.00 0.00 30.24 31.27 2qki n GLN 290 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 2qki n ASN 291 N 0.33 0.00 -0.20 1.08 5.15 -1.26 -5.11 115.26 115.24 2qki n ASN 291 Ca 0.00 0.00 -0.06 0.00 -0.60 0.00 0.00 54.58 53.92 2qki n ASN 291 Cb 0.00 0.00 -0.06 0.00 -0.53 0.00 0.00 39.78 39.19 2qki n ASN 291 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 2qki h LEU 292 N 0.00 -1.18 -9.34 1.20 4.07 -1.95 -3.42 115.31 104.69 2qki h LEU 292 Ca 0.00 0.17 -0.54 0.00 0.08 0.00 0.00 57.88 57.59 2qki h LEU 292 Cb 0.00 0.51 0.01 0.00 1.08 0.00 0.00 40.66 42.26 2qki h LEU 292 CO 0.00 -0.15 1.05 -0.13 -1.08 0.00 0.00 178.44 178.13 2qki s ARG 293 N -4.42 4.19 0.34 1.13 0.52 -1.26 -4.92 118.95 114.54 2qki s ARG 293 Ca -0.07 2.26 0.09 0.00 -0.52 0.00 0.00 55.73 57.50 2qki s ARG 293 Cb 0.06 -3.84 0.63 0.00 0.52 0.00 0.00 34.95 32.32 2qki s ARG 293 CO 0.35 -0.80 1.80 0.00 0.02 0.00 0.00 175.30 176.66 2qki h ALA 294 N 9.10 1.30 0.00 2.13 0.00 -1.99 -3.20 119.26 126.60 2qki h ALA 294 Ca -0.41 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.16 2qki h ALA 294 Cb 1.19 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.90 2qki h ALA 294 CO 0.94 0.49 0.00 0.93 0.00 0.00 0.00 179.25 181.61 2qki h GLU 295 N 0.14 0.00 0.00 0.00 3.07 -1.95 -2.08 114.58 113.76 2qki h GLU 295 Ca 0.02 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 58.86 2qki h GLU 295 Cb 0.65 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.56 2qki h GLU 295 CO 0.05 0.00 -0.09 -0.44 -1.40 0.00 0.00 179.01 177.13 2qki h ASP 296 N 0.00 0.00 0.76 1.42 3.32 -1.97 -2.34 116.42 117.61 2qki h ASP 296 Ca 0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 2qki h ASP 296 Cb 0.45 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.00 2qki h ASP 296 CO 0.00 0.09 -0.06 -0.07 -1.72 0.00 0.00 179.24 177.48 2qki h LEU 297 N 0.00 0.00 -9.51 1.55 4.07 -1.58 -3.45 115.31 106.39 2qki h LEU 297 Ca -0.00 0.00 -0.53 0.00 0.08 0.00 0.00 57.88 57.43 2qki h LEU 297 Cb 0.52 0.00 0.02 0.00 1.08 0.00 0.00 40.66 42.28 2qki h LEU 297 CO 0.01 0.06 0.69 -0.69 -1.08 0.00 0.00 178.44 177.44 2qki s VAL 298 N -3.82 3.54 0.00 1.22 1.01 -0.88 -2.20 120.40 119.27 2qki s VAL 298 Ca -0.00 1.09 0.00 0.00 0.00 0.00 0.00 61.98 63.07 2qki s VAL 298 Cb 0.10 -3.70 0.00 0.00 0.00 0.00 0.00 36.38 32.78 2qki s VAL 298 CO 0.55 0.07 0.00 0.61 0.00 0.00 0.00 175.10 176.33 2qki n GLY 299 N 3.44 1.50 4.01 4.51 0.00 -0.81 -5.03 105.19 112.81 2qki n GLY 299 Ca 0.11 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.90 2qki n GLY 299 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qki s LYS 300 N -0.73 1.74 0.11 1.61 1.02 -0.93 -4.91 119.74 117.64 2qki s LYS 300 Ca 0.00 -1.36 -0.00 0.00 0.02 0.00 0.00 55.97 54.63 2qki s LYS 300 Cb 0.00 -2.41 -0.04 0.00 -0.52 0.00 0.00 37.83 34.86 2qki s LYS 300 CO 0.00 -1.37 0.01 -1.54 -0.92 0.00 0.00 175.35 171.53 2qki s SER 301 N -4.77 0.54 -0.09 2.83 1.04 -0.80 -1.20 113.70 111.25 2qki s SER 301 Ca 0.66 -1.12 -0.03 0.00 0.48 0.00 0.00 55.95 55.94 2qki s SER 301 Cb -0.05 0.23 -0.03 0.00 0.10 0.00 0.00 66.02 66.27 2qki s SER 301 CO 0.43 -0.65 0.03 -0.76 0.98 0.00 0.00 173.24 173.28 2qki s LEU 302 N -3.02 3.76 0.20 2.42 2.01 0.86 0.80 118.68 125.71 2qki s LEU 302 Ca 0.17 0.22 0.09 0.00 0.01 0.00 0.00 54.13 54.62 2qki s LEU 302 Cb 0.07 -1.88 -0.04 0.00 0.01 0.00 0.00 46.19 44.36 2qki s LEU 302 CO -0.02 0.38 -0.09 -0.72 1.01 0.00 0.00 176.35 176.91 2qki s TYR 303 N -0.90 2.62 -0.13 0.29 -0.85 -0.74 -1.64 117.35 115.99 2qki s TYR 303 Ca 0.14 -0.23 -0.02 0.00 -0.52 0.00 0.00 57.07 56.44 2qki s TYR 303 Cb -0.11 -1.25 0.04 0.00 0.38 0.00 0.00 41.96 41.01 2qki s TYR 303 CO 0.03 0.54 0.00 0.54 -1.52 0.00 0.00 175.55 175.14 2qki s VAL 304 N -1.86 0.54 -0.22 -3.49 0.11 0.96 -1.74 120.40 114.70 2qki s VAL 304 Ca 0.26 -0.21 -0.08 0.00 -2.93 0.00 0.00 61.98 59.02 2qki s VAL 304 Cb -0.08 -0.81 -0.04 0.00 -1.53 0.00 0.00 36.38 33.92 2qki s VAL 304 CO 0.16 0.09 0.09 -0.55 -3.33 0.00 0.00 175.10 171.56 2qki s SER 305 N 1.89 5.59 -0.11 3.54 0.15 -0.43 -0.92 113.70 123.40 2qki s SER 305 Ca 0.03 -0.00 0.03 0.00 0.70 0.00 0.00 55.95 56.70 2qki s SER 305 Cb -0.14 -1.99 -0.00 0.00 -1.71 0.00 0.00 66.02 62.18 2qki s SER 305 CO -0.07 0.08 -0.21 0.00 1.20 0.00 0.00 173.24 174.25 2qki s ALA 306 N 0.93 2.29 -0.22 5.45 0.00 0.35 -1.59 121.76 128.97 2qki s ALA 306 Ca 0.05 -0.98 -0.04 0.00 0.00 0.00 0.00 51.96 50.99 2qki s ALA 306 Cb -0.14 -0.94 -0.01 0.00 0.00 0.00 0.00 23.12 22.03 2qki s ALA 306 CO 0.03 0.22 -0.03 0.99 0.00 0.00 0.00 175.76 176.97 2qki s THR 307 N 0.44 3.58 -0.15 0.00 2.01 0.16 -1.01 115.64 120.67 2qki s THR 307 Ca -0.15 -0.43 -0.03 0.00 0.31 0.00 0.00 61.69 61.39 2qki s THR 307 Cb -0.17 -2.63 -0.03 0.00 0.01 0.00 0.00 72.50 69.68 2qki s THR 307 CO 0.06 0.42 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.69 2qki s VAL 308 N 1.36 3.98 -0.12 3.82 1.01 -0.28 -0.35 120.40 129.81 2qki s VAL 308 Ca 0.04 -0.33 0.03 0.00 0.00 0.00 0.00 61.98 61.72 2qki s VAL 308 Cb -0.14 -2.73 0.00 0.00 0.00 0.00 0.00 36.38 33.51 2qki s VAL 308 CO -0.01 0.51 -0.22 -0.63 0.00 0.00 0.00 175.10 174.75 2qki s ILE 309 N 0.18 2.14 0.67 2.22 1.01 0.24 -1.76 121.20 125.90 2qki s ILE 309 Ca -0.01 -0.97 -0.15 0.00 0.00 0.00 0.00 60.65 59.51 2qki s ILE 309 Cb -0.14 -1.84 0.00 0.00 0.01 0.00 0.00 42.46 40.50 2qki s ILE 309 CO 0.03 0.55 1.14 -0.76 0.00 0.00 0.00 174.94 175.90 2qki s LEU 310 N 0.58 3.41 0.53 2.97 1.43 -1.06 -1.02 118.68 125.52 2qki s LEU 310 Ca -0.13 2.12 0.29 0.00 -1.03 0.00 0.00 54.13 55.38 2qki s LEU 310 Cb -0.17 -4.56 1.49 0.00 0.03 0.00 0.00 46.19 42.98 2qki s LEU 310 CO 0.03 -1.76 2.07 0.45 0.23 0.00 0.00 176.35 177.38 2qki h HIS 311 N 0.07 0.00 0.00 0.29 3.86 -1.90 0.15 115.15 117.62 2qki h HIS 311 Ca -0.47 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 58.71 2qki h HIS 311 Cb 1.26 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.73 2qki h HIS 311 CO 0.52 0.10 -0.12 0.66 0.86 0.00 0.00 177.93 179.96 2qki h SER 312 N 0.00 0.00 -0.43 2.45 4.64 -1.91 -3.46 113.55 114.83 2qki h SER 312 Ca -0.00 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.13 2qki h SER 312 Cb 0.35 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.36 2qki h SER 312 CO 0.01 0.12 -0.17 0.61 -0.87 0.00 0.00 176.83 176.53 2qki n GLY 313 N -0.13 0.98 0.08 -0.77 0.00 0.51 -4.83 105.19 101.02 2qki n GLY 313 Ca -0.00 -0.16 0.08 0.00 0.00 0.00 0.00 46.02 45.94 2qki n GLY 313 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2qki n SER 314 N -0.64 0.59 -4.06 1.61 7.64 -1.26 -4.95 113.62 112.55 2qki n SER 314 Ca -0.09 0.24 -0.08 0.00 1.01 0.00 0.00 58.87 59.94 2qki n SER 314 Cb 0.46 0.83 -0.10 0.00 -1.01 0.00 0.00 64.21 64.38 2qki n SER 314 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2qki s ASP 315 N -5.22 0.46 -0.29 6.43 2.15 -1.26 -5.09 116.67 113.86 2qki s ASP 315 Ca -0.03 -0.82 -0.14 0.00 0.43 0.00 0.00 52.55 51.98 2qki s ASP 315 Cb 0.10 0.16 0.10 0.00 -0.30 0.00 0.00 42.92 42.98 2qki s ASP 315 CO 0.83 -0.48 0.71 -0.32 -0.17 0.00 0.00 175.17 175.74 2qki s MET 316 N -3.03 0.64 -0.03 4.34 -2.45 -1.26 -2.58 119.30 114.94 2qki s MET 316 Ca -0.01 1.23 0.02 0.00 -1.25 0.00 0.00 55.69 55.68 2qki s MET 316 Cb 0.01 0.34 0.01 0.00 1.25 0.00 0.00 34.83 36.44 2qki s MET 316 CO -0.06 -0.16 -0.06 0.08 1.05 0.00 0.00 175.02 175.87 2qki s VAL 317 N 1.97 0.55 -0.12 10.11 1.01 -0.73 -5.00 120.40 128.19 2qki s VAL 317 Ca -0.09 -0.20 -0.02 0.00 0.00 0.00 0.00 61.98 61.66 2qki s VAL 317 Cb -0.07 -0.52 -0.03 0.00 0.00 0.00 0.00 36.38 35.76 2qki s VAL 317 CO -0.19 0.20 -0.03 -1.58 0.00 0.00 0.00 175.10 173.49 2qki s GLN 318 N 0.43 3.36 0.09 2.72 -0.44 -1.26 -1.13 119.66 123.43 2qki s GLN 318 Ca -0.06 -0.50 0.03 0.00 -2.50 0.00 0.00 55.36 52.33 2qki s GLN 318 Cb -0.09 -2.83 -0.04 0.00 -1.64 0.00 0.00 33.01 28.41 2qki s GLN 318 CO 0.00 0.42 -0.09 0.00 0.50 0.00 0.00 175.29 176.12 2qki s ALA 319 N -0.12 1.04 -0.00 1.58 0.00 -0.18 -4.99 121.76 119.08 2qki s ALA 319 Ca 0.03 -1.21 0.01 0.00 0.00 0.00 0.00 51.96 50.79 2qki s ALA 319 Cb -0.13 0.07 -0.00 0.00 0.00 0.00 0.00 23.12 23.06 2qki s ALA 319 CO 0.02 -0.10 -0.04 -2.00 0.00 0.00 0.00 175.76 173.65 2qki s GLU 320 N -3.03 0.34 -0.20 0.00 2.12 -1.26 -0.49 118.70 116.18 2qki s GLU 320 Ca 0.06 -0.15 -0.01 0.00 0.36 0.00 0.00 54.97 55.24 2qki s GLU 320 Cb -0.01 -0.33 0.01 0.00 0.26 0.00 0.00 34.13 34.06 2qki s GLU 320 CO -0.01 0.09 -0.13 0.50 -0.54 0.00 0.00 175.26 175.17 2qki s ARG 321 N -0.08 3.08 0.47 4.30 6.06 -0.10 -4.92 118.95 127.77 2qki s ARG 321 Ca 0.01 -0.79 0.00 0.00 -2.50 0.00 0.00 55.73 52.45 2qki s ARG 321 Cb -0.02 -2.78 -0.00 0.00 0.06 0.00 0.00 34.95 32.21 2qki s ARG 321 CO -0.00 -0.24 0.00 -1.13 -2.50 0.00 0.00 175.30 171.43 2qki n SER 322 N 4.68 3.25 -3.52 -2.12 3.41 -1.26 -0.03 113.62 118.03 2qki n SER 322 Ca -0.19 -3.08 -0.24 0.00 -0.26 0.00 0.00 58.87 55.10 2qki n SER 322 Cb 0.50 0.35 0.07 0.00 -0.26 0.00 0.00 64.21 64.87 2qki n SER 322 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qki n GLY 323 N -0.66 -0.54 3.53 5.00 0.00 -1.18 -4.94 105.19 106.41 2qki n GLY 323 Ca -0.19 0.23 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 2qki n GLY 323 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qki s ILE 324 N -3.29 4.16 0.35 -0.61 1.01 -0.65 -4.89 121.20 117.27 2qki s ILE 324 Ca 0.55 0.40 -0.28 0.00 0.00 0.00 0.00 60.65 61.32 2qki s ILE 324 Cb -0.24 -4.68 -0.10 0.00 0.01 0.00 0.00 42.46 37.45 2qki s ILE 324 CO 0.67 -1.35 1.26 -2.84 0.00 0.00 0.00 174.94 172.68 2qki s PRO 325 N 4.56 4.27 -0.25 2.79 0.02 -1.26 -0.10 135.00 145.03 2qki s PRO 325 Ca 0.34 2.10 -0.14 0.00 0.02 0.00 0.00 61.00 63.31 2qki s PRO 325 Cb -0.11 -2.96 -0.04 0.00 0.02 0.00 0.00 34.50 31.41 2qki s PRO 325 CO 0.19 -0.22 0.33 0.42 -0.33 0.00 0.00 177.00 177.39 2qki s ILE 326 N -1.21 5.22 0.05 2.83 1.01 -0.34 0.70 121.20 129.46 2qki s ILE 326 Ca 0.51 0.50 -0.01 0.00 0.00 0.00 0.00 60.65 61.66 2qki s ILE 326 Cb -0.37 -3.66 -0.04 0.00 0.01 0.00 0.00 42.46 38.40 2qki s ILE 326 CO 0.48 0.22 -0.03 0.68 0.00 0.00 0.00 174.94 176.29 2qki s VAL 327 N 1.70 0.22 -2.66 2.92 -7.23 0.08 -1.92 120.40 113.52 2qki s VAL 327 Ca 0.14 -1.66 0.23 0.00 -1.81 0.00 0.00 61.98 58.88 2qki s VAL 327 Cb -0.15 -1.31 0.13 0.00 0.56 0.00 0.00 36.38 35.60 2qki s VAL 327 CO 0.09 -0.91 1.19 0.35 -0.31 0.00 0.00 175.10 175.51 2qki n THR 328 N 0.36 0.00 -3.81 5.32 -2.24 -1.26 -1.93 114.28 110.71 2qki n THR 328 Ca -0.16 -0.43 -0.12 0.00 -2.27 0.00 0.00 64.05 61.07 2qki n THR 328 Cb 0.60 1.42 -0.12 0.00 -2.10 0.00 0.00 70.33 70.13 2qki n THR 328 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2qki s SER 329 N -2.10 -0.17 0.39 3.42 0.15 -1.26 -4.30 113.70 109.82 2qki s SER 329 Ca 0.25 0.28 0.27 0.00 0.70 0.00 0.00 55.95 57.45 2qki s SER 329 Cb 0.19 0.37 0.85 0.00 -1.71 0.00 0.00 66.02 65.72 2qki s SER 329 CO 0.37 -0.14 1.77 -0.65 1.20 0.00 0.00 173.24 175.80 2qki h PRO 330 N 5.48 0.00 -5.73 5.44 0.11 -1.94 -3.47 132.00 131.90 2qki h PRO 330 Ca -0.26 0.00 -0.54 0.00 0.11 0.00 0.00 66.00 65.30 2qki h PRO 330 Cb 1.19 0.00 -0.14 0.00 0.11 0.00 0.00 31.00 32.17 2qki h PRO 330 CO 0.39 0.00 -0.69 0.71 -0.21 0.00 0.00 178.00 178.20 2qki s TYR 331 N -3.33 2.11 0.02 0.65 2.02 -1.26 -3.65 117.35 113.90 2qki s TYR 331 Ca 0.06 -0.58 0.02 0.00 -0.37 0.00 0.00 57.07 56.19 2qki s TYR 331 Cb 0.09 -1.15 -0.02 0.00 -0.40 0.00 0.00 41.96 40.48 2qki s TYR 331 CO 0.57 0.43 -0.06 -0.65 -1.57 0.00 0.00 175.55 174.27 2qki s GLN 332 N -3.66 0.42 -0.18 -0.62 -0.21 -0.83 -4.64 119.66 109.95 2qki s GLN 332 Ca 0.30 -0.50 -0.01 0.00 0.02 0.00 0.00 55.36 55.17 2qki s GLN 332 Cb 0.02 -0.25 -0.00 0.00 1.00 0.00 0.00 33.01 33.78 2qki s GLN 332 CO 0.13 0.05 -0.12 0.42 -2.12 0.00 0.00 175.29 173.65 2qki s ILE 333 N -0.89 2.88 -0.09 1.08 1.01 -1.26 -1.02 121.20 122.91 2qki s ILE 333 Ca -0.06 -0.68 0.04 0.00 0.00 0.00 