#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2xao s ILE 4 N 0.00 1.62 0.06 2.02 1.01 -1.26 -3.38 121.20 121.27 2xao s ILE 4 Ca 0.00 -1.11 -0.31 0.00 0.00 0.00 0.00 60.65 59.23 2xao s ILE 4 Cb 0.00 -1.77 -0.08 0.00 0.01 0.00 0.00 42.46 40.62 2xao s ILE 4 CO 0.00 0.05 1.68 -0.76 0.00 0.00 0.00 174.94 175.91 2xao s LEU 5 N 1.38 4.37 0.55 2.97 1.02 -0.72 -4.90 118.68 123.34 2xao s LEU 5 Ca -0.03 2.50 0.06 0.00 0.02 0.00 0.00 54.13 56.67 2xao s LEU 5 Cb -0.17 -3.56 0.05 0.00 0.02 0.00 0.00 46.19 42.52 2xao s LEU 5 CO -0.07 -0.90 0.47 -1.61 0.02 0.00 0.00 176.35 174.25 2xao s GLU 6 N 2.80 2.27 0.31 1.70 0.41 -1.26 -1.93 118.70 123.00 2xao s GLU 6 Ca 0.75 -1.94 0.07 0.00 -0.41 0.00 0.00 54.97 53.43 2xao s GLU 6 Cb -0.40 -2.20 0.76 0.00 -1.78 0.00 0.00 34.13 30.51 2xao s GLU 6 CO 0.33 -0.65 1.77 1.49 -0.49 0.00 0.00 175.26 177.71 2xao h GLU 7 N 0.66 0.72 0.00 1.61 4.81 -1.92 -1.37 114.58 119.09 2xao h GLU 7 Ca -0.36 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 58.78 2xao h GLU 7 Cb 1.30 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 30.51 2xao h GLU 7 CO 0.54 0.48 -0.22 0.87 -0.73 0.00 0.00 179.01 179.95 2xao h LYS 8 N 0.74 0.00 0.00 1.92 1.57 -1.97 -2.87 116.57 115.97 2xao h LYS 8 Ca 0.58 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.35 2xao h LYS 8 Cb 0.94 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.24 2xao h LYS 8 CO -0.38 0.22 -0.04 -0.44 -0.57 0.00 0.00 179.45 178.23 2xao h ASP 9 N 0.00 0.00 0.12 0.86 3.32 -1.64 -3.30 116.42 115.78 2xao h ASP 9 Ca -0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 2xao h ASP 9 Cb 0.57 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.12 2xao h ASP 9 CO 0.03 0.04 -0.07 0.00 -1.72 0.00 0.00 179.24 177.52 2xao h ALA 10 N 1.96 1.64 -0.00 3.45 0.00 -1.50 -1.54 119.26 123.26 2xao h ALA 10 Ca -0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2xao h ALA 10 Cb 0.86 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.64 2xao h ALA 10 CO 0.01 0.09 -0.01 -1.13 0.00 0.00 0.00 179.25 178.21 2xao n SER 11 N -4.10 0.14 -0.65 0.00 3.41 -1.24 -3.26 113.62 107.90 2xao n SER 11 Ca -0.03 -0.79 0.13 0.00 -0.26 0.00 0.00 58.87 57.92 2xao n SER 11 Cb 0.16 -0.07 0.28 0.00 -0.26 0.00 0.00 64.21 64.31 2xao n SER 11 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2xao n ASP 12 N -0.99 2.12 -4.22 4.04 8.00 -0.58 -4.87 116.55 120.06 2xao n ASP 12 Ca 0.21 -1.64 -0.32 0.00 0.71 0.00 0.00 54.79 53.74 2xao n ASP 12 Cb 0.