0.00 60.65 59.95 2qki s ILE 333 Cb -0.07 -2.25 -0.01 0.00 0.01 0.00 0.00 42.46 40.15 2qki s ILE 333 CO -0.00 0.49 -0.23 -1.00 0.00 0.00 0.00 174.94 174.20 2qki s HIS 334 N 1.02 2.54 -0.35 3.97 3.76 0.14 -4.82 115.29 121.56 2qki s HIS 334 Ca -0.01 -0.90 0.09 0.00 -0.15 0.00 0.00 55.06 54.09 2qki s HIS 334 Cb -0.15 -1.68 0.74 0.00 1.11 0.00 0.00 32.58 32.60 2qki s HIS 334 CO -0.02 -0.33 1.83 1.19 -0.85 0.00 0.00 174.74 176.57 2qki n PHE 335 N 3.31 2.58 0.19 1.40 3.72 -1.26 -1.65 117.46 125.75 2qki n PHE 335 Ca -0.18 -1.31 0.04 0.00 -0.05 0.00 0.00 57.45 55.95 2qki n PHE 335 Cb 0.53 -0.74 0.36 0.00 -0.94 0.00 0.00 39.48 38.69 2qki n PHE 335 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 176.76 178.50 2qki h THR 336 N 2.43 1.06 -0.37 4.37 1.35 -1.94 -2.14 112.91 117.68 2qki h THR 336 Ca 0.33 -1.42 0.00 0.00 -0.55 0.00 0.00 66.41 64.77 2qki h THR 336 Cb 2.44 1.81 0.00 0.00 -1.73 0.00 0.00 68.15 70.67 2qki h THR 336 CO 0.81 0.38 0.00 0.29 -0.25 0.00 0.00 175.52 176.74 2qki n LYS 337 N -3.78 3.61 -3.68 4.72 4.76 -1.26 -4.70 118.16 117.84 2qki n LYS 337 Ca -0.01 -2.96 -0.36 0.00 -2.87 0.00 0.00 58.31 52.11 2qki n LYS 337 Cb 0.46 -1.99 -0.09 0.00 -1.84 0.00 0.00 35.03 31.57 2qki n LYS 337 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 2qki s THR 338 N -2.80 5.38 0.49 -0.18 2.01 -0.81 -4.48 115.64 115.26 2qki s THR 338 Ca 0.47 0.22 -0.22 0.00 0.31 0.00 0.00 61.69 62.46 2qki s THR 338 Cb 0.37 -3.50 -0.08 0.00 0.01 0.00 0.00 72.50 69.30 2qki s THR 338 CO 0.11 0.39 1.01 -2.65 -0.69 0.00 0.00 174.62 172.80 2qki n PRO 339 N 3.88 1.23 -0.71 4.92 -0.02 -1.26 -4.78 135.00 138.26 2qki n PRO 339 Ca -0.15 0.45 0.09 0.00 -2.02 0.00 0.00 63.50 61.87 2qki n PRO 339 Cb 0.52 -2.13 0.37 0.00 -0.02 0.00 0.00 33.50 32.25 2qki n PRO 339 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2qki n LYS 340 N -0.31 4.13 -4.19 -0.52 4.76 -1.26 -4.87 118.16 115.90 2qki n LYS 340 Ca 0.11 -2.99 -0.16 0.00 -2.87 0.00 0.00 58.31 52.39 2qki n LYS 340 Cb 0.43 -2.02 -0.15 0.00 -1.84 0.00 0.00 35.03 31.45 2qki n LYS 340 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 2qki s TYR 341 N -2.21 0.53 0.30 2.13 2.02 -1.26 -1.59 117.35 117.27 2qki s TYR 341 Ca 0.52 -0.10 0.08 0.00 -0.37 0.00 0.00 57.07 57.20 2qki s TYR 341 Cb 0.36 -0.35 -0.06 0.00 -0.40 0.00 0.00 41.96 41.51 2qki s TYR 341 CO 0.21 -0.02 -0.10 -0.59 -1.57 0.00 0.00 175.55 173.49 2qki s PHE 342 N -0.09 2.15 -0.39 2.71 -0.12 -0.27 -4.86 117.98 117.11 2qki s PHE 342 Ca 0.02 -0.56 -0.07 0.00 -0.05 0.00 0.00 56.93 56.26 2qki s PHE 342 Cb -0.03 -1.17 0.07 0.00 -0.63 0.00 0.00 43.02 41.26 2qki s PHE 342 CO -0.00 0.46 0.21 0.15 -0.05 0.00 0.00 175.22 175.98 2qki s LYS 343 N -3.65 2.50 0.12 1.99 3.01 -1.26 -0.50 119.74 121.95 2qki s LYS 343 Ca 0.30 -1.45 -0.35 0.00 -1.01 0.00 0.00 55.97 53.46 2qki s LYS 343 Cb 0.02 -3.65 -0.16 0.00 -1.01 0.00 0.00 37.83 33.03 2qki s LYS 343 CO 0.14 -0.90 1.42 -2.30 0.51 0.00 0.00 175.35 174.22 2qki n PRO 344 N 4.83 1.53 0.00 -1.68 -0.02 -1.26 -0.95 135.00 137.45 2qki n PRO 344 Ca -0.09 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 61.94 2qki n PRO 344 Cb 0.43 -2.23 0.00 0.00 -0.02 0.00 0.00 33.50 31.68 2qki n PRO 344 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qki n GLY 345 N 2.81 2.13 3.68 -1.23 0.00 -1.17 -4.67 105.19 106.75 2qki n GLY 345 Ca 0.18 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.96 2qki n GLY 345 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2qki s MET 346 N -0.88 2.30 0.46 1.61 -1.94 -0.12 -4.75 119.30 115.98 2qki s MET 346 Ca 0.00 -1.54 -0.25 0.00 -1.71 0.00 0.00 55.69 52.20 2qki s MET 346 Cb 0.00 -2.13 -0.08 0.00 2.01 0.00 0.00 34.83 34.63 2qki s MET 346 CO 0.00 0.21 1.43 -2.30 -0.01 0.00 0.00 175.02 174.35 2qki n PRO 347 N -1.03 2.22 -3.95 2.03 -0.02 -1.26 -2.57 135.00 130.42 2qki n PRO 347 Ca -0.04 0.79 -0.35 0.00 -2.02 0.00 0.00 63.50 61.88 2qki n PRO 347 Cb 0.61 -2.63 -0.14 0.00 -0.02 0.00 0.00 33.50 31.31 2qki n PRO 347 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 2qki s PHE 348 N -1.20 3.01 -0.08 6.00 5.36 0.17 -4.73 117.98 126.51 2qki s PHE 348 Ca 0.62 -1.35 -0.17 0.00 -0.96 0.00 0.00 56.93 55.08 2qki s PHE 348 Cb -0.44 -2.07 -0.05 0.00 -0.34 0.00 0.00 43.02 40.12 2qki s PHE 348 CO 0.57 -0.67 0.44 -0.51 -1.46 0.00 0.00 175.22 173.59 2qki s ASP 349 N 1.38 6.71 -0.20 6.13 1.01 -1.26 -1.24 116.67 129.20 2qki s ASP 349 Ca 0.02 0.84 -0.02 0.00 0.71 0.00 0.00 52.55 54.11 2qki s ASP 349 Cb -0.16 -2.27 0.00 0.00 1.01 0.00 0.00 42.92 41.51 2qki s ASP 349 CO -0.05 0.11 -0.11 -0.76 0.21 0.00 0.00 175.17 174.58 2qki s LEU 350 N 0.09 2.62 -0.52 1.23 1.02 0.21 -4.66 118.68 118.67 2qki s LEU 350 Ca 0.24 -0.47 -0.20 0.00 0.02 0.00 0.00 54.13 53.73 2qki s LEU 350 Cb -0.15 -1.64 0.06 0.00 0.02 0.00 0.00 46.19 44.48 2qki s LEU 350 CO 0.11 0.01 0.69 -0.32 0.02 0.00 0.00 176.35 176.85 2qki s MET 351 N 1.28 3.15 -0.13 1.70 1.75 -1.26 -1.22 119.30 124.56 2qki s MET 351 Ca 0.03 -0.82 -0.10 0.00 -1.25 0.00 0.00 55.69 53.56 2qki s MET 351 Cb -0.14 -4.10 -0.05 0.00 2.84 0.00 0.00 34.83 33.38 2qki s MET 351 CO -0.05 -1.29 0.19 0.14 -0.65 0.00 0.00 175.02 173.35 2qki s VAL 352 N 2.86 5.40 -0.19 10.11 -7.23 0.23 -3.96 120.40 127.63 2qki s VAL 352 Ca 0.17 0.32 -0.02 0.00 -1.81 0.00 0.00 61.98 60.64 2qki s VAL 352 Cb -0.18 -3.48 -0.00 0.00 0.56 0.00 0.00 36.38 33.27 2qki s VAL 352 CO 0.13 0.53 -0.10 0.12 -0.31 0.00 0.00 175.10 175.47 2qki s PHE 353 N -0.44 2.88 -0.16 2.82 5.36 -0.66 -0.90 117.98 126.87 2qki s PHE 353 Ca 0.14 -1.09 -0.00 0.00 -0.96 0.00 0.00 56.93 55.02 2qki s PHE 353 Cb -0.12 -2.00 -0.00 0.00 -0.34 0.00 0.00 43.02 40.55 2qki s PHE 353 CO 0.03 -0.56 -0.14 0.08 -1.46 0.00 0.00 175.22 173.17 2qki s VAL 354 N 1.22 2.73 0.31 3.12 1.01 -0.18 0.29 120.40 128.90 2qki s VAL 354 Ca 0.02 -0.74 0.08 0.00 0.00 0.00 0.00 61.98 61.35 2qki s VAL 354 Cb -0.14 -2.16 -0.04 0.00 0.00 0.00 0.00 36.38 34.03 2qki s VAL 354 CO -0.04 0.51 0.12 0.42 0.00 0.00 0.00 175.10 176.10 2qki s THR 355 N 0.89 3.30 0.62 3.92 -4.23 -0.19 -0.84 115.64 119.11 2qki s THR 355 Ca -0.04 -1.71 -0.10 0.00 -1.18 0.00 0.00 61.69 58.67 2qki s THR 355 Cb -0.15 -2.99 -0.02 0.00 1.34 0.00 0.00 72.50 70.67 2qki s THR 355 CO -0.01 -0.25 1.00 0.20 -0.54 0.00 0.00 174.62 175.02 2qki s ASN 356 N -3.81 5.99 0.14 3.99 0.01 0.13 -1.96 114.94 119.42 2qki s ASN 356 Ca 0.36 1.21 0.09 0.00 -0.71 0.00 0.00 52.86 53.81 2qki s ASN 356 Cb -0.04 -2.24 0.47 0.00 0.41 0.00 0.00 41.25 39.85 2qki s ASN 356 CO 0.22 -0.96 1.24 -2.65 -1.51 0.00 0.00 177.10 173.45 2qki n PRO 357 N -2.72 0.06 -0.22 -0.60 -0.02 -1.24 -0.28 135.00 129.97 2qki n PRO 357 Ca 0.05 0.54 0.08 0.00 -2.02 0.00 0.00 63.50 62.15 2qki n PRO 357 Cb 0.55 -1.72 0.22 0.00 -0.02 0.00 0.00 33.50 32.54 2qki n PRO 357 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2qki n ASP 358 N -1.79 2.50 0.00 2.55 5.75 -1.26 -4.82 116.55 119.48 2qki n ASP 358 Ca -0.01 -1.97 0.00 0.00 -0.01 0.00 0.00 54.79 52.80 2qki n ASP 358 Cb 0.05 -0.30 0.00 0.00 -1.03 0.00 0.00 41.12 39.84 2qki n ASP 358 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2qki n GLY 359 N 1.25 1.38 3.79 6.12 0.00 0.62 -5.03 105.19 113.33 2qki n GLY 359 Ca 0.16 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.82 2qki n GLY 359 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2qki s SER 360 N -3.20 7.00 0.16 1.61 1.04 -1.25 -4.79 113.70 114.28 2qki s SER 360 Ca 0.00 1.90 -0.34 0.00 0.48 0.00 0.00 55.95 57.99 2qki s SER 360 Cb 0.00 -2.58 -0.14 0.00 0.10 0.00 0.00 66.02 63.40 2qki s SER 360 CO 0.00 -0.32 1.49 -0.81 0.98 0.00 0.00 173.24 174.58 2qki n PRO 361 N 0.06 1.89 -3.61 4.02 -0.04 -1.26 0.20 135.00 136.25 2qki n PRO 361 Ca 0.04 0.68 -0.37 0.00 -0.04 0.00 0.00 63.50 63.81 2qki n PRO 361 Cb 0.51 -2.39 -0.09 0.00 -0.04 0.00 0.00 33.50 31.48 2qki n PRO 361 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2qki s ALA 362 N 0.63 3.60 -0.10 0.55 0.00 -0.02 -4.60 121.76 121.82 2qki s ALA 362 Ca 0.78 -0.85 -0.07 0.00 0.00 0.00 0.00 51.96 51.82 2qki s ALA 362 Cb -0.74 -2.39 -0.04 0.00 0.00 0.00 0.00 23.12 19.95 2qki s ALA 362 CO 0.42 -0.24 0.16 -0.47 0.00 0.00 0.00 175.76 175.63 2qki s TYR 363 N 1.17 3.60 -1.39 0.00 5.04 -1.26 -4.12 117.35 120.39 2qki s TYR 363 Ca 0.09 0.54 -0.00 0.00 -2.44 0.00 0.00 57.07 55.26 2qki s TYR 363 Cb -0.14 -1.95 0.00 0.00 0.35 0.00 0.00 41.96 40.23 2qki s TYR 363 CO 0.06 0.72 0.03 -2.13 -1.34 0.00 0.00 175.55 172.89 2qki n ARG 364 N 1.85 -1.49 -3.37 4.97 3.00 -0.18 -4.96 116.66 116.48 2qki n ARG 364 Ca -0.19 0.79 -0.38 0.00 -0.00 0.00 0.00 57.85 58.08 2qki n ARG 364 Cb 0.55 -5.20 -0.06 0.00 0.00 0.00 0.00 32.46 27.74 2qki n ARG 364 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 2qki s VAL 365 N -2.83 5.22 0.21 5.15 1.01 -1.26 -4.75 120.40 123.15 2qki s VAL 365 Ca 0.02 0.85 -0.30 0.00 0.00 0.00 0.00 61.98 62.55 2qki s VAL 365 Cb -0.01 -3.77 -0.08 0.00 0.00 0.00 0.00 36.38 32.52 2qki s VAL 365 CO 0.02 0.34 1.01 -2.84 0.00 0.00 0.00 175.10 173.63 2qki s PRO 366 N 0.62 4.73 0.11 2.72 0.02 -1.26 -1.35 135.00 140.59 2qki s PRO 366 Ca 0.23 1.60 0.05 0.00 0.02 0.00 0.00 61.00 62.90 2qki s PRO 366 Cb -0.15 -3.28 -0.04 0.00 0.02 0.00 0.00 34.50 31.06 2qki s PRO 366 CO 0.09 0.31 -0.13 0.14 -0.33 0.00 0.00 177.00 177.07 2qki s VAL 367 N -0.77 1.19 -0.02 3.83 -7.23 0.79 -0.38 120.40 117.81 2qki s VAL 367 Ca 0.44 -1.63 -0.16 0.00 -1.81 0.00 0.00 61.98 58.83 2qki s VAL 367 Cb -0.27 -1.41 0.03 0.00 0.56 0.00 0.00 36.38 35.28 2qki s VAL 367 CO 0.34 -0.42 0.34 0.00 -0.31 0.00 0.00 175.10 175.05 2qki s ALA 368 N -2.08 -0.86 -0.09 1.32 0.00 -0.75 -1.24 121.76 118.07 2qki s ALA 368 Ca 0.06 0.43 -0.30 0.00 0.00 0.00 0.00 51.96 52.15 2qki s ALA 368 Cb -0.05 0.04 -0.03 0.00 0.00 0.00 0.00 23.12 23.08 2qki s ALA 368 CO 0.02 -0.26 1.19 0.08 0.00 0.00 0.00 175.76 176.79 2qki s VAL 369 N -1.24 4.32 0.42 0.00 1.01 -1.26 -1.55 120.40 122.09 2qki s VAL 369 Ca -0.13 1.63 -0.24 0.00 0.00 0.00 0.00 61.98 63.24 2qki s VAL 369 Cb -0.05 -4.05 -0.08 0.00 0.00 0.00 0.00 36.38 32.20 2qki s VAL 369 CO 0.04 -0.03 1.10 0.00 0.00 0.00 0.00 175.10 176.21 2qki s GLN 370 N 2.48 4.03 0.00 2.72 -2.07 0.76 -1.79 119.66 125.80 2qki s GLN 370 Ca 0.55 1.63 0.00 0.00 -1.82 0.00 0.00 55.36 55.72 2qki s GLN 370 Cb -0.23 -2.52 0.00 0.00 -1.09 0.00 0.00 33.01 29.16 2qki s GLN 370 CO 0.20 -0.28 0.00 0.41 -1.32 0.00 0.00 175.29 174.29 2qki n GLY 371 N 0.41 2.22 2.55 2.60 0.00 -1.26 -4.62 105.19 107.09 2qki n GLY 371 Ca 0.06 -0.40 -0.34 0.00 0.00 0.00 0.00 46.02 45.34 2qki n GLY 371 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2qki n GLU 372 N 0.00 3.02 0.00 1.61 1.02 -1.21 -4.99 120.64 120.09 2qki n GLU 372 Ca 0.00 -3.79 0.00 0.00 -0.02 0.00 0.00 57.16 53.35 2qki n GLU 372 Cb 0.00 -2.27 0.00 0.00 -0.02 0.00 0.00 31.44 29.15 2qki n GLU 372 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2qki n ASP 373 N -0.64 0.00 0.00 1.62 9.92 -0.74 -4.46 116.55 122.26 2qki n ASP 373 Ca 0.51 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.77 2qki n ASP 373 Cb 0.53 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.01 2qki n ASP 373 CO 0.00 0.00 0.00 1.07 0.13 0.00 0.00 177.20 178.40 2qki n THR 374 N 0.00 0.00 0.03 -3.53 5.66 -1.26 -4.04 114.28 111.14 2qki n THR 374 Ca 0.00 0.00 -0.03 0.00 -3.05 0.00 0.00 64.05 60.97 2qki n THR 374 Cb 0.00 0.00 -0.02 0.00 -1.55 0.00 0.00 70.33 68.76 2qki n THR 374 CO 0.00 0.00 0.00 -0.37 -3.05 0.00 0.00 175.07 171.65 2qki h VAL 375 N 0.00 0.00 -3.39 1.08 -1.51 -1.94 -3.49 116.25 106.99 2qki h VAL 375 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.47 2qki h VAL 375 Cb 0.00 0.00 0.00 0.00 -2.13 0.00 0.00 31.29 29.16 2qki h VAL 375 CO 0.00 0.00 -0.83 0.00 -1.23 0.00 0.00 177.57 175.51 2qki n GLN 376 N -3.05 -4.18 -3.84 5.19 6.02 -1.26 -5.09 117.38 111.17 2qki n GLN 376 Ca -0.02 3.12 -0.12 0.00 -0.01 0.00 0.00 57.00 59.97 2qki n GLN 376 Cb 0.09 -3.51 -0.09 0.00 1.02 0.00 0.00 30.24 27.74 2qki n GLN 376 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2qki s SER 377 N -3.33 -0.03 -0.13 1.08 0.15 -0.37 -4.95 113.70 106.12 2qki s SER 377 Ca 0.00 -0.14 -0.04 0.00 0.70 0.00 0.00 55.95 56.47 2qki s SER 377 Cb 0.00 0.23 -0.03 0.00 -1.71 0.00 0.00 66.02 64.51 2qki s SER 377 CO 0.00 -0.40 0.00 -0.76 1.20 0.00 0.00 173.24 173.28 2qki s LEU 378 N -1.40 3.51 0.36 3.45 2.01 -1.26 -0.15 118.68 125.20 2qki s LEU 378 Ca -0.14 0.03 -0.27 0.00 0.01 0.00 0.00 54.13 53.76 2qki s LEU 378 Cb -0.07 -1.84 -0.09 0.00 0.01 0.00 0.00 46.19 44.20 2qki s LEU 378 CO 0.02 0.26 1.25 0.42 1.01 0.00 0.00 176.35 179.31 2qki s THR 379 N -0.17 2.88 0.40 5.49 -4.23 -0.46 -4.66 115.64 114.90 2qki s THR 379 Ca 0.05 0.83 -0.04 0.00 -1.18 0.00 0.00 61.69 61.34 2qki s THR 379 Cb -0.13 -3.50 0.09 0.00 1.34 0.00 0.00 72.50 70.30 2qki s THR 379 CO 0.02 0.15 0.55 0.00 -0.54 0.00 0.00 174.62 174.80 2qki n GLN 380 N 0.52 -0.18 -0.23 3.99 1.13 0.08 -1.01 117.38 121.67 2qki n GLN 380 Ca 0.02 -1.12 0.08 0.00 -1.94 0.00 0.00 57.00 54.03 2qki n GLN 380 Cb 0.44 -0.48 0.34 0.00 0.11 0.00 0.00 30.24 30.64 2qki n GLN 380 CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 2qki h GLY 381 N -0.56 1.10 -0.45 1.08 0.00 -1.91 0.11 103.07 102.44 2qki h GLY 381 Ca -0.18 -0.32 0.00 0.00 0.00 0.00 0.00 47.33 46.83 2qki h GLY 381 CO 0.15 0.20 0.00 2.09 0.00 0.00 0.00 176.54 178.98 2qki n ASP 382 N -4.50 0.64 -0.01 0.19 5.75 -1.26 -4.71 116.55 112.65 2qki n ASP 382 Ca 0.13 -2.01 -0.00 0.00 -0.01 0.00 0.00 54.79 52.90 2qki n ASP 382 Cb 0.30 -0.10 -0.00 0.00 -1.03 0.00 0.00 41.12 40.29 2qki n ASP 382 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2qki n GLY 383 N 0.64 0.47 3.65 6.12 0.00 0.39 -4.84 105.19 111.63 2qki n GLY 383 Ca 0.04 -0.18 -0.32 0.00 0.00 0.00 0.00 46.02 45.56 2qki n GLY 383 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2qki s VAL 384 N -1.97 3.96 0.04 1.61 -7.23 -1.25 -1.01 120.40 114.54 2qki s VAL 384 Ca 0.00 -0.67 0.05 0.00 -1.81 0.00 0.00 61.98 59.55 2qki s VAL 384 Cb 0.00 -2.75 -0.02 0.00 0.56 0.00 0.00 36.38 34.17 2qki s VAL 384 CO 0.00 0.38 -0.14 0.00 -0.31 0.00 0.00 175.10 175.03 2qki s ALA 385 N -1.05 1.20 -0.26 1.32 0.00 -0.08 -0.74 121.76 122.15 2qki s ALA 385 Ca 0.19 -0.84 -0.10 0.00 0.00 0.00 0.00 51.96 51.21 2qki s ALA 385 Cb -0.11 -0.19 -0.04 0.00 0.00 0.00 0.00 23.12 22.78 2qki s ALA 385 CO 0.09 0.23 0.14 0.21 0.00 0.00 0.00 175.76 176.43 2qki s LYS 386 N -1.15 3.89 0.19 0.00 2.20 -1.26 -0.60 119.74 123.01 2qki s LYS 386 Ca 0.02 -0.36 0.09 0.00 -0.36 0.00 0.00 55.97 55.36 2qki s LYS 386 Cb -0.08 -3.51 -0.04 0.00 -1.51 0.00 0.00 37.83 32.69 2qki s LYS 386 CO 0.01 -0.11 -0.06 -0.51 -0.36 0.00 0.00 175.35 174.32 2qki s LEU 387 N 1.50 3.08 -0.01 5.43 1.43 -0.36 -4.87 118.68 124.88 2qki s LEU 387 Ca 0.07 -0.55 -0.00 0.00 -1.03 0.00 0.00 54.13 52.61 2qki s LEU 387 Cb -0.15 -1.73 0.00 0.00 0.03 0.00 0.00 46.19 44.35 2qki s LEU 387 CO 0.07 0.08 0.02 -0.44 0.23 0.00 0.00 176.35 176.31 2qki s SER 388 N -2.99 -0.01 -0.03 2.29 0.01 -1.26 -0.62 113.70 111.09 2qki s SER 388 Ca 0.26 0.03 0.04 0.00 1.31 0.00 0.00 55.95 57.59 2qki s SER 388 Cb -0.08 0.02 -0.00 0.00 0.21 0.00 0.00 66.02 66.17 2qki s SER 388 CO 0.17 -0.01 -0.13 0.27 0.41 0.00 0.00 173.24 173.94 2qki s ILE 389 N 0.09 1.14 -0.61 1.44 -4.36 -0.37 -4.98 121.20 113.55 2qki s ILE 389 Ca -0.01 -0.56 -0.24 0.00 -0.26 0.00 0.00 60.65 59.58 2qki s ILE 389 Cb -0.01 -0.99 0.05 0.00 1.25 0.00 0.00 42.46 42.76 2qki s ILE 389 CO -0.00 0.34 1.02 0.20 0.24 0.00 0.00 174.94 176.74 2qki s ASN 390 N 0.10 6.27 0.26 4.36 0.02 -1.26 -0.66 114.94 124.04 2qki s ASN 390 Ca -0.03 -0.51 -0.30 0.00 -1.02 0.00 0.00 52.86 51.01 2qki s ASN 390 Cb -0.10 -2.46 -0.09 0.00 0.02 0.00 0.00 41.25 38.62 2qki s ASN 390 CO 0.01 -1.41 1.08 0.42 0.02 0.00 0.00 177.10 177.23 2qki s THR 391 N 4.35 3.59 0.42 1.60 -4.23 -1.06 -4.98 115.64 115.32 2qki s THR 391 Ca 0.30 1.57 -0.19 0.00 -1.18 0.00 0.00 61.69 62.19 2qki s THR 391 Cb -0.13 -4.00 -0.10 0.00 1.34 0.00 0.00 72.50 69.61 2qki s THR 391 CO 0.17 0.36 0.91 -1.00 -0.54 0.00 0.00 174.62 174.52 2qki s HIS 392 N -1.05 3.33 -1.43 3.99 3.76 -1.26 -3.04 115.29 119.60 2qki s HIS 392 Ca 0.45 1.52 -0.14 0.00 -0.15 0.00 0.00 55.06 56.73 2qki s HIS 392 Cb -0.31 -2.78 0.05 0.00 1.11 0.00 0.00 32.58 30.65 2qki s HIS 392 CO 0.39 -0.09 2.13 -0.35 -0.85 0.00 0.00 174.74 175.97 2qki n PRO 393 N -0.67 2.95 -4.55 8.40 -0.04 -1.26 -3.46 135.00 136.36 2qki n PRO 393 Ca 0.06 -2.76 -0.26 0.00 -0.04 0.00 0.00 63.50 60.50 2qki n PRO 393 Cb 0.54 -3.30 -0.11 0.00 -0.04 0.00 0.00 33.50 30.60 2qki n PRO 393 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2qki s SER 394 N 3.22 3.75 -0.04 3.54 1.04 -1.26 -4.85 113.70 119.10 2qki s SER 394 Ca 0.48 -1.21 0.21 0.00 0.48 0.00 0.00 55.95 55.90 2qki s SER 394 Cb 0.12 -0.36 0.65 0.00 0.10 0.00 0.00 66.02 66.54 2qki s SER 394 CO -0.06 -0.23 1.55 1.67 0.98 0.00 0.00 173.24 177.16 2qki n GLN 395 N -0.81 2.99 -2.11 4.02 -0.06 -1.26 -4.69 117.38 115.45 2qki n GLN 395 Ca -0.05 -2.64 -0.42 0.00 -2.00 0.00 0.00 57.00 51.90 2qki n GLN 395 Cb 0.64 -1.66 -0.03 0.00 -4.06 0.00 0.00 30.24 25.13 2qki n GLN 395 CO 0.00 0.00 0.00 0.21 -0.20 0.00 0.00 177.06 177.07 2qki s LYS 396 N -1.31 4.32 0.58 3.69 2.36 -1.26 -4.77 119.74 123.35 2qki s LYS 396 Ca 0.48 2.17 -0.20 0.00 -2.55 0.00 0.00 55.97 55.87 2qki s LYS 396 Cb 0.27 -3.17 -0.05 0.00 -1.05 0.00 0.00 37.83 33.83 2qki s LYS 396 CO 0.30 -0.38 1.18 -2.30 1.55 0.00 0.00 175.35 175.70 2qki n PRO 397 N 2.92 1.28 -3.53 4.03 -0.02 -1.26 -4.80 135.00 133.61 2qki n PRO 397 Ca 0.08 0.48 -0.37 0.00 -2.02 0.00 0.00 63.50 61.67 2qki n PRO 397 Cb 0.41 -2.39 -0.09 0.00 -0.02 0.00 0.00 33.50 31.42 2qki n PRO 397 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2qki s LEU 398 N -2.91 4.13 -0.33 2.45 2.96 0.15 -4.94 118.68 120.18 2qki s LEU 398 Ca 0.75 0.29 -0.07 0.00 -0.22 0.00 0.00 54.13 54.88 2qki s LEU 398 Cb -0.42 -2.29 0.03 0.00 0.50 0.00 0.00 46.19 44.01 2qki s LEU 398 CO 0.47 -0.01 0.10 -0.55 -1.32 0.00 0.00 176.35 175.05 2qki s SER 399 N 1.08 5.27 -0.14 3.68 0.15 -1.26 -0.27 113.70 122.21 2qki s SER 399 Ca 0.13 -1.05 0.01 0.00 0.70 0.00 0.00 55.95 55.74 2qki s SER 399 Cb -0.14 -1.87 -0.00 0.00 -1.71 0.00 0.00 66.02 62.30 2qki s SER 399 CO 0.06 -0.30 -0.17 -0.51 1.20 0.00 0.00 173.24 173.52 2qki s ILE 400 N 1.42 2.55 -0.16 6.45 1.10 -0.21 -5.00 121.20 127.36 2qki s ILE 400 Ca -0.01 -0.82 -0.02 0.00 -0.51 0.00 0.00 60.65 59.29 2qki s ILE 400 Cb -0.19 -2.05 -0.02 0.00 0.15 0.00 0.00 42.46 40.35 2qki s ILE 400 CO 0.03 0.53 -0.08 -0.89 -2.11 0.00 0.00 174.94 172.41 2qki s THR 401 N 0.65 3.39 -0.12 4.00 2.01 -1.26 -1.13 115.64 123.17 2qki s THR 401 Ca -0.09 -0.53 -0.01 0.00 0.31 0.00 0.00 61.69 61.38 2qki s THR 401 Cb -0.16 -2.47 -0.02 0.00 0.01 0.00 0.00 72.50 69.86 2qki s THR 401 CO 0.02 0.49 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.65 2qki s VAL 402 N 0.59 3.31 0.08 3.82 1.01 -0.75 -0.17 120.40 128.28 2qki s VAL 402 Ca -0.05 -0.58 0.09 0.00 0.00 0.00 0.00 61.98 61.44 2qki s VAL 402 Cb -0.15 -2.39 -0.03 0.00 0.00 0.00 0.00 36.38 33.80 2qki s VAL 402 CO 0.03 0.53 -0.25 -0.13 0.00 0.00 0.00 175.10 175.28 2qki s ARG 403 N 0.14 1.49 0.36 2.72 0.52 -0.60 -2.23 118.95 121.36 2qki s ARG 403 Ca -0.05 -1.16 -0.27 0.00 -0.52 0.00 0.00 55.73 53.72 2qki s ARG 403 Cb -0.15 -1.77 -0.10 0.00 0.52 0.00 0.00 34.95 33.46 2qki s ARG 403 CO 0.04 0.44 1.27 0.99 0.02 0.00 0.00 175.30 178.06 2qki s THR 404 N -0.94 2.80 -0.32 0.02 2.01 -0.57 -1.82 115.64 116.83 2qki s THR 404 Ca 0.11 0.76 0.09 0.00 0.31 0.00 0.00 61.69 62.96 2qki s THR 404 Cb -0.10 -3.47 0.46 0.00 0.01 0.00 0.00 72.50 69.40 2qki s THR 404 CO 0.04 0.15 1.16 0.29 -0.69 0.00 0.00 174.62 175.56 2qki n LYS 405 N 0.53 3.27 -2.04 4.92 4.76 0.49 -4.66 118.16 125.43 2qki n LYS 405 Ca 0.02 -4.13 -0.43 0.00 -2.87 0.00 0.00 58.31 50.90 2qki n LYS 405 Cb 0.43 -2.16 -0.03 0.00 -1.84 0.00 0.00 35.03 31.44 2qki n LYS 405 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 2qki s LYS 406 N -3.60 4.04 0.57 1.97 2.47 -1.26 -4.68 119.74 119.25 2qki s LYS 406 Ca 0.47 2.01 0.31 0.00 -1.56 0.00 0.00 55.97 57.19 2qki s LYS 406 Cb 0.40 -4.00 1.72 0.00 -1.46 0.00 0.00 37.83 34.49 2qki s LYS 406 CO -0.02 -1.01 2.18 -0.56 0.16 0.00 0.00 175.35 176.11 2qki h GLN 407 N 9.99 0.00 -0.52 4.03 3.07 -1.97 -2.44 115.11 127.26 2qki h GLN 407 Ca -0.37 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.37 2qki h GLN 407 Cb 1.17 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.73 2qki h GLN 407 CO 0.97 0.05 0.00 -0.85 0.09 0.00 0.00 178.83 179.09 2qki n GLU 408 N -3.65 2.36 -4.91 0.06 0.00 -1.26 -4.90 120.64 108.35 2qki n GLU 408 Ca -0.02 -1.63 -0.30 0.00 0.00 0.00 0.00 57.16 55.20 2qki n GLU 408 Cb 0.16 -1.51 -0.14 0.00 0.00 0.00 0.00 31.44 29.94 2qki n GLU 408 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 2qki s LEU 409 N -1.17 2.25 1.10 -1.84 1.02 -0.92 -5.14 118.68 113.98 2qki s LEU 409 Ca 0.30 -0.54 -0.15 0.00 0.02 0.00 0.00 54.13 53.76 2qki s LEU 409 Cb 0.18 -1.34 0.16 0.00 0.02 0.00 0.00 46.19 45.21 2qki s LEU 409 CO 0.17 0.27 0.50 -1.20 0.02 0.00 0.00 176.35 176.11 2qki n SER 410 N 1.82 -1.90 -0.15 2.29 7.64 -1.26 -4.87 113.62 117.20 2qki n SER 410 Ca -0.17 -0.03 -0.09 0.00 1.01 0.00 0.00 58.87 59.60 2qki n SER 410 Cb 0.52 -1.14 0.00 0.00 -1.01 0.00 0.00 64.21 62.58 2qki n SER 410 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 2qki h GLU 411 N -2.20 0.64 -0.71 1.43 4.39 -1.97 -2.67 114.58 113.49 2qki h GLU 411 Ca -0.54 -0.11 0.10 0.00 0.34 0.00 0.00 59.36 59.15 2qki h GLU 411 Cb 1.33 -0.11 -0.05 0.00 -0.10 0.00 0.00 28.75 29.83 2qki h GLU 411 CO 0.42 0.57 0.47 0.00 -1.16 0.00 0.00 179.01 179.31 2qki h ALA 412 N 1.03 1.88 0.00 3.43 0.00 -1.95 -2.56 119.26 121.09 2qki h ALA 412 Ca 0.15 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2qki h ALA 412 Cb 0.16 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2qki h ALA 412 CO -0.01 -0.03 0.00 0.93 0.00 0.00 0.00 179.25 180.13 2qki h GLU 413 N 0.58 0.00 -7.00 0.00 5.08 -1.67 -3.45 114.58 108.12 2qki h GLU 413 Ca 0.33 0.00 -0.50 0.00 -1.00 0.00 0.00 59.36 58.19 2qki h GLU 413 Cb 0.50 0.00 0.05 0.00 0.50 0.00 0.00 28.75 29.80 2qki h GLU 413 CO -0.11 0.00 0.45 -0.65 -1.00 0.00 0.00 179.01 177.70 2qki s GLN 414 N -3.34 3.84 0.35 2.33 -1.52 -0.97 -4.18 119.66 116.17 2qki s GLN 414 Ca 0.05 1.65 -0.16 0.00 -1.95 0.00 0.00 55.36 54.95 2qki s GLN 414 Cb 0.07 -2.38 -0.09 0.00 -0.22 0.00 0.00 33.01 30.39 2qki s GLN 414 CO 0.62 -0.46 0.78 0.00 -0.25 0.00 0.00 175.29 175.98 2qki s ALA 415 N -1.64 3.27 0.02 6.09 0.00 -1.26 -4.91 121.76 123.32 2qki s ALA 415 Ca 0.63 0.10 -0.07 0.00 0.00 0.00 0.00 51.96 52.62 2qki s ALA 415 Cb -0.25 -2.84 -0.00 0.00 0.00 0.00 0.00 23.12 20.03 2qki s ALA 415 CO 0.31 0.28 0.14 -0.08 0.00 0.00 0.00 175.76 176.40 2qki s THR 416 N -2.04 0.10 -0.26 0.00 -1.32 -1.26 -1.51 115.64 109.35 2qki s THR 416 Ca 0.56 -0.81 -0.23 0.00 -1.21 0.00 0.00 61.69 59.99 2qki s THR 416 Cb -0.10 -0.62 0.07 0.00 -1.51 0.00 0.00 72.50 70.34 2qki s THR 416 CO 0.17 -0.45 0.68 -0.60 -2.21 0.00 0.00 174.62 172.21 2qki s ARG 417 N -1.85 0.79 -0.15 7.08 6.06 -0.94 -4.74 118.95 125.18 2qki s ARG 417 Ca -0.11 0.96 -0.01 0.00 -2.50 0.00 0.00 55.73 54.07 2qki s ARG 417 Cb -0.05 0.37 -0.01 0.00 0.06 0.00 0.00 34.95 35.32 2qki s ARG 417 CO -0.01 -0.10 -0.12 0.99 -2.50 0.00 0.00 175.30 173.57 2qki s THR 418 N 0.43 3.00 0.32 4.11 2.01 -1.26 -1.81 115.64 122.44 2qki s THR 418 Ca -0.01 -0.66 0.10 0.00 0.31 0.00 0.00 61.69 61.43 2qki s THR 418 Cb -0.05 -2.28 -0.05 0.00 0.01 0.00 0.00 72.50 70.13 2qki s THR 418 CO -0.00 0.50 -0.03 0.00 -0.69 0.00 0.00 174.62 174.40 2qki s MET 419 N 0.70 2.04 -0.09 4.92 0.23 -0.28 -4.98 119.30 121.85 2qki s MET 419 Ca -0.06 -1.71 0.03 0.00 -1.03 0.00 0.00 55.69 52.93 2qki s MET 419 Cb -0.15 -1.93 0.00 0.00 -1.53 0.00 0.00 34.83 31.22 2qki s MET 419 CO 0.02 0.20 -0.20 -1.14 -2.03 0.00 0.00 175.02 171.87 2qki s GLN 420 N -3.67 2.55 -0.12 3.16 0.74 -1.26 -1.04 119.66 120.01 2qki s GLN 420 Ca 0.33 -0.72 -0.01 0.00 0.05 0.00 0.00 55.36 55.02 2qki s GLN 420 Cb -0.02 -1.98 -0.02 0.00 1.10 0.00 0.00 33.01 32.10 2qki s GLN 420 CO 0.19 0.14 -0.09 0.00 -0.55 0.00 0.00 175.29 174.97 2qki s ALA 421 N 0.43 2.81 0.10 1.58 0.00 0.63 -4.85 121.76 122.46 2qki s ALA 421 Ca -0.17 -0.87 -0.03 0.00 0.00 0.00 0.00 51.96 50.89 2qki s ALA 421 Cb -0.17 -1.31 -0.05 0.00 0.00 0.00 0.00 23.12 21.59 2qki s ALA 421 CO 0.07 0.31 0.31 -0.51 0.00 0.00 0.00 175.76 175.94 2qki s LEU 422 N 0.10 4.31 0.23 0.00 1.43 -0.62 0.29 118.68 124.41 2qki s LEU 422 Ca -0.04 0.48 -0.30 0.00 -1.03 0.00 0.00 54.13 53.25 2qki s LEU 422 Cb -0.14 -3.13 -0.09 0.00 0.03 0.00 0.00 46.19 42.86 2qki s LEU 422 CO 0.04 0.11 1.21 -2.16 0.23 0.00 0.00 176.35 175.78 2qki s PRO 423 N -2.52 4.48 0.26 1.29 0.04 -1.26 -1.11 135.00 136.18 2qki s PRO 423 Ca 0.38 1.94 -0.30 0.00 0.04 0.00 0.00 61.00 63.06 2qki s PRO 423 Cb -0.13 -3.20 -0.11 0.00 0.04 0.00 0.00 34.50 31.11 2qki s PRO 423 CO 0.25 -0.07 1.53 -0.47 0.04 0.00 0.00 177.00 178.28 2qki s TYR 424 N -0.38 2.89 -0.21 0.56 5.04 0.34 -4.85 117.35 120.75 2qki s TYR 424 Ca 0.51 0.86 -0.16 0.00 -2.44 0.00 0.00 57.07 55.85 2qki s TYR 424 Cb -0.34 -3.95 -0.04 0.00 0.35 0.00 0.00 41.96 37.98 2qki s TYR 424 CO 0.40 -3.21 0.39 0.45 -1.34 0.00 0.00 175.55 172.25 2qki s SER 425 N 0.51 6.42 0.62 4.32 0.15 0.17 -4.85 113.70 121.04 2qki s SER 425 Ca 0.62 0.50 -0.12 0.00 0.70 0.00 0.00 55.95 57.65 2qki s SER 425 Cb -0.45 -2.23 -0.04 0.00 -1.71 0.00 0.00 66.02 61.60 2qki s SER 425 CO 0.44 -0.08 1.03 0.42 1.20 0.00 0.00 173.24 176.25 2qki s THR 426 N 1.35 4.54 0.11 6.45 -4.23 -1.26 -4.42 115.64 118.17 2qki s THR 426 Ca 0.19 0.88 -0.23 0.00 -1.18 0.00 0.00 61.69 61.34 2qki s THR 426 Cb -0.15 -3.75 -0.08 0.00 1.34 0.00 0.00 72.50 69.86 2qki s THR 426 CO 0.08 -1.03 1.70 0.58 -0.54 0.00 0.00 174.62 175.41 2qki h VAL 427 N -0.23 0.76 -2.04 2.29 2.07 -1.91 -3.34 116.25 113.85 2qki h VAL 427 Ca -0.44 0.00 -0.49 0.00 0.82 0.00 0.00 66.70 66.58 2qki h VAL 427 Cb 1.19 0.76 -0.40 0.00 -1.52 0.00 0.00 31.29 31.32 2qki h VAL 427 CO 0.61 0.00 -1.12 0.61 0.02 0.00 0.00 177.57 177.68 2qki n GLY 428 N -1.22 3.88 3.90 2.17 0.00 -1.26 -4.93 105.19 107.72 2qki n GLY 428 Ca -0.05 -1.84 -0.25 0.00 0.00 0.00 0.00 46.02 43.88 2qki n GLY 428 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2qki n ASN 429 N 0.21 -1.22 0.02 1.61 5.03 -1.25 -4.91 115.26 114.75 2qki n ASN 429 Ca 0.26 -0.93 -0.09 0.00 0.87 0.00 0.00 54.58 54.68 2qki n ASN 429 Cb 0.62 -3.41 -0.13 0.00 -1.02 0.00 0.00 39.78 35.84 2qki n ASN 429 CO 0.00 0.00 0.00 0.77 -1.83 0.00 0.00 177.26 176.20 2qki h SER 430 N -1.84 0.06 -0.33 6.41 4.64 -1.92 -3.49 113.55 117.09 2qki h SER 430 Ca -0.62 -0.10 -0.08 0.00 -0.47 0.00 0.00 61.79 60.52 2qki h SER 430 Cb 1.37 -0.02 -0.02 0.00 -0.31 0.00 0.00 62.40 63.42 2qki h SER 430 CO 0.62 1.08 -0.09 0.59 -0.87 0.00 0.00 176.83 178.17 2qki n ASN 431 N -3.22 -2.94 -4.51 4.97 5.03 -1.26 -4.92 115.26 108.41 2qki n ASN 431 Ca -0.11 0.06 -0.37 0.00 0.87 0.00 0.00 54.58 55.03 2qki n ASN 431 Cb 1.01 -1.35 -0.12 0.00 -1.02 0.00 0.00 39.78 38.30 2qki n ASN 431 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.26 175.63 2qki s ASN 432 N -2.91 5.45 0.10 6.41 0.01 -1.26 -4.18 114.94 118.56 2qki s ASN 432 Ca 0.00 -0.11 0.04 0.00 -0.71 0.00 0.00 52.86 52.08 2qki s ASN 432 Cb 0.00 -1.98 -0.04 0.00 0.41 0.00 0.00 41.25 39.64 2qki s ASN 432 CO 0.00 -0.00 -0.11 -0.31 -1.51 0.00 0.00 177.10 175.17 2qki s TYR 433 N 1.45 1.12 -0.01 2.20 2.02 0.57 -4.86 117.35 119.84 2qki s TYR 433 Ca 0.06 -0.64 0.06 0.00 -0.37 0.00 0.00 57.07 56.18 2qki s TYR 433 Cb -0.15 -0.61 -0.02 0.00 -0.40 0.00 0.00 41.96 40.79 2qki s TYR 433 CO 0.05 0.03 -0.20 -1.17 -1.57 0.00 0.00 175.55 172.68 2qki s LEU 434 N -2.47 2.05 -0.11 -1.29 2.96 -1.26 -2.67 118.68 115.90 2qki s LEU 434 Ca 0.06 -0.38 -0.01 0.00 -0.22 0.00 0.00 54.13 53.58 2qki s LEU 434 Cb -0.03 -1.04 0.03 0.00 0.50 0.00 0.00 46.19 45.64 2qki s LEU 434 CO 0.01 0.24 -0.07 -2.28 -1.32 0.00 0.00 176.35 172.93 2qki s HIS 435 N -0.51 1.39 -0.13 5.38 5.65 -0.92 -4.56 115.29 121.59 2qki s HIS 435 Ca 0.08 -0.67 -0.11 0.00 0.25 0.00 0.00 55.06 54.61 2qki s HIS 435 Cb -0.08 -1.18 -0.05 0.00 -1.18 0.00 0.00 32.58 30.09 2qki s HIS 435 CO -0.01 -0.49 0.22 -0.51 -0.65 0.00 0.00 174.74 173.30 2qki s LEU 436 N 1.74 4.32 -0.02 8.88 1.43 -1.26 -1.76 118.68 132.01 2qki s LEU 436 Ca 0.05 0.51 0.02 0.00 -1.03 0.00 0.00 54.13 53.68 2qki s LEU 436 Cb -0.13 -2.24 0.00 0.00 0.03 0.00 0.00 46.19 43.86 2qki s LEU 436 CO -0.08 0.26 -0.07 -0.55 0.23 0.00 0.00 176.35 176.14 2qki s SER 437 N -0.33 0.98 0.13 2.29 0.15 -0.66 -4.92 113.70 111.34 2qki s SER 437 Ca 0.15 -0.15 0.04 0.00 0.70 0.00 0.00 55.95 56.69 2qki s SER 437 Cb -0.13 -0.25 -0.04 0.00 -1.71 0.00 0.00 66.02 63.89 2qki s SER 437 CO 0.04 0.05 -0.09 0.68 1.20 0.00 0.00 173.24 175.12 2qki s VAL 438 N 0.19 1.01 0.07 4.45 -7.23 -1.26 -0.67 120.40 116.96 2qki s VAL 438 Ca -0.02 -1.95 -0.30 0.00 -1.81 0.00 0.00 61.98 57.89 2qki s VAL 438 Cb -0.07 -1.71 -0.05 0.00 0.56 0.00 0.00 36.38 35.10 2qki s VAL 438 CO 0.00 -0.74 1.08 -0.76 -0.31 0.00 0.00 175.10 174.36 2qki s LEU 439 N -3.00 4.41 0.77 1.32 1.43 -1.26 -5.06 118.68 117.29 2qki s LEU 439 Ca 0.13 1.88 -0.11 0.00 -1.03 0.00 0.00 54.13 55.01 2qki s LEU 439 Cb 0.02 -3.58 0.06 0.00 0.03 0.00 0.00 46.19 42.72 2qki s LEU 439 CO -0.01 -0.30 1.14 -0.13 0.23 0.00 0.00 176.35 177.28 2qki s ARG 440 N 0.61 2.17 0.00 1.70 3.00 -1.26 -5.01 118.95 120.16 2qki s ARG 440 Ca 0.53 0.12 0.00 0.00 0.00 0.00 0.00 55.73 56.38 2qki s ARG 440 Cb -0.26 -2.00 0.00 0.00 0.00 0.00 0.00 34.95 32.69 2qki s ARG 440 CO 0.30 -1.43 0.00 0.25 0.00 0.00 0.00 175.30 174.42 2qki n THR 441 N -3.19 0.00 -0.93 0.02 -2.24 -1.26 -5.04 114.28 101.64 2qki n THR 441 Ca 0.08 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.51 2qki n THR 441 Cb 0.60 0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 68.74 2qki n THR 441 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2qki n GLU 442 N -0.85 0.00 -3.93 -0.78 4.71 -1.26 -4.92 120.64 113.62 2qki n GLU 442 Ca 0.00 0.00 -0.35 0.00 -0.01 0.00 0.00 57.16 56.80 2qki n GLU 442 Cb 0.00 -1.02 -0.14 0.00 -1.01 0.00 0.00 31.44 29.27 2qki n GLU 442 CO 0.00 0.00 0.00 -1.17 0.09 0.00 0.00 177.13 176.05 2qki s LEU 443 N 5.02 3.00 0.14 -4.62 0.20 -1.26 -5.04 118.68 116.12 2qki s LEU 443 Ca 0.87 -0.59 0.09 0.00 0.69 0.00 0.00 54.13 55.19 2qki s LEU 443 Cb -0.95 -1.71 -0.04 0.00 -0.43 0.00 0.00 46.19 43.07 2qki s LEU 443 CO 0.40 -0.07 -0.22 -0.13 -0.29 0.00 0.00 176.35 176.04 2qki s ARG 444 N 1.42 1.28 0.41 1.98 3.00 -1.26 -0.64 118.95 125.14 2qki s ARG 444 Ca 0.04 -1.32 -0.23 0.00 0.00 0.00 0.00 55.73 54.22 2qki s ARG 444 Cb -0.15 -1.54 -0.13 0.00 0.00 0.00 0.00 34.95 33.14 2qki s ARG 444 CO -0.04 0.34 0.55 -2.30 0.00 0.00 0.00 175.30 173.85 2qki n PRO 445 N 0.70 0.57 0.00 3.54 -0.02 -1.26 -2.11 135.00 136.42 2qki n PRO 445 Ca -0.16 0.21 0.00 0.00 -2.02 0.00 0.00 63.50 61.53 2qki n PRO 445 Cb 0.55 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.53 2qki n PRO 445 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qki n GLY 446 N 1.78 2.62 3.78 -1.23 0.00 0.16 -4.96 105.19 107.34 2qki n GLY 446 Ca 0.12 -0.37 -0.37 0.00 0.00 0.00 0.00 46.02 45.39 2qki n GLY 446 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2qki s GLU 447 N 0.00 4.54 0.09 1.61 2.02 -0.90 -4.74 118.70 121.31 2qki s GLU 447 Ca 0.00 1.41 -0.17 0.00 0.02 0.00 0.00 54.97 56.23 2qki s GLU 447 Cb 0.00 -2.82 -0.07 0.00 0.10 0.00 0.00 34.13 31.34 2qki s GLU 447 CO 0.00 0.22 0.54 0.99 0.02 0.00 0.00 175.26 177.03 2qki s THR 448 N -1.55 4.81 -0.16 3.63 2.01 -1.26 -1.47 115.64 121.66 2qki s THR 448 Ca 0.50 1.04 -0.00 0.00 0.31 0.00 0.00 61.69 63.55 2qki s THR 448 Cb -0.21 -3.82 -0.00 0.00 0.01 0.00 0.00 72.50 68.48 2qki s THR 448 CO 0.27 0.46 -0.14 -0.22 -0.69 0.00 0.00 174.62 174.29 2qki s LEU 449 N -1.38 2.52 -0.20 4.42 2.96 0.81 -4.93 118.68 122.90 2qki s LEU 449 Ca 0.31 -0.45 -0.29 0.00 -0.22 0.00 0.00 54.13 53.48 2qki s LEU 449 Cb -0.18 -1.58 0.00 0.00 0.50 0.00 0.00 46.19 44.94 2qki s LEU 449 CO 0.18 0.09 1.06 0.20 -1.32 0.00 0.00 176.35 176.55 2qki s ASN 450 N 0.81 7.12 -0.21 3.68 0.01 -1.26 -0.30 114.94 124.79 2qki s ASN 450 Ca -0.05 1.45 -0.05 0.00 -0.71 0.00 0.00 52.86 53.49 2qki s ASN 450 Cb -0.15 -2.54 -0.02 0.00 0.41 0.00 0.00 41.25 38.94 2qki s ASN 450 CO 0.00 -0.63 0.00 -0.69 -1.51 0.00 0.00 177.10 174.27 2qki s VAL 451 N 2.97 3.89 -0.29 1.60 1.01 -0.18 -4.42 120.40 124.98 2qki s VAL 451 Ca 0.46 -0.33 -0.15 0.00 0.00 0.00 0.00 61.98 61.96 2qki s VAL 451 Cb -0.16 -2.77 -0.03 0.00 0.00 0.00 0.00 36.38 33.42 2qki s VAL 451 CO 0.09 0.42 0.36 0.20 0.00 0.00 0.00 175.10 176.17 2qki s ASN 452 N 1.15 6.22 -0.32 3.32 -0.87 0.15 -0.54 114.94 124.06 2qki s ASN 452 Ca 0.03 0.12 -0.11 0.00 -1.57 0.00 0.00 52.86 51.32 2qki s ASN 452 Cb -0.14 -2.20 -0.02 0.00 -0.02 0.00 0.00 41.25 38.86 2qki s ASN 452 CO 0.01 -0.22 0.20 -0.36 -2.57 0.00 0.00 177.10 174.16 2qki s PHE 453 N 2.05 3.20 -0.05 2.20 0.08 0.05 -1.66 117.98 123.85 2qki s PHE 453 Ca 0.14 -0.27 0.04 0.00 0.12 0.00 0.00 56.93 56.96 2qki s PHE 453 Cb -0.16 -2.41 -0.00 0.00 -0.57 0.00 0.00 43.02 39.88 2qki s PHE 453 CO 0.11 -0.35 -0.18 -1.17 -0.10 0.00 0.00 175.22 173.52 2qki s LEU 454 N 1.69 1.91 -0.15 -0.37 2.96 -0.72 -1.51 118.68 122.49 2qki s LEU 454 Ca 0.06 -0.38 -0.04 0.00 -0.22 0.00 0.00 54.13 53.54 2qki s LEU 454 Cb -0.17 -1.04 -0.03 0.00 0.50 0.00 0.00 46.19 45.45 2qki s LEU 454 CO 0.09 0.15 -0.01 -0.22 -1.32 0.00 0.00 176.35 175.03 2qki s LEU 455 N 0.14 3.41 -0.29 -0.68 2.96 -0.30 -2.16 118.68 121.77 2qki s LEU 455 Ca -0.07 -0.04 0.01 0.00 -0.22 0.00 0.00 54.13 53.81 2qki s LEU 455 Cb -0.13 -1.82 0.06 0.00 0.50 0.00 0.00 46.19 44.80 2qki s LEU 455 CO 0.03 0.21 -0.05 -0.60 -1.32 0.00 0.00 176.35 174.63 2qki s ARG 456 N 0.12 2.22 0.05 1.98 3.52 -1.09 -4.94 118.95 120.82 2qki s ARG 456 Ca 0.01 -1.39 -0.27 0.00 -0.13 0.00 0.00 55.73 53.95 2qki s ARG 456 Cb -0.13 -3.04 0.08 0.00 -1.56 0.00 0.00 34.95 30.29 2qki s ARG 456 CO 0.02 -0.64 0.69 0.00 -0.81 0.00 0.00 175.30 174.56 2qki s MET 457 N 1.13 1.11 0.54 5.12 0.23 -1.26 -0.32 119.30 125.86 2qki s MET 457 Ca -0.05 -0.17 -0.21 0.00 -1.03 0.00 0.00 55.69 54.23 2qki s MET 457 Cb -0.20 0.52 -0.05 0.00 -1.53 0.00 0.00 34.83 33.57 2qki s MET 457 CO -0.04 -0.44 1.23 0.16 -2.03 0.00 0.00 175.02 173.90 2qki s ASP 458 N -2.09 5.49 0.57 -1.18 -4.77 -1.26 -4.71 116.67 108.71 2qki s ASP 458 Ca -0.03 2.45 0.28 0.00 -3.30 0.00 0.00 52.55 51.95 2qki s ASP 458 Cb -0.01 -2.61 1.50 0.00 -1.09 0.00 0.00 42.92 40.71 2qki s ASP 458 CO -0.04 -1.39 1.99 0.08 0.70 0.00 0.00 175.17 176.50 2qki h ARG 459 N 1.35 0.00 0.00 2.11 0.11 -2.01 -0.52 114.38 115.41 2qki h ARG 459 Ca -0.50 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 59.56 2qki h ARG 459 Cb 1.28 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.36 2qki h ARG 459 CO 0.57 0.00 -0.10 0.00 0.10 0.00 0.00 179.97 180.54 2qki h ALA 460 N 1.64 1.37 0.00 0.08 0.00 -2.07 -3.31 119.26 116.97 2qki h ALA 460 Ca 0.20 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2qki h ALA 460 Cb 0.96 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.73 2qki h ALA 460 CO -0.00 0.13 -0.40 0.72 0.00 0.00 0.00 179.25 179.70 2qki n HIS 461 N -3.75 0.00 0.09 0.00 8.25 -0.24 -4.79 115.22 114.78 2qki n HIS 461 Ca -0.02 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.57 2qki n HIS 461 Cb 0.21 0.00 0.63 0.00 1.12 0.00 0.00 29.99 31.95 2qki n HIS 461 CO 0.00 0.00 0.00 1.05 0.64 0.00 0.00 176.34 178.03 2qki h GLU 462 N 0.00 0.09 0.00 -0.41 -0.00 -1.56 -2.36 114.58 110.34 2qki h GLU 462 Ca 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 59.36 59.35 2qki h GLU 462 Cb 0.00 -0.02 0.00 0.00 -0.00 0.00 0.00 28.75 28.73 2qki h GLU 462 CO 0.00 0.06 0.00 0.00 -0.00 0.00 0.00 179.01 179.07 2qki h ALA 463 N 1.83 1.00 0.00 1.06 0.00 -1.87 -2.57 119.26 118.71 2qki h ALA 463 Ca 0.15 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 2qki h ALA 463 Cb 0.50 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 2qki h ALA 463 CO -0.02 0.00 -0.02 0.87 0.00 0.00 0.00 179.25 180.09 2qki h LYS 464 N 0.00 0.00 -5.58 0.00 1.79 -1.79 -3.43 116.57 107.56 2qki h LYS 464 Ca 0.00 0.00 -0.62 0.00 -2.18 0.00 0.00 60.65 57.85 2qki h LYS 464 Cb 0.30 0.00 -0.12 0.00 -1.58 0.00 0.00 32.23 30.83 2qki h LYS 464 CO 0.00 0.02 0.22 0.42 -1.08 0.00 0.00 179.45 179.03 2qki s ILE 465 N -3.73 4.85 -0.12 1.86 -1.09 -0.97 -4.86 121.20 117.13 2qki s ILE 465 Ca 0.00 0.73 0.02 0.00 -2.23 0.00 0.00 60.65 59.17 2qki s ILE 465 Cb 0.10 -4.10 -0.01 0.00 -1.58 0.00 0.00 42.46 36.87 2qki s ILE 465 CO 0.54 -0.32 0.25 0.54 -1.23 0.00 0.00 174.94 174.72 2qki n ARG 466 N 6.13 3.78 -3.57 2.79 5.12 -1.26 -4.51 116.66 125.14 2qki n ARG 466 Ca 0.00 -0.23 -0.06 0.00 -1.93 0.00 0.00 57.85 55.64 2qki n ARG 466 Cb 0.48 -0.74 -0.02 0.00 -1.16 0.00 0.00 32.46 31.02 2qki n ARG 466 CO 0.00 0.00 0.00 1.52 -1.93 0.00 0.00 177.63 177.22 2qki s TYR 467 N -0.77 -0.19 0.08 -1.55 -0.85 -1.26 -1.23 117.35 111.59 2qki s TYR 467 Ca 0.01 0.12 0.10 0.00 -0.52 0.00 0.00 57.07 56.78 2qki s TYR 467 Cb 0.01 0.52 -0.03 0.00 0.38 0.00 0.00 41.96 42.84 2qki s TYR 467 CO 0.05 -0.31 -0.26 0.71 -1.52 0.00 0.00 175.55 174.22 2qki s TYR 468 N -2.63 2.34 -0.12 -3.49 2.02 -0.07 -4.71 117.35 110.70 2qki s TYR 468 Ca 0.08 -0.38 -0.12 0.00 -0.37 0.00 0.00 57.07 56.28 2qki s TYR 468 Cb -0.01 -1.33 -0.05 0.00 -0.40 0.00 0.00 41.96 40.17 2qki s TYR 468 CO -0.06 0.24 0.26 0.99 -1.57 0.00 0.00 175.55 175.41 2qki s THR 469 N -0.93 5.31 0.02 -0.71 2.01 -0.53 -0.41 115.64 120.39 2qki s THR 469 Ca 0.13 0.49 0.07 0.00 0.31 0.00 0.00 61.69 62.69 2qki s THR 469 Cb -0.10 -3.57 -0.02 0.00 0.01 0.00 0.00 72.50 68.82 2qki s THR 469 CO 0.04 0.50 -0.22 -0.72 -0.69 0.00 0.00 174.62 173.54 2qki s TYR 470 N -0.31 1.93 -0.04 4.92 -0.85 0.09 -1.29 117.35 121.80 2qki s TYR 470 Ca 0.17 -0.38 0.03 0.00 -0.52 0.00 0.00 57.07 56.37 2qki s TYR 470 Cb -0.13 -1.18 0.00 0.00 0.38 0.00 0.00 41.96 41.03 2qki s TYR 470 CO 0.06 0.06 -0.12 -0.51 -1.52 0.00 0.00 175.55 173.52 2qki s LEU 471 N -0.98 1.79 -0.35 -3.49 1.43 0.63 -1.19 118.68 116.53 2qki s LEU 471 Ca 0.08 -0.25 -0.04 0.00 -1.03 0.00 0.00 54.13 52.90 2qki s LEU 471 Cb -0.09 -0.70 0.07 0.00 0.03 0.00 0.00 46.19 45.50 2qki s LEU 471 CO 0.01 0.08 0.11 -0.63 0.23 0.00 0.00 176.35 176.15 2qki s ILE 472 N 0.22 3.36 -0.03 -0.59 1.01 0.13 -0.77 121.20 124.54 2qki s ILE 472 Ca -0.05 -1.53 -0.29 0.00 0.00 0.00 0.00 60.65 58.78 2qki s ILE 472 Cb -0.10 -3.05 -0.03 0.00 0.01 0.00 0.00 42.46 39.29 2qki s ILE 472 CO 0.01 -0.33 0.93 -0.04 0.00 0.00 0.00 174.94 175.51 2qki s MET 473 N 1.27 4.52 -0.07 2.79 -1.94 0.16 -0.68 119.30 125.34 2qki s MET 473 Ca 0.00 1.31 -0.06 0.00 -1.71 0.00 0.00 55.69 55.24 2qki s MET 473 Cb -0.21 -3.47 0.02 0.00 2.01 0.00 0.00 34.83 33.18 2qki s MET 473 CO -0.01 -0.06 0.18 1.21 -0.01 0.00 0.00 175.02 176.33 2qki s ASN 474 N 0.98 -0.19 -0.64 3.03 3.84 -0.66 -1.19 114.94 120.12 2qki s ASN 474 Ca 0.49 0.37 0.00 0.00 0.21 0.00 0.00 52.86 53.93 2qki s ASN 474 Cb -0.20 0.36 0.00 0.00 -0.55 0.00 0.00 41.25 40.85 2qki s ASN 474 CO 0.25 -0.08 0.00 0.29 -2.79 0.00 0.00 177.10 174.77 2qki n LYS 475 N 3.17 -1.63 -0.19 0.43 5.02 -1.26 -1.89 118.16 121.80 2qki n LYS 475 Ca -0.15 0.36 0.00 0.00 -2.02 0.00 0.00 58.31 56.50 2qki n LYS 475 Cb 0.58 -4.63 0.00 0.00 -0.02 0.00 0.00 35.03 30.96 2qki n LYS 475 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2qki n GLY 476 N -0.30 1.12 3.29 0.72 0.00 -1.26 -4.76 105.19 104.00 2qki n GLY 476 Ca -0.07 -0.16 -0.11 0.00 0.00 0.00 0.00 46.02 45.68 2qki n GLY 476 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2qki s ARG 477 N -0.60 0.94 -0.44 1.61 1.04 -0.80 -4.93 118.95 115.77 2qki s ARG 477 Ca 0.00 -0.59 -0.27 0.00 -1.04 0.00 0.00 55.73 53.83 2qki s ARG 477 Cb 0.00 0.41 -0.04 0.00 -2.04 0.00 0.00 34.95 33.28 2qki s ARG 477 CO 0.00 -0.33 2.04 -0.51 -0.04 0.00 0.00 175.30 176.46 2qki s LEU 478 N -2.40 3.40 -0.01 -1.89 1.43 -1.26 -1.65 118.68 116.30 2qki s LEU 478 Ca -0.01 1.03 -0.22 0.00 -1.03 0.00 0.00 54.13 53.89 2qki s LEU 478 Cb 0.01 -2.94 -0.20 0.00 0.03 0.00 0.00 46.19 43.09 2qki s LEU 478 CO -0.07 -2.26 1.18 0.25 0.23 0.00 0.00 176.35 175.67 2qki h LEU 479 N 16.30 0.30 -7.28 1.79 5.85 -1.20 -3.46 115.31 127.61 2qki h LEU 479 Ca -0.30 -0.64 -0.09 0.00 0.84 0.00 0.00 57.88 57.69 2qki h LEU 479 Cb 1.20 -0.09 -0.20 0.00 0.37 0.00 0.00 40.66 41.95 2qki h LEU 479 CO 1.11 0.89 -0.07 -0.75 -0.34 0.00 0.00 178.44 179.28 2qki s LYS 480 N -3.68 0.83 -0.02 1.25 2.20 -1.23 -5.01 119.74 114.08 2qki s LYS 480 Ca -0.15 0.05 -0.11 0.00 -0.36 0.00 0.00 55.97 55.40 2qki s LYS 480 Cb 0.03 0.38 0.02 0.00 -1.51 0.00 0.00 37.83 36.75 2qki s LYS 480 CO 0.75 -0.24 0.24 0.00 -0.36 0.00 0.00 175.35 175.74 2qki s ALA 481 N -1.17 -0.60 0.00 3.13 0.00 -1.26 0.20 121.76 122.06 2qki s ALA 481 Ca -0.12 0.24 0.00 0.00 0.00 0.00 0.00 51.96 52.08 2qki s ALA 481 Cb -0.03 -0.00 0.00 0.00 0.00 0.00 0.00 23.12 23.09 2qki s ALA 481 CO 0.06 -0.22 0.00 0.41 0.00 0.00 0.00 175.76 176.02 2qki n GLY 482 N 1.63 1.31 3.20 0.00 0.00 -0.33 -4.99 105.19 106.01 2qki n GLY 482 Ca -0.20 -0.78 -0.22 0.00 0.00 0.00 0.00 46.02 44.82 2qki n GLY 482 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qki s ARG 483 N -0.59 1.11 -0.24 1.61 1.81 -1.26 -0.74 118.95 120.67 2qki s ARG 483 Ca 0.00 -0.87 -0.03 0.00 -1.72 0.00 0.00 55.73 53.11 2qki s ARG 483 Cb 0.00 -1.18 0.01 0.00 -0.45 0.00 0.00 34.95 33.32 2qki s ARG 483 CO 0.00 0.29 -0.04 -1.14 -0.68 0.00 0.00 175.30 173.74 2qki s GLN 484 N -1.24 3.17 0.50 3.54 2.00 0.45 -4.96 119.66 123.12 2qki s GLN 484 Ca 0.04 -0.77 -0.20 0.00 -2.00 0.00 0.00 55.36 52.43 2qki s GLN 484 Cb -0.08 -3.03 -0.08 0.00 0.80 0.00 0.00 33.01 30.62 2qki s GLN 484 CO 0.02 -0.29 1.07 0.14 -0.50 0.00 0.00 175.29 175.73 2qki s VAL 485 N 1.43 3.59 -0.12 1.34 -7.23 -1.26 -0.89 120.40 117.25 2qki s VAL 485 Ca 0.04 0.99 -0.11 0.00 -1.81 0.00 0.00 61.98 61.09 2qki s VAL 485 Cb -0.15 -3.40 0.03 0.00 0.56 0.00 0.00 36.38 33.42 2qki s VAL 485 CO -0.03 -0.21 0.32 -0.60 -0.31 0.00 0.00 175.10 174.26 2qki s ARG 486 N -3.23 0.36 -0.02 4.82 3.52 -0.36 -4.87 118.95 119.17 2qki s ARG 486 Ca 0.69 0.45 0.04 0.00 -0.13 0.00 0.00 55.73 56.78 2qki s ARG 486 Cb -0.19 0.16 -0.03 0.00 -1.56 0.00 0.00 34.95 33.33 2qki s ARG 486 CO 0.22 -0.05 -0.13 -1.21 -0.81 0.00 0.00 175.30 173.32 2qki s GLU 487 N 0.26 2.43 0.43 5.12 8.01 -1.26 -4.15 118.70 129.54 2qki s GLU 487 Ca -0.01 -0.76 -0.21 0.00 0.01 0.00 0.00 54.97 54.00 2qki s GLU 487 Cb -0.03 -2.38 -0.13 0.00 -4.31 0.00 0.00 34.13 27.28 2qki s GLU 487 CO -0.00 0.60 0.37 -2.30 0.01 0.00 0.00 175.26 173.94 2qki n PRO 488 N 1.92 0.36 0.00 0.39 -0.02 -1.26 -1.92 135.00 134.47 2qki n PRO 488 Ca -0.16 0.13 0.00 0.00 -2.02 0.00 0.00 63.50 61.45 2qki n PRO 488 Cb 0.52 -1.34 0.00 0.00 -0.02 0.00 0.00 33.50 32.66 2qki n PRO 488 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qki n GLY 489 N 1.99 2.39 3.55 -1.23 0.00 -1.26 -5.00 105.19 105.63 2qki n GLY 489 Ca 0.11 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.70 2qki n GLY 489 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2qki s GLN 490 N -0.22 3.44 0.05 1.61 -0.21 -0.81 -4.91 119.66 118.61 2qki s GLN 490 Ca 0.00 -0.02 -0.22 0.00 0.02 0.00 0.00 55.36 55.14 2qki s GLN 490 Cb 0.00 -3.96 -0.14 0.00 1.00 0.00 0.00 33.01 29.91 2qki s GLN 490 CO 0.00 -1.23 1.46 -0.44 -2.12 0.00 0.00 175.29 172.96 2qki h ASP 491 N 9.08 0.19 -3.25 5.90 3.45 -1.92 -3.45 116.42 126.43 2qki h ASP 491 Ca -0.25 -0.32 -0.44 0.00 0.43 0.00 0.00 57.03 56.45 2qki h ASP 491 Cb 1.08 -0.05 -0.38 0.00 -0.56 0.00 0.00 39.33 39.41 2qki h ASP 491 CO 1.01 0.47 -0.77 -0.22 -1.57 0.00 0.00 179.24 178.17 2qki s LEU 492 N -9.51 0.59 0.09 1.55 1.98 -1.26 -1.15 118.68 110.97 2qki s LEU 492 Ca -0.14 -0.12 0.09 0.00 -2.89 0.00 0.00 54.13 51.07 2qki s LEU 492 Cb 0.05 -0.43 -0.04 0.00 0.66 0.00 0.00 46.19 46.43 2qki s LEU 492 CO 0.70 -0.20 -0.23 0.68 -1.89 0.00 0.00 176.35 175.41 2qki s VAL 493 N 1.98 2.46 -0.11 1.68 -7.23 -0.57 -4.99 120.40 113.62 2qki s VAL 493 Ca 0.05 -1.49 0.02 0.00 -1.81 0.00 0.00 61.98 58.75 2qki s VAL 493 Cb -0.13 -2.05 -0.01 0.00 0.56 0.00 0.00 36.38 34.75 2qki s VAL 493 CO -0.05 0.22 -0.19 -0.69 -0.31 0.00 0.00 175.10 174.07 2qki s VAL 494 N -0.98 2.49 -0.28 1.32 1.01 -1.26 -0.77 120.40 121.94 2qki s VAL 494 Ca 0.14 -0.87 -0.11 0.00 0.00 0.00 0.00 61.98 61.15 2qki s VAL 494 Cb -0.10 -2.00 -0.05 0.00 0.00 0.00 0.00 36.38 34.23 2qki s VAL 494 CO 0.06 0.55 0.18 -0.22 0.00 0.00 0.00 175.10 175.66 2qki s LEU 495 N 0.30 4.00 -0.59 3.92 2.96 0.30 -4.93 118.68 124.64 2qki s LEU 495 Ca -0.14 -0.01 -0.26 0.00 -0.22 0.00 0.00 54.13 53.49 2qki s LEU 495 Cb -0.17 -2.11 0.04 0.00 0.50 0.00 0.00 46.19 44.45 2qki s LEU 495 CO 0.07 -0.04 1.09 -2.16 -1.32 0.00 0.00 176.35 173.99 2qki s PRO 496 N 1.70 3.39 -0.40 0.98 0.04 -1.26 -1.01 135.00 138.45 2qki s PRO 496 Ca 0.07 -0.05 -0.13 0.00 0.04 0.00 0.00 61.00 60.93 2qki s PRO 496 Cb -0.16 -4.06 0.03 0.00 0.04 0.00 0.00 34.50 30.35 2qki s PRO 496 CO 0.10 -1.66 0.26 -1.17 0.04 0.00 0.00 177.00 174.57 2qki s LEU 497 N 4.60 4.97 -0.02 -3.56 2.96 0.59 -4.92 118.68 123.30 2qki s LEU 497 Ca 0.36 -0.99 -0.30 0.00 -0.22 0.00 0.00 54.13 52.99 2qki s LEU 497 Cb -0.10 -2.09 -0.06 0.00 0.50 0.00 0.00 46.19 44.44 2qki s LEU 497 CO 0.21 -0.44 1.56 -0.44 -1.32 0.00 0.00 176.35 175.92 2qki s SER 498 N 1.68 6.72 -0.21 3.68 0.01 -1.26 -0.13 113.70 124.19 2qki s SER 498 Ca 0.03 2.22 -0.13 0.00 1.31 0.00 0.00 55.95 59.38 2qki s SER 498 Cb -0.19 -2.55 -0.04 0.00 0.21 0.00 0.00 66.02 63.44 2qki s SER 498 CO 0.08 -0.85 0.28 -0.63 0.41 0.00 0.00 173.24 172.53 2qki s ILE 499 N 3.25 5.29 0.42 1.44 -1.09 -0.54 -4.96 121.20 125.01 2qki s ILE 499 Ca 0.69 0.46 0.05 0.00 -2.23 0.00 0.00 60.65 59.62 2qki s ILE 499 Cb -0.33 -3.61 -0.05 0.00 -1.58 0.00 0.00 42.46 36.88 2qki s ILE 499 CO 0.28 0.32 0.03 0.42 -1.23 0.00 0.00 174.94 174.77 2qki s THR 500 N 0.99 1.48 -0.30 2.92 -4.23 -1.26 0.37 115.64 115.61 2qki s THR 500 Ca 0.14 -2.00 0.18 0.00 -1.18 0.00 0.00 61.69 58.83 2qki s THR 500 Cb -0.14 -2.68 0.18 0.00 1.34 0.00 0.00 72.50 71.20 2qki s THR 500 CO 0.05 0.00 1.54 0.35 -0.54 0.00 0.00 174.62 176.02 2qki n THR 501 N -0.98 1.14 0.24 3.99 -2.24 -1.26 -1.04 114.28 114.14 2qki n THR 501 Ca -0.08 0.70 0.12 0.00 -2.27 0.00 0.00 64.05 62.52 2qki n THR 501 Cb 0.67 -1.70 0.52 0.00 -2.10 0.00 0.00 70.33 67.71 2qki n THR 501 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2qki h ASP 502 N 0.00 0.00 0.98 3.42 3.32 -1.98 -3.18 116.42 118.98 2qki h ASP 502 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2qki h ASP 502 Cb 0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.59 2qki h ASP 502 CO 0.00 0.17 -0.05 0.49 -1.72 0.00 0.00 179.24 178.13 2qki n PHE 503 N -3.34 0.05 -2.39 4.55 3.72 -0.21 -4.80 117.46 115.04 2qki n PHE 503 Ca 0.00 0.01 -0.43 0.00 -0.05 0.00 0.00 57.45 56.99 2qki n PHE 503 Cb 0.39 -0.50 -0.02 0.00 -0.94 0.00 0.00 39.48 38.41 2qki n PHE 503 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 2qki s ILE 504 N -3.01 4.05 0.00 4.37 1.01 -1.20 -1.78 121.20 124.64 2qki s ILE 504 Ca 0.14 1.15 0.00 0.00 0.00 0.00 0.00 60.65 61.94 2qki s ILE 504 Cb 0.18 -4.17 0.00 0.00 0.01 0.00 0.00 42.46 38.49 2qki s ILE 504 CO 0.55 -0.57 0.00 -0.81 0.00 0.00 0.00 174.94 174.11 2qki n PRO 505 N 7.58 2.25 0.00 2.79 -0.05 -1.26 -4.94 135.00 141.37 2qki n PRO 505 Ca 0.15 0.00 0.00 0.00 -0.05 0.00 0.00 63.50 63.60 2qki n PRO 505 Cb 0.47 -0.82 0.00 0.00 -0.05 0.00 0.00 33.50 33.10 2qki n PRO 505 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 175.50 175.90 2qki n SER 506 N -1.05 0.00 -3.65 3.54 2.88 -0.73 -2.92 113.62 111.69 2qki n SER 506 Ca 0.00 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.42 2qki n SER 506 Cb 0.06 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.46 2qki n SER 506 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 2qki s PHE 507 N -2.00 -0.27 -0.04 0.66 -0.71 -0.40 -4.62 117.98 110.60 2qki s PHE 507 Ca 0.00 0.16 0.01 0.00 -1.04 0.00 0.00 56.93 56.06 2qki s PHE 507 Cb 0.00 0.24 -0.03 0.00 -1.21 0.00 0.00 43.02 42.02 2qki s PHE 507 CO 0.00 -0.61 -0.04 1.03 -1.34 0.00 0.00 175.22 174.26 2qki s ARG 508 N -2.81 2.76 -0.18 1.99 0.52 -0.33 -0.30 118.95 120.60 2qki s ARG 508 Ca -0.03 -0.57 0.01 0.00 -0.52 0.00 0.00 55.73 54.61 2qki s ARG 508 Cb -0.00 -2.63 0.03 0.00 0.52 0.00 0.00 34.95 32.86 2qki s ARG 508 CO -0.05 0.65 -0.16 -1.17 0.02 0.00 0.00 175.30 174.59 2qki s LEU 509 N -1.15 2.07 0.01 2.53 1.98 -0.19 -0.66 118.68 123.26 2qki s LEU 509 Ca 0.15 -0.66 0.04 0.00 -2.89 0.00 0.00 54.13 50.77 2qki s LEU 509 Cb -0.11 -1.35 -0.03 0.00 0.66 0.00 0.00 46.19 45.36 2qki s LEU 509 CO 0.05 -0.05 -0.11 0.54 -1.89 0.00 0.00 176.35 174.89 2qki s VAL 510 N 1.36 3.33 0.03 1.68 0.11 0.05 -0.44 120.40 126.52 2qki s VAL 510 Ca 0.03 -0.89 -0.02 0.00 -2.93 0.00 0.00 61.98 58.17 2qki s VAL 510 Cb -0.14 -2.42 -0.02 0.00 -1.53 0.00 0.00 36.38 32.27 2qki s VAL 510 CO -0.11 0.40 0.02 0.00 -3.33 0.00 0.00 175.10 172.08 2qki s ALA 511 N -0.95 0.07 0.04 1.54 0.00 0.28 -0.27 121.76 122.47 2qki s ALA 511 Ca 0.16 -0.61 -0.14 0.00 0.00 0.00 0.00 51.96 51.37 2qki s ALA 511 Cb -0.11 0.19 0.02 0.00 0.00 0.00 0.00 23.12 23.22 2qki s ALA 511 CO 0.06 -0.23 0.31 1.52 0.00 0.00 0.00 175.76 177.42 2qki s TYR 512 N -2.08 -0.12 0.28 0.00 -0.85 -0.41 -0.86 117.35 113.31 2qki s TYR 512 Ca -0.10 0.02 0.08 0.00 -0.52 0.00 0.00 57.07 56.55 2qki s TYR 512 Cb -0.05 0.10 -0.06 0.00 0.38 0.00 0.00 41.96 42.34 2qki s TYR 512 CO -0.03 -0.49 -0.08 1.52 -1.52 0.00 0.00 175.55 174.94 2qki s TYR 513 N -2.41 2.03 0.07 -3.49 -0.85 0.10 -1.45 117.35 111.35 2qki s TYR 513 Ca -0.06 -0.62 0.02 0.00 -0.52 0.00 0.00 57.07 55.88 2qki s TYR 513 Cb -0.01 -1.12 -0.03 0.00 0.38 0.00 0.00 41.96 41.18 2qki s TYR 513 CO -0.02 0.38 -0.06 -0.08 -1.52 0.00 0.00 175.55 174.24 2qki s THR 514 N -2.90 0.54 0.25 -3.49 -1.32 -1.26 -1.04 115.64 106.42 2qki s THR 514 Ca 0.29 -1.50 -0.20 0.00 -1.21 0.00 0.00 61.69 59.07 2qki s THR 514 Cb 0.02 -1.13 0.03 0.00 -1.51 0.00 0.00 72.50 69.91 2qki s THR 514 CO 0.12 -0.66 0.66 -1.48 -2.21 0.00 0.00 174.62 171.06 2qki s LEU 515 N -2.32 -0.22 -0.29 9.08 2.34 -1.00 -4.90 118.68 121.37 2qki s LEU 515 Ca 0.00 -0.54 -0.16 0.00 0.06 0.00 0.00 54.13 53.50 2qki s LEU 515 Cb -0.02 2.57 -0.03 0.00 -0.56 0.00 0.00 46.19 48.16 2qki s LEU 515 CO -0.03 -1.25 0.43 -0.63 -1.06 0.00 0.00 176.35 173.81 2qki s ILE 516 N -3.90 5.12 0.00 1.48 1.01 -1.26 -1.30 121.20 122.36 2qki s ILE 516 Ca 0.10 0.55 0.00 0.00 0.00 0.00 0.00 60.65 61.30 2qki s ILE 516 Cb -0.04 -3.79 0.00 0.00 0.01 0.00 0.00 42.46 38.64 2qki s ILE 516 CO 0.03 0.05 0.00 0.61 0.00 0.00 0.00 174.94 175.63 2qki n GLY 517 N 4.67 5.36 5.00 6.18 0.00 -0.34 -4.90 105.19 121.16 2qki n GLY 517 Ca -0.07 -1.79 0.00 0.00 0.00 0.00 0.00 46.02 44.16 2qki n GLY 517 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qki n ALA 518 N -3.00 0.00 -2.17 4.61 0.00 -1.26 -0.56 120.51 118.13 2qki n ALA 518 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 2qki n ALA 518 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 2qki n ALA 518 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2qki n SER 519 N 0.00 -0.02 0.00 0.00 3.41 -1.26 -4.94 113.62 110.82 2qki n SER 519 Ca 0.00 -1.85 0.00 0.00 -0.26 0.00 0.00 58.87 56.76 2qki n SER 519 Cb 0.00 -0.03 0.00 0.00 -0.26 0.00 0.00 64.21 63.92 2qki n SER 519 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qki n GLY 520 N 0.17 0.43 3.90 5.00 0.00 0.28 -5.05 105.19 109.92 2qki n GLY 520 Ca -0.08 -0.73 -0.33 0.00 0.00 0.00 0.00 46.02 44.89 2qki n GLY 520 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2qki s GLN 521 N -1.33 3.53 0.13 1.61 2.00 -0.87 -4.85 119.66 119.88 2qki s GLN 521 Ca 0.00 -0.21 -0.30 0.00 -2.00 0.00 0.00 55.36 52.85 2qki s GLN 521 Cb 0.00 -3.02 -0.06 0.00 0.80 0.00 0.00 33.01 30.72 2qki s GLN 521 CO 0.00 0.60 1.00 0.50 -0.50 0.00 0.00 175.29 176.89 2qki s ARG 522 N -2.17 4.68 -0.05 1.67 6.06 -1.26 -1.20 118.95 126.68 2qki s ARG 522 Ca 0.32 1.53 0.03 0.00 -2.50 0.00 0.00 55.73 55.10 2qki s ARG 522 Cb -0.13 -3.35 0.01 0.00 0.06 0.00 0.00 34.95 31.54 2qki s ARG 522 CO 0.21 0.19 -0.12 -2.00 -2.50 0.00 0.00 175.30 171.08 2qki s GLU 523 N -0.14 1.51 -0.14 5.12 2.12 -0.42 -4.94 118.70 121.81 2qki s GLU 523 Ca 0.47 -0.42 -0.03 0.00 0.36 0.00 0.00 54.97 55.35 2qki s GLU 523 Cb -0.25 -1.30 -0.03 0.00 0.26 0.00 0.00 34.13 32.81 2qki s GLU 523 CO 0.31 0.10 -0.04 0.08 -0.54 0.00 0.00 175.26 175.16 2qki s VAL 524 N 0.40 3.84 -0.13 3.70 1.01 -1.26 -2.37 120.40 125.59 2qki s VAL 524 Ca -0.09 -0.38 0.00 0.00 0.00 0.00 0.00 61.98 61.51 2qki s VAL 524 Cb -0.13 -2.66 0.02 0.00 0.00 0.00 0.00 36.38 33.61 2qki s VAL 524 CO 0.02 0.51 -0.13 -0.69 0.00 0.00 0.00 175.10 174.82 2qki s VAL 525 N 0.20 1.43 0.15 2.92 1.01 -0.21 -4.70 120.40 121.21 2qki s VAL 525 Ca -0.02 -0.55 0.10 0.00 0.00 0.00 0.00 61.98 61.50 2qki s VAL 525 Cb -0.14 -1.36 -0.04 0.00 0.00 0.00 0.00 36.38 34.84 2qki s VAL 525 CO 0.03 0.44 -0.22 0.00 0.00 0.00 0.00 175.10 175.34 2qki s ALA 526 N 1.47 2.18 0.11 5.51 0.00 -1.26 -0.72 121.76 129.05 2qki s ALA 526 Ca 0.03 -1.47 -0.02 0.00 0.00 0.00 0.00 51.96 50.51 2qki s ALA 526 Cb -0.13 -0.28 -0.04 0.00 0.00 0.00 0.00 23.12 22.68 2qki s ALA 526 CO -0.09 0.38 0.06 0.34 0.00 0.00 0.00 175.76 176.45 2qki s ASP 527 N -2.36 0.32 0.11 0.00 2.15 -0.04 -4.56 116.67 112.29 2qki s ASP 527 Ca 0.14 -1.12 -0.09 0.00 0.43 0.00 0.00 52.55 51.91 2qki s ASP 527 Cb -0.08 0.29 -0.00 0.00 -0.30 0.00 0.00 42.92 42.82 2qki s ASP 527 CO 0.07 -0.71 0.22 -0.94 -0.17 0.00 0.00 175.17 173.63 2qki s SER 528 N -3.01 0.09 -0.01 -0.34 1.04 -1.26 -0.56 113.70 109.65 2qki s SER 528 Ca 0.19 -0.69 -0.03 0.00 0.48 0.00 0.00 55.95 55.91 2qki s SER 528 Cb 0.07 0.37 -0.00 0.00 0.10 0.00 0.00 66.02 66.56 2qki s SER 528 CO -0.01 -0.77 0.05 0.54 0.98 0.00 0.00 173.24 174.03 2qki s VAL 529 N -3.88 0.05 -0.17 5.02 0.11 0.41 -2.96 120.40 118.98 2qki s VAL 529 Ca 0.08 -0.40 -0.06 0.00 -2.93 0.00 0.00 61.98 58.66 2qki s VAL 529 Cb 0.04 -0.21 -0.04 0.00 -1.53 0.00 0.00 36.38 34.64 2qki s VAL 529 CO -0.09 -0.22 0.05 0.86 -3.33 0.00 0.00 175.10 172.37 2qki s TRP 530 N -0.69 3.24 -0.15 1.54 -0.00 -1.11 -1.02 118.94 120.75 2qki s TRP 530 Ca -0.08 0.07 -0.00 0.00 -0.00 0.00 0.00 56.10 56.09 2qki s TRP 530 Cb -0.05 -2.03 0.04 0.00 -0.00 0.00 0.00 33.47 31.43 2qki s TRP 530 CO 0.00 0.20 -0.07 0.08 -0.00 0.00 0.00 176.95 177.16 2qki s VAL 531 N 0.16 1.15 0.22 5.86 1.01 0.59 -5.00 120.40 124.39 2qki s VAL 531 Ca 0.04 -0.57 -0.30 0.00 0.00 0.00 0.00 61.98 61.15 2qki s VAL 531 Cb -0.12 -1.27 -0.09 0.00 0.00 0.00 0.00 36.38 34.91 2qki s VAL 531 CO 0.01 0.22 1.15 -0.62 0.00 0.00 0.00 175.10 175.86 2qki s ASP 532 N 1.63 7.16 -0.05 3.32 2.15 -1.26 -1.28 116.67 128.34 2qki s ASP 532 Ca 0.02 2.24 0.06 0.00 0.43 0.00 0.00 52.55 55.29 2qki s ASP 532 Cb -0.14 -2.61 -0.01 0.00 -0.30 0.00 0.00 42.92 39.85 2qki s ASP 532 CO -0.08 -0.28 -0.23 -0.69 -0.17 0.00 0.00 175.17 173.72 2qki s VAL 533 N -0.48 1.91 0.18 1.11 1.01 -1.15 -4.65 120.40 118.34 2qki s VAL 533 Ca 0.49 -0.99 -0.33 0.00 0.00 0.00 0.00 61.98 61.16 2qki s VAL 533 Cb -0.32 -1.62 -0.14 0.00 0.00 0.00 0.00 36.38 34.30 2qki s VAL 533 CO 0.38 0.53 1.44 1.17 0.00 0.00 0.00 175.10 178.62 2qki n LYS 534 N 2.99 1.87 -1.91 2.72 3.00 0.19 -4.50 118.16 122.52 2qki n LYS 534 Ca -0.18 0.67 -0.40 0.00 -0.00 0.00 0.00 58.31 58.41 2qki n LYS 534 Cb 0.52 -2.35 0.01 0.00 0.00 0.00 0.00 35.03 33.21 2qki n LYS 534 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 2qki s ASP 535 N 0.51 6.05 0.04 3.14 1.11 -1.26 -4.90 116.67 121.37 2qki s ASP 535 Ca 0.75 2.80 -0.09 0.00 0.18 0.00 0.00 52.55 56.19 2qki s ASP 535 Cb -0.72 -2.65 0.03 0.00 1.07 0.00 0.00 42.92 40.65 2qki s ASP 535 CO 0.45 -1.04 0.43 -1.54 1.18 0.00 0.00 175.17 174.65 2qki n SER 536 N -0.07 -0.58 -4.87 0.27 3.41 -1.26 -5.15 113.62 105.36 2qki n SER 536 Ca 0.05 -1.25 -0.31 0.00 -0.26 0.00 0.00 58.87 57.10 2qki n SER 536 Cb 0.43 0.94 0.01 0.00 -0.26 0.00 0.00 64.21 65.32 2qki n SER 536 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qki h VAL 538 N -0.28 1.47 0.00 0.00 2.07 -1.99 -3.45 116.25 114.07 2qki h VAL 538 Ca -0.44 -1.51 0.00 0.00 0.82 0.00 0.00 66.70 65.57 2qki h VAL 538 Cb 1.19 2.42 0.00 0.00 -1.52 0.00 0.00 31.29 33.38 2qki h VAL 538 CO 0.62 0.41 0.00 0.61 0.02 0.00 0.00 177.57 179.23 2qki n GLY 539 N 0.59 1.03 3.50 2.17 0.00 -1.26 -5.00 105.19 106.23 2qki n GLY 539 Ca -0.09 -0.68 -0.17 0.00 0.00 0.00 0.00 46.02 45.09 2qki n GLY 539 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2qki s SER 540 N -1.00 -0.64 -0.23 1.61 1.04 -1.26 -5.08 113.70 108.14 2qki s SER 540 Ca 0.00 0.58 -0.10 0.00 0.48 0.00 0.00 55.95 56.92 2qki s SER 540 Cb 0.00 0.55 0.09 0.00 0.10 0.00 0.00 66.02 66.76 2qki s SER 540 CO 0.00 -0.67 0.52 -0.22 0.98 0.00 0.00 173.24 173.85 2qki s LEU 541 N -1.47 -0.71 -0.02 2.42 2.96 -1.26 -3.62 118.68 116.99 2qki s LEU 541 Ca -0.09 1.20 0.02 0.00 -0.22 0.00 0.00 54.13 55.05 2qki s LEU 541 Cb -0.00 1.75 0.00 0.00 0.50 0.00 0.00 46.19 48.44 2qki s LEU 541 CO 0.06 -0.22 -0.08 -0.69 -1.32 0.00 0.00 176.35 174.10 2qki s VAL 542 N 2.30 0.65 -0.14 1.68 1.01 -0.08 -5.02 120.40 120.80 2qki s VAL 542 Ca -0.06 -0.31 -0.02 0.00 0.00 0.00 0.00 61.98 61.59 2qki s VAL 542 Cb -0.10 -0.57 -0.02 0.00 0.00 0.00 0.00 36.38 35.68 2qki s VAL 542 CO -0.15 0.20 -0.06 -0.69 0.00 0.00 0.00 175.10 174.40 2qki s VAL 543 N 0.09 3.69 0.21 2.92 1.01 -1.26 -0.96 120.40 126.10 2qki s VAL 543 Ca -0.01 -0.44 -0.01 0.00 0.00 0.00 0.00 61.98 61.52 2qki s VAL 543 Cb -0.06 -2.59 0.01 0.00 0.00 0.00 0.00 36.38 33.74 2qki s VAL 543 CO 0.00 0.51 0.29 2.29 0.00 0.00 0.00 175.10 178.20 2qki n LYS 544 N 3.35 0.42 -2.81 2.72 2.85 0.57 -4.99 118.16 120.27 2qki n LYS 544 Ca -0.18 -1.62 -0.39 0.00 -1.05 0.00 0.00 58.31 55.07 2qki n LYS 544 Cb 0.53 1.58 -0.06 0.00 -0.65 0.00 0.00 35.03 36.42 2qki n LYS 544 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 2qki s SER 545 N -2.26 7.52 0.00 -5.58 0.15 -1.26 -0.10 113.70 112.17 2qki s SER 545 Ca 0.17 1.85 0.28 0.00 0.70 0.00 0.00 55.95 58.94 2qki s SER 545 Cb -0.01 -2.58 1.00 0.00 -1.71 0.00 0.00 66.02 62.73 2qki s SER 545 CO 0.12 0.12 1.74 0.61 1.20 0.00 0.00 173.24 177.02 2qki n GLY 546 N 1.29 -1.14 3.68 9.45 0.00 0.43 -4.61 105.19 114.28 2qki n GLY 546 Ca -0.02 -0.26 -0.40 0.00 0.00 0.00 0.00 46.02 45.34 2qki n GLY 546 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2qki s GLN 552 N -2.75 4.27 0.90 1.61 0.74 -1.26 -4.44 119.66 118.73 2qki s GLN 552 Ca 0.20 0.69 -0.10 0.00 0.05 0.00 0.00 55.36 56.20 2qki s GLN 552 Cb 0.19 -3.54 0.13 0.00 1.10 0.00 0.00 33.01 30.89 2qki s GLN 552 CO 0.55 -0.16 1.13 -1.25 -0.55 0.00 0.00 175.29 175.01 2qki s PRO 553 N 1.63 1.18 0.08 1.67 0.04 -1.26 -5.05 135.00 133.29 2qki s PRO 553 Ca 0.31 1.43 0.06 0.00 0.04 0.00 0.00 61.00 62.85 2qki s PRO 553 Cb -0.16 -1.75 -0.04 0.00 0.04 0.00 0.00 34.50 32.59 2qki s PRO 553 CO 0.12 -2.48 -0.11 0.08 0.04 0.00 0.00 177.00 174.65 2qki s VAL 554 N -2.70 3.33 0.08 -0.36 1.01 -1.26 -5.07 120.40 115.44 2qki s VAL 554 Ca 0.66 -1.18 -0.37 0.00 0.00 0.00 0.00 61.98 61.09 2qki s VAL 554 Cb -0.22 -2.52 -0.17 0.00 0.00 0.00 0.00 36.38 33.47 2qki s VAL 554 CO 0.58 0.19 1.28 -2.65 0.00 0.00 0.00 175.10 174.50 2qki n PRO 555 N 0.95 1.00 -0.33 2.72 -0.02 -1.26 -1.96 135.00 136.11 2qki n PRO 555 Ca -0.14 0.36 0.00 0.00 -2.02 0.00 0.00 63.50 61.70 2qki n PRO 555 Cb 0.52 -1.97 0.00 0.00 -0.02 0.00 0.00 33.50 32.04 2qki n PRO 555 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qki n GLY 556 N 2.34 1.61 3.75 -1.23 0.00 -1.26 -5.01 105.19 105.39 2qki n GLY 556 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 2qki n GLY 556 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2qki s GLN 557 N -0.27 4.52 0.27 1.61 0.74 -0.83 -5.01 119.66 120.69 2qki s GLN 557 Ca 0.00 1.94 -0.29 0.00 0.05 0.00 0.00 55.36 57.05 2qki s GLN 557 Cb 0.00 -3.18 -0.09 0.00 1.10 0.00 0.00 33.01 30.84 2qki s GLN 557 CO 0.00 0.01 1.22 -1.14 -0.55 0.00 0.00 175.29 174.82 2qki s GLN 558 N -1.10 4.48 0.05 1.67 0.74 -1.26 -4.95 119.66 119.28 2qki s GLN 558 Ca 0.49 1.99 -0.07 0.00 0.05 0.00 0.00 55.36 57.82 2qki s GLN 558 Cb -0.34 -3.16 -0.01 0.00 1.10 0.00 0.00 33.01 30.60 2qki s GLN 558 CO 0.42 -0.04 0.13 0.00 -0.55 0.00 0.00 175.29 175.25 2qki s MET 559 N -1.15 0.66 -0.21 1.67 0.23 -1.26 -5.08 119.30 114.17 2qki s MET 559 Ca 0.49 -0.80 -0.13 0.00 -1.03 0.00 0.00 55.69 54.22 2qki s MET 559 Cb -0.35 0.26 -0.04 0.00 -1.53 0.00 0.00 34.83 33.16 2qki s MET 559 CO 0.44 -0.18 0.28 0.99 -2.03 0.00 0.00 175.02 174.52 2qki s THR 560 N -2.93 5.29 -0.09 3.16 2.01 -1.26 -5.01 115.64 116.80 2qki s THR 560 Ca -0.02 0.46 -0.06 0.00 0.31 0.00 0.00 61.69 62.39 2qki s THR 560 Cb 0.01 -3.62 -0.04 0.00 0.01 0.00 0.00 72.50 68.86 2qki s THR 560 CO -0.06 0.32 0.15 -0.22 -0.69 0.00 0.00 174.62 174.12 2qki s LEU 561 N 0.99 4.38 -0.23 4.42 2.96 -1.26 0.16 118.68 130.11 2qki s LEU 561 Ca 0.14 0.43 0.01 0.00 -0.22 0.00 0.00 54.13 54.50 2qki s LEU 561 Cb -0.14 -2.22 0.04 0.00 0.50 0.00 0.00 46.19 44.37 2qki s LEU 561 CO 0.05 0.37 -0.14 -0.75 -1.32 0.00 0.00 176.35 174.56 2qki s LYS 562 N -1.29 2.64 -0.24 1.98 2.20 0.86 -4.68 119.74 121.22 2qki s LYS 562 Ca 0.18 -1.08 -0.03 0.00 -0.36 0.00 0.00 55.97 54.68 2qki s LYS 562 Cb -0.12 -2.77 0.01 0.00 -1.51 0.00 0.00 37.83 33.44 2qki s LYS 562 CO 0.08 -0.40 -0.05 0.42 -0.36 0.00 0.00 175.35 175.05 2qki s ILE 563 N 1.21 3.16 -0.16 5.43 1.01 -1.26 -0.32 121.20 130.28 2qki s ILE 563 Ca -0.02 -0.74 0.01 0.00 0.00 0.00 0.00 60.65 59.90 2qki s ILE 563 Cb -0.17 -2.52 0.00 0.00 0.01 0.00 0.00 42.46 39.79 2qki s ILE 563 CO -0.08 0.31 -0.17 -1.61 0.00 0.00 0.00 174.94 173.38 2qki s GLU 564 N 1.41 3.13 0.00 2.79 2.02 -0.13 -5.00 118.70 122.92 2qki s GLU 564 Ca 0.03 -0.79 0.00 0.00 0.02 0.00 0.00 54.97 54.24 2qki s GLU 564 Cb -0.15 -2.58 0.00 0.00 0.10 0.00 0.00 34.13 31.50 2qki s GLU 564 CO -0.04 -0.03 0.00 0.41 0.02 0.00 0.00 175.26 175.62 2qki n GLY 565 N 4.16 1.62 3.76 -1.39 0.00 -1.26 -0.90 105.19 111.18 2qki n GLY 565 Ca -0.20 -0.90 -0.39 0.00 0.00 0.00 0.00 46.02 44.53 2qki n GLY 565 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2qki s ASP 566 N -0.48 7.26 0.27 1.61 1.01 -1.24 -4.98 116.67 120.13 2qki s ASP 566 Ca 0.00 2.09 -0.30 0.00 0.71 0.00 0.00 52.55 55.05 2qki s ASP 566 Cb 0.00 -2.61 -0.11 0.00 1.01 0.00 0.00 42.92 41.21 2qki s ASP 566 CO 0.00 -0.13 1.55 -2.28 0.21 0.00 0.00 175.17 174.51 2qki s HIS 567 N -1.33 2.85 0.00 4.23 5.65 -1.26 -2.37 115.29 123.06 2qki s HIS 567 Ca 0.47 0.85 0.00 0.00 0.25 0.00 0.00 55.06 56.63 2qki s HIS 567 Cb -0.27 -3.99 0.00 0.00 -1.18 0.00 0.00 32.58 27.15 2qki s HIS 567 CO 0.34 -3.31 0.00 0.41 -0.65 0.00 0.00 174.74 171.53 2qki n GLY 568 N 2.25 1.21 3.82 1.59 0.00 -1.26 -5.04 105.19 107.75 2qki n GLY 568 Ca 0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.77 2qki n GLY 568 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qki s ALA 569 N -3.29 3.01 -0.26 4.61 0.00 -1.00 -5.04 121.76 119.79 2qki s ALA 569 Ca 0.00 0.43 -0.11 0.00 0.00 0.00 0.00 51.96 52.28 2qki s ALA 569 Cb 0.00 -3.17 -0.05 0.00 0.00 0.00 0.00 23.12 19.90 2qki s ALA 569 CO 0.00 0.04 0.19 0.50 0.00 0.00 0.00 175.76 176.49 2qki s ARG 570 N -3.21 4.00 -0.16 0.00 3.52 -1.26 -5.03 118.95 116.81 2qki s ARG 570 Ca 0.63 -0.27 -0.04 0.00 -0.13 0.00 0.00 55.73 55.91 2qki s ARG 570 Cb -0.10 -3.61 -0.03 0.00 -1.56 0.00 0.00 34.95 29.65 2qki s ARG 570 CO 0.15 -0.09 -0.02 0.08 -0.81 0.00 0.00 175.30 174.61 2qki s VAL 571 N 1.49 4.00 -0.06 7.11 1.01 -1.26 -5.10 120.40 127.60 2qki s VAL 571 Ca 0.08 -0.32 0.03 0.00 0.00 0.00 0.00 61.98 61.78 2qki s VAL 571 Cb -0.15 -2.77 -0.02 0.00 0.00 0.00 0.00 36.38 33.44 2qki s VAL 571 CO 0.08 0.48 -0.15 0.68 0.00 0.00 0.00 175.10 176.20 2qki s VAL 572 N 0.41 2.96 0.13 2.92 -7.23 -1.26 -5.13 120.40 113.20 2qki s VAL 572 Ca -0.03 -0.75 0.10 0.00 -1.81 0.00 0.00 61.98 59.49 2qki s VAL 572 Cb -0.14 -2.16 -0.04 0.00 0.56 0.00 0.00 36.38 34.60 2qki s VAL 572 CO 0.03 0.58 -0.24 -0.76 -0.31 0.00 0.00 175.10 174.39 2qki s LEU 573 N -0.50 2.33 0.07 1.32 1.43 -1.26 -5.15 118.68 116.92 2qki s LEU 573 Ca 0.06 -0.74 0.02 0.00 -1.03 0.00 0.00 54.13 52.45 2qki s LEU 573 Cb -0.12 -1.08 -0.03 0.00 0.03 0.00 0.00 46.19 44.99 2qki s LEU 573 CO 0.02 0.12 -0.08 0.68 0.23 0.00 0.00 176.35 177.32 2qki s VAL 574 N -1.18 0.65 -0.12 -1.59 -7.23 -1.26 -5.14 120.40 104.53 2qki s VAL 574 Ca 0.12 -1.41 0.02 0.00 -1.81 0.00 0.00 61.98 58.90 2qki s VAL 574 Cb -0.10 -1.04 -0.00 0.00 0.56 0.00 0.00 36.38 35.80 2qki s VAL 574 CO 0.06 -0.54 -0.18 0.00 -0.31 0.00 0.00 175.10 174.12 2qki s ALA 575 N -2.17 2.39 -0.05 1.32 0.00 -1.26 -5.12 121.76 116.87 2qki s ALA 575 Ca -0.01 -0.96 0.04 0.00 0.00 0.00 0.00 51.96 51.02 2qki s ALA 575 Cb -0.05 -1.04 -0.00 0.00 0.00 0.00 0.00 23.12 22.04 2qki s ALA 575 CO -0.01 0.20 -0.16 0.08 0.00 0.00 0.00 175.76 175.87 2qki s VAL 576 N 0.46 1.32 0.04 0.00 1.01 -1.26 -5.10 120.40 116.87 2qki s VAL 576 Ca -0.13 -0.65 -0.30 0.00 0.00 0.00 0.00 61.98 60.90 2qki s VAL 576 Cb -0.17 -1.15 -0.08 0.00 0.00 0.00 0.00 36.38 34.98 2qki s VAL 576 CO 0.05 0.39 1.84 -0.62 0.00 0.00 0.00 175.10 176.76 2qki s ASP 577 N 0.15 6.51 0.42 3.32 -1.08 -1.26 -4.88 116.67 119.85 2qki s ASP 577 Ca -0.06 2.57 0.25 0.00 -0.52 0.00 0.00 52.55 54.80 2qki s ASP 577 Cb -0.12 -2.54 1.38 0.00 -1.46 0.00 0.00 42.92 40.18 2qki s ASP 577 CO 0.02 -1.00 1.76 0.11 0.52 0.00 0.00 175.17 176.58 2qki h LYS 578 N 9.76 0.00 0.00 4.34 1.57 -1.99 0.07 116.57 130.32 2qki h LYS 578 Ca -0.46 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.29 2qki h LYS 578 Cb 1.22 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.52 2qki h LYS 578 CO 0.94 0.00 -0.12 0.78 -0.57 0.00 0.00 179.45 180.48 2qki h GLY 579 N 0.00 0.00 0.93 3.86 0.00 -1.90 -2.82 103.07 103.14 2qki h GLY 579 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.35 2qki h GLY 579 CO 0.00 0.00 0.41 -2.08 0.00 0.00 0.00 176.54 174.87 2qki h VAL 580 N 0.00 1.12 0.00 4.60 2.07 -1.35 -2.66 116.25 120.03 2qki h VAL 580 Ca -0.00 -0.28 -0.01 0.00 0.82 0.00 0.00 66.70 67.23 2qki h VAL 580 Cb 0.25 0.23 -0.00 0.00 -1.52 0.00 0.00 31.29 30.24 2qki h VAL 580 CO 0.02 0.15 -0.04 -0.26 0.02 0.00 0.00 177.57 177.45 2qki h PHE 581 N 0.82 0.00 0.00 1.57 0.04 -1.62 -2.21 116.94 115.53 2qki h PHE 581 Ca 0.25 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.96 2qki h PHE 581 Cb -0.03 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.11 2qki h PHE 581 CO -0.04 0.04 -0.27 0.28 -0.60 0.00 0.00 178.31 177.72 2qki h VAL 582 N 0.00 1.17 0.03 -0.55 2.07 -1.43 -3.17 116.25 114.37 2qki h VAL 582 Ca -0.00 -0.92 -0.31 0.00 0.82 0.00 0.00 66.70 66.28 2qki h VAL 582 Cb 0.62 1.50 -0.04 0.00 -1.52 0.00 0.00 31.29 31.84 2qki h VAL 582 CO 0.01 0.26 -1.83 0.18 0.02 0.00 0.00 177.57 176.21 2qki n LEU 583 N -4.19 1.26 -3.45 2.57 4.77 -0.88 -4.95 117.00 112.14 2qki n LEU 583 Ca -0.02 0.34 0.01 0.00 -0.03 0.00 0.00 56.01 56.30 2qki n LEU 583 Cb 0.32 -0.12 -0.04 0.00 -2.33 0.00 0.00 43.42 41.25 2qki n LEU 583 CO 0.37 0.51 0.49 0.21 -1.33 0.00 0.00 177.39 177.65 2qki s ASN 584 N -6.28 -0.77 -0.12 -1.43 3.84 -0.92 -5.04 114.94 104.22 2qki s ASN 584 Ca -0.10 0.99 0.18 0.00 0.21 0.00 0.00 52.86 54.14 2qki s ASN 584 Cb 0.08 1.85 0.27 0.00 -0.55 0.00 0.00 41.25 42.89 2qki s ASN 584 CO 0.81 -0.15 1.14 2.29 -2.79 0.00 0.00 177.10 178.40 2qki n LYS 585 N 5.15 1.19 -2.72 0.43 2.85 -1.25 -3.96 118.16 119.85 2qki n LYS 585 Ca -0.09 -2.46 -0.24 0.00 -1.05 0.00 0.00 58.31 54.46 2qki n LYS 585 Cb 0.52 -1.42 0.02 0.00 -0.65 0.00 0.00 35.03 33.49 2qki n LYS 585 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 2qki s LYS 586 N -2.66 3.00 -1.50 -1.58 1.02 -1.26 -4.49 119.74 112.27 2qki s LYS 586 Ca 0.30 -0.28 0.00 0.00 0.02 0.00 0.00 55.97 56.01 2qki s LYS 586 Cb 0.26 -2.43 0.00 0.00 -0.52 0.00 0.00 37.83 35.14 2qki s LYS 586 CO 0.03 -0.46 0.00 0.09 -0.92 0.00 0.00 175.35 174.09 2qki n ASN 587 N -2.30 -4.86 -4.83 2.83 3.02 -1.26 -4.84 115.26 103.02 2qki n ASN 587 Ca 0.03 0.13 -0.35 0.00 -0.03 0.00 0.00 54.58 54.36 2qki n ASN 587 Cb 0.58 -3.91 -0.06 0.00 -0.61 0.00 0.00 39.78 35.78 2qki n ASN 587 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2qki s LYS 588 N -4.29 4.17 -0.05 3.52 1.02 -1.26 -4.79 119.74 118.06 2qki s LYS 588 Ca 0.00 0.80 -0.30 0.00 0.02 0.00 0.00 55.97 56.49 2qki s LYS 588 Cb 0.00 -2.74 -0.02 0.00 -0.52 0.00 0.00 37.83 34.54 2qki s LYS 588 CO 0.00 0.32 1.01 -1.17 -0.92 0.00 0.00 175.35 174.59 2qki s LEU 589 N -2.28 4.31 0.06 3.17 2.96 -1.26 -5.04 118.68 120.59 2qki s LEU 589 Ca 0.46 1.61 0.02 0.00 -0.22 0.00 0.00 54.13 56.00 2qki s LEU 589 Cb -0.15 -3.56 -0.03 0.00 0.50 0.00 0.00 46.19 42.95 2qki s LEU 589 CO 0.20 -0.37 -0.07 0.42 -1.32 0.00 0.00 176.35 175.22 2qki s THR 590 N 1.54 0.53 0.32 3.68 -4.23 -1.26 -5.05 115.64 111.16 2qki s THR 590 Ca 0.50 -1.43 0.05 0.00 -1.18 0.00 0.00 61.69 59.64 2qki s THR 590 Cb -0.20 -1.03 0.10 0.00 1.34 0.00 0.00 72.50 72.71 2qki s THR 590 CO 0.23 -0.62 1.79 -0.61 -0.54 0.00 0.00 174.62 174.88 2qki h GLN 591 N 3.86 0.39 -0.35 3.99 5.75 -2.00 -2.71 115.11 124.04 2qki h GLN 591 Ca -0.35 -0.12 -0.10 0.00 -0.15 0.00 0.00 58.65 57.92 2qki h GLN 591 Cb 1.18 -0.04 -0.01 0.00 1.07 0.00 0.00 27.48 29.68 2qki h GLN 591 CO 0.51 0.58 -0.21 0.66 -2.65 0.00 0.00 178.83 177.72 2qki h SER 592 N 0.35 0.68 -0.32 -0.69 4.64 -1.96 -2.50 113.55 113.74 2qki h SER 592 Ca 0.06 -0.23 -0.05 0.00 -0.47 0.00 0.00 61.79 61.10 2qki h SER 592 Cb 0.56 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 62.44 2qki h SER 592 CO 0.04 0.88 0.06 0.11 -0.87 0.00 0.00 176.83 177.05 2qki h LYS 593 N 0.59 0.63 -0.20 4.77 1.57 -1.93 -1.91 116.57 120.09 2qki h LYS 593 Ca 0.09 -0.12 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 2qki h LYS 593 Cb 0.68 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.89 2qki h LYS 593 CO 0.05 0.60 0.08 0.82 -0.57 0.00 0.00 179.45 180.43 2qki h ILE 594 N 0.60 1.17 -0.31 1.86 2.04 -1.17 -2.45 117.51 119.25 2qki h ILE 594 Ca 0.13 -0.52 -0.02 0.00 1.00 0.00 0.00 64.86 65.46 2qki h ILE 594 Cb 0.29 1.14 -0.02 0.00 -0.74 0.00 0.00 36.82 37.49 2qki h ILE 594 CO 0.00 0.17 0.12 -0.50 0.00 0.00 0.00 178.15 177.94 2qki h TRP 595 N 0.17 0.43 -0.69 1.37 -0.00 -1.35 -1.59 115.95 114.28 2qki h TRP 595 Ca 0.07 -0.01 -0.03 0.00 -0.00 0.00 0.00 58.89 58.91 2qki h TRP 595 Cb 0.19 -0.14 -0.03 0.00 -0.00 0.00 0.00 29.16 29.18 2qki h TRP 595 CO -0.01 0.35 0.30 -0.44 -0.00 0.00 0.00 178.44 178.64 2qki h ASP 596 N 0.43 0.90 -0.64 -3.49 3.32 -1.18 -0.10 116.42 115.68 2qki h ASP 596 Ca 0.11 -0.11 -0.09 0.00 0.02 0.00 0.00 57.03 56.96 2qki h ASP 596 Cb 0.10 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.40 2qki h ASP 596 CO -0.01 0.79 0.04 0.58 -1.72 0.00 0.00 179.24 178.92 2qki h VAL 597 N 0.98 1.27 -0.19 -1.35 2.07 -0.84 -2.31 116.25 115.88 2qki h VAL 597 Ca 0.24 -1.12 -0.03 0.00 0.82 0.00 0.00 66.70 66.61 2qki h VAL 597 Cb 0.14 0.73 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 2qki h VAL 597 CO -0.03 0.41 -0.01 0.58 0.02 0.00 0.00 177.57 178.54 2qki h VAL 598 N 1.01 1.26 -0.85 2.57 2.07 -1.09 -3.06 116.25 118.16 2qki h VAL 598 Ca 0.19 -0.91 -0.03 0.00 0.82 0.00 0.00 66.70 66.77 2qki h VAL 598 Cb 0.52 1.49 -0.04 0.00 -1.52 0.00 0.00 31.29 31.74 2qki h VAL 598 CO 0.02 0.28 0.43 -0.33 0.02 0.00 0.00 177.57 177.99 2qki h GLU 599 N 0.09 1.21 0.00 1.57 4.39 -1.02 -2.31 114.58 118.50 2qki h GLU 599 Ca 0.05 -0.16 -0.01 0.00 0.34 0.00 0.00 59.36 59.58 2qki h GLU 599 Cb 0.42 -0.23 -0.00 0.00 -0.10 0.00 0.00 28.75 28.84 2qki h GLU 599 CO 0.01 0.91 -0.06 0.87 -1.16 0.00 0.00 179.01 179.59 2qki h LYS 600 N 1.20 0.00 -0.54 2.33 1.79 -1.41 -2.58 116.57 117.37 2qki h LYS 600 Ca 0.30 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.77 2qki h LYS 600 Cb 0.08 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.73 2qki h LYS 600 CO -0.04 0.06 0.00 0.00 -1.08 0.00 0.00 179.45 178.38 2qki n ALA 601 N -2.18 2.41 -1.68 3.86 0.00 -0.87 -4.94 120.51 117.11 2qki n ALA 601 Ca -0.02 -0.97 -0.44 0.00 0.00 0.00 0.00 53.44 52.01 2qki n ALA 601 Cb 0.21 -0.96 -0.03 0.00 0.00 0.00 0.00 19.45 18.67 2qki n ALA 601 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2qki n ASP 602 N 1.13 2.89 0.09 0.00 2.03 -0.97 -4.89 116.55 116.83 2qki n ASP 602 Ca 0.19 1.14 0.06 0.00 0.52 0.00 0.00 54.79 56.70 2qki n ASP 602 Cb 0.47 -1.45 -0.01 0.00 -0.72 0.00 0.00 41.12 39.41 2qki n ASP 602 CO 0.00 0.00 0.00 0.16 -1.92 0.00 0.00 177.20 175.44 2qki h ILE 603 N 3.09 0.31 -3.86 5.18 3.07 -1.92 -3.45 117.51 119.95 2qki h ILE 603 Ca -0.45 -1.56 -0.51 0.00 1.55 0.00 0.00 64.86 63.89 2qki h ILE 603 Cb 1.27 1.88 0.04 0.00 -0.27 0.00 0.00 36.82 39.74 2qki h ILE 603 CO 0.76 0.18 0.54 -0.83 -1.05 0.00 0.00 178.15 177.75 2qki s GLY 604 N -4.53 3.01 0.00 0.16 0.00 -1.26 -4.19 107.32 100.50 2qki s GLY 604 Ca -0.00 1.04 0.01 0.00 0.00 0.00 0.00 44.72 45.77 2qki s GLY 604 CO 0.78 1.65 0.28 0.00 0.00 0.00 0.00 173.10 175.81 2qki s THR 606 N -0.66 0.40 -0.48 0.00 -4.23 -1.20 -5.01 115.64 104.46 2qki s THR 606 Ca 0.01 -1.98 0.24 0.00 -1.18 0.00 0.00 61.69 58.78 2qki s THR 606 Cb 0.01 -2.38 0.25 0.00 1.34 0.00 0.00 72.50 71.72 2qki s THR 606 CO 0.04 -0.20 1.72 -2.65 -0.54 0.00 0.00 174.62 172.99 2qki n PRO 607 N -0.31 0.20 0.00 3.99 -0.02 -1.26 -4.90 135.00 132.70 2qki n PRO 607 Ca -0.02 0.42 0.00 0.00 -2.02 0.00 0.00 63.50 61.88 2qki n PRO 607 Cb 0.65 -1.88 0.00 0.00 -0.02 0.00 0.00 33.50 32.25 2qki n PRO 607 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qki n GLY 608 N 0.04 1.13 7.00 -1.23 0.00 -1.26 -2.75 105.19 108.13 2qki n GLY 608 Ca 0.02 -1.65 0.00 0.00 0.00 0.00 0.00 46.02 44.39 2qki n GLY 608 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2qki n SER 609 N 0.00 -2.66 0.00 1.61 2.88 -1.15 -4.41 113.62 109.89 2qki n SER 609 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2qki n SER 609 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2qki n SER 609 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2qki n GLY 610 N 0.00 -0.93 0.32 0.46 0.00 -1.26 -4.21 105.19 99.56 2qki n GLY 610 Ca 0.00 -1.03 -0.06 0.00 0.00 0.00 0.00 46.02 44.93 2qki n GLY 610 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2qki h LYS 611 N 0.00 1.10 0.00 1.61 3.64 -1.91 -3.41 116.57 117.61 2qki h LYS 611 Ca 0.00 -0.18 -0.07 0.00 -1.27 0.00 0.00 60.65 59.13 2qki h LYS 611 Cb 0.00 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.62 2qki h LYS 611 CO 0.00 0.88 0.02 -0.40 -2.27 0.00 0.00 179.45 177.68 2qki n ASP 612 N -4.36 -0.74 -0.34 4.20 5.68 -1.26 0.44 116.55 120.17 2qki n ASP 612 Ca 0.06 -1.73 -0.01 0.00 -0.50 0.00 0.00 54.79 52.62 2qki n ASP 612 Cb 0.16 1.29 0.12 0.00 -1.14 0.00 0.00 41.12 41.55 2qki n ASP 612 CO 0.00 0.00 0.00 0.10 -1.33 0.00 0.00 177.20 175.97 2qki h TYR 613 N 1.41 1.14 -0.04 2.11 -0.00 -1.84 -0.53 116.97 119.22 2qki h TYR 613 Ca -0.12 0.03 -0.00 0.00 0.00 0.00 0.00 58.73 58.63 2qki h TYR 613 Cb 0.50 -0.38 -0.00 0.00 0.00 0.00 0.00 36.73 36.85 2qki h TYR 613 CO 0.00 0.66 0.01 0.00 -0.00 0.00 0.00 178.16 178.84 2qki h ALA 614 N 1.38 0.05 -0.97 0.10 0.00 -1.93 -2.80 119.26 115.08 2qki h ALA 614 Ca 0.37 -0.10 0.09 0.00 0.00 0.00 0.00 54.91 55.26 2qki h ALA 614 Cb -0.02 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 17.69 2qki h ALA 614 CO -0.11 -0.35 0.62 0.78 0.00 0.00 0.00 179.25 180.19 2qki h GLY 615 N -0.13 1.50 0.26 0.00 0.00 -1.88 -1.82 103.07 101.00 2qki h GLY 615 Ca 0.01 -0.43 -0.00 0.00 0.00 0.00 0.00 47.33 46.91 2qki h GLY 615 CO -0.00 0.25 -0.36 -2.08 0.00 0.00 0.00 176.54 174.35 2qki h VAL 616 N 1.04 0.00 -0.53 4.60 2.07 -0.85 -0.34 116.25 122.24 2qki h VAL 616 Ca 0.45 0.00 0.10 0.00 0.82 0.00 0.00 66.70 68.07 2qki h VAL 616 Cb 0.33 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.01 2qki h VAL 616 CO -0.20 0.00 -0.00 -0.26 0.02 0.00 0.00 177.57 177.13 2qki h PHE 617 N -0.64 -0.03 -0.14 1.57 0.04 -1.44 -2.85 116.94 113.44 2qki h PHE 617 Ca -0.03 0.04 -0.06 0.00 2.80 0.00 0.00 57.97 60.71 2qki h PHE 617 Cb 0.58 0.10 -0.00 0.00 2.20 0.00 0.00 35.95 38.83 2qki h PHE 617 CO -0.27 -0.13 -0.16 1.03 -0.60 0.00 0.00 178.31 178.19 2qki h SER 618 N 0.12 0.38 -0.00 2.17 0.87 -1.25 -0.58 113.55 115.26 2qki h SER 618 Ca 0.27 -0.50 0.00 0.00 -1.23 0.00 0.00 61.79 60.33 2qki h SER 618 Cb 0.41 -0.11 -0.00 0.00 -0.44 0.00 0.00 62.40 62.27 2qki h SER 618 CO -0.45 0.80 0.01 0.44 -0.53 0.00 0.00 176.83 177.10 2qki h ASP 619 N -0.03 0.00 -0.42 6.23 3.32 -1.04 -1.07 116.42 123.40 2qki h ASP 619 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 2qki h ASP 619 Cb 0.70 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.25 2qki h ASP 619 CO 0.04 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.56 2qki n ALA 620 N -2.16 2.44 -1.06 3.45 0.00 -0.99 0.35 120.51 122.55 2qki n ALA 620 Ca -0.03 -0.84 0.00 0.00 0.00 0.00 0.00 53.44 52.57 2qki n ALA 620 Cb 0.08 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 18.56 2qki n ALA 620 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qki n GLY 621 N 1.31 0.41 3.45 0.00 0.00 -0.40 -4.24 105.19 105.72 2qki n GLY 621 Ca 0.17 -1.03 -0.30 0.00 0.00 0.00 0.00 46.02 44.86 2qki n GLY 621 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qki s LEU 622 N 0.00 2.56 0.20 0.99 1.43 -0.26 -0.14 118.68 123.47 2qki s LEU 622 Ca 0.00 -0.51 -0.08 0.00 -1.03 0.00 0.00 54.13 52.51 2qki s LEU 622 Cb 0.00 -1.48 -0.07 0.00 0.03 0.00 0.00 46.19 44.68 2qki s LEU 622 CO 0.00 0.23 0.50 0.42 0.23 0.00 0.00 176.35 177.72 2qki s THR 623 N -0.99 5.01 -0.01 5.49 -4.23 0.16 -3.38 115.64 117.69 2qki s THR 623 Ca 0.15 0.32 0.02 0.00 -1.18 0.00 0.00 61.69 61.00 2qki s THR 623 Cb -0.10 -3.62 -0.00 0.00 1.34 0.00 0.00 72.50 70.11 2qki s THR 623 CO 0.06 -0.05 -0.07 0.12 -0.54 0.00 0.00 174.62 174.15 2qki s PHE 624 N -1.78 0.67 -0.15 3.99 5.36 -1.26 -3.35 117.98 121.46 2qki s PHE 624 Ca 0.45 -0.14 -0.10 0.00 -0.96 0.00 0.00 56.93 56.18 2qki s PHE 624 Cb -0.11 -0.46 0.05 0.00 -0.34 0.00 0.00 43.02 42.15 2qki s PHE 624 CO 0.23 -0.05 0.37 0.99 -1.46 0.00 0.00 175.22 175.30 2qki s THR 625 N 0.04 -0.02 0.24 0.12 2.01 -0.68 -1.20 115.64 116.15 2qki s THR 625 Ca -0.00 0.06 0.07 0.00 0.31 0.00 0.00 61.69 62.13 2qki s THR 625 Cb -0.05 -0.54 -0.05 0.00 0.01 0.00 0.00 72.50 71.87 2qki s THR 625 CO -0.00 0.03 -0.10 -0.94 -0.69 0.00 0.00 174.62 172.92 2qki s SER 626 N 0.89 2.59 0.60 3.53 1.04 -0.40 0.26 113.70 122.22 2qki s SER 626 Ca -0.06 -1.10 0.37 0.00 0.48 0.00 0.00 55.95 55.64 2qki s SER 626 Cb -0.06 -0.14 1.92 0.00 0.10 0.00 0.00 66.02 67.84 2qki s SER 626 CO -0.07 -0.26 2.20 0.77 0.98 0.00 0.00 173.24 176.86 2qki h SER 627 N 2.44 0.00 -0.34 7.02 4.64 -1.06 -2.52 113.55 123.73 2qki h SER 627 Ca -0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 2qki h SER 627 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 2qki h SER 627 CO 0.64 0.02 0.00 -1.54 -0.87 0.00 0.00 176.83 175.09 2qki n SER 628 N -3.24 2.98 0.00 4.97 3.41 -1.26 -4.96 113.62 115.52 2qki n SER 628 Ca -0.02 -1.93 0.00 0.00 -0.26 0.00 0.00 58.87 56.67 2qki n SER 628 Cb 0.17 -0.22 0.00 0.00 -0.26 0.00 0.00 64.21 63.90 2qki n SER 628 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qki n GLY 629 N 1.41 0.90 3.65 5.00 0.00 -0.95 -5.05 105.19 110.15 2qki n GLY 629 Ca 0.18 -0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 2qki n GLY 629 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2qki s GLN 630 N -0.80 4.23 0.21 1.61 1.11 -1.26 -4.94 119.66 119.82 2qki s GLN 630 Ca 0.00 1.09 -0.16 0.00 0.01 0.00 0.00 55.36 56.30 2qki s GLN 630 Cb 0.00 -3.63 0.02 0.00 -1.01 0.00 0.00 33.01 28.39 2qki s GLN 630 CO 0.00 -0.52 0.51 1.14 0.01 0.00 0.00 175.29 176.43 2qki s GLN 631 N 2.83 1.44 0.53 2.91 -2.07 -1.26 -1.27 119.66 122.76 2qki s GLN 631 Ca 0.38 -1.00 -0.17 0.00 -1.82 0.00 0.00 55.36 52.75 2qki s GLN 631 Cb -0.15 0.50 -0.07 0.00 -1.09 0.00 0.00 33.01 32.20 2qki s GLN 631 CO 0.08 -0.61 1.02 0.95 -1.32 0.00 0.00 175.29 175.42 2qki s THR 632 N -3.92 4.07 0.54 3.63 -4.23 -0.34 -4.84 115.64 110.55 2qki s THR 632 Ca 0.13 1.07 -0.20 0.00 -1.18 0.00 0.00 61.69 61.52 2qki s THR 632 Cb -0.01 -3.51 -0.06 0.00 1.34 0.00 0.00 72.50 70.26 2qki s THR 632 CO 0.01 -0.49 1.16 0.00 -0.54 0.00 0.00 174.62 174.77 2qki s ALA 633 N -2.38 2.71 0.07 3.99 0.00 -1.26 -4.91 121.76 119.98 2qki s ALA 633 Ca 0.63 0.90 -0.33 0.00 0.00 0.00 0.00 51.96 53.15 2qki s ALA 633 Cb -0.14 -3.39 -0.12 0.00 0.00 0.00 0.00 23.12 19.47 2qki s ALA 633 CO 0.29 -0.86 1.75 1.04 0.00 0.00 0.00 175.76 177.99 2qki n GLN 634 N -1.24 2.36 -3.18 0.00 1.13 -1.26 -4.98 117.38 110.21 2qki n GLN 634 Ca 0.11 0.86 -0.41 0.00 -1.94 0.00 0.00 57.00 55.62 2qki n GLN 634 Cb 0.50 -2.69 -0.07 0.00 0.11 0.00 0.00 30.24 28.09 2qki n GLN 634 CO 0.00 0.00 0.00 0.50 -1.44 0.00 0.00 177.06 176.12 2qki s ARG 635 N 2.43 3.88 0.00 -1.09 3.52 -1.26 -4.90 118.95 121.53 2qki s ARG 635 Ca 0.84 0.20 0.08 0.00 -0.13 0.00 0.00 55.73 56.72 2qki s ARG 635 Cb -0.62 -3.72 0.01 0.00 -1.56 0.00 0.00 34.95 29.05 2qki s ARG 635 CO 0.42 -0.53 0.60 0.00 -0.81 0.00 0.00 175.30 174.99 2qki n ALA 636 N 5.76 2.68 -2.79 6.12 0.00 -1.26 -4.32 120.51 126.70 2qki n ALA 636 Ca -0.03 -0.44 -0.35 0.00 0.00 0.00 0.00 53.44 52.63 2qki n ALA 636 Cb 0.49 -0.29 -0.09 0.00 0.00 0.00 0.00 19.45 19.56 2qki n ALA 636 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2qki s GLU 637 N -1.09 3.46 0.20 0.00 0.41 -1.26 -5.02 118.70 115.40 2qki s GLU 637 Ca 0.07 -0.34 0.15 0.00 -0.41 0.00 0.00 54.97 54.44 2qki s GLU 637 Cb 0.07 -3.02 -0.02 0.00 -1.78 0.00 0.00 34.13 29.37 2qki s GLU 637 CO 0.18 0.54 1.25 -0.07 -0.49 0.00 0.00 175.26 176.67 2qki h LEU 638 N 5.76 0.00 -9.71 1.80 3.38 -1.99 -3.46 115.31 111.10 2qki h LEU 638 Ca -0.45 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 56.98 2qki h LEU 638 Cb 1.19 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.86 2qki h LEU 638 CO 0.61 0.58 -0.59 -1.10 0.09 0.00 0.00 178.44 178.03 2qki s GLN 639 N -2.92 2.53 0.78 1.13 -1.52 -1.26 -5.06 119.66 113.34 2qki s GLN 639 Ca 0.02 -1.30 -0.12 0.00 -1.95 0.00 0.00 55.36 52.02 2qki s GLN 639 Cb 0.08 -2.31 0.06 0.00 -0.22 0.00 0.00 33.01 30.62 2qki s GLN 639 CO 0.77 0.35 1.11 0.00 -0.25 0.00 0.00 175.29 177.28 2qki s PRO 641 N -4.64 3.65 0.19 0.00 0.02 -1.26 -5.03 135.00 127.93 2qki s PRO 641 Ca 0.64 2.34 -0.17 0.00 0.02 0.00 0.00 61.00 63.84 2qki s PRO 641 Cb -0.20 -2.61 -0.08 0.00 0.02 0.00 0.00 34.50 31.64 2qki s PRO 641 CO 0.53 -0.82 0.64 -1.14 -0.33 0.00 0.00 177.00 175.89 2qki s GLN 642 N -2.49 4.11 0.00 5.54 2.00 -1.26 -5.18 119.66 122.39 2qki s GLN 642 Ca 0.62 0.68 0.30 0.00 -2.00 0.00 0.00 55.36 54.96 2qki s GLN 642 Cb -0.42 -2.88 1.43 0.00 0.80 0.00 0.00 33.01 31.94 2qki s GLN 642 CO 0.54 0.42 1.96 -0.35 -0.50 0.00 0.00 175.29 177.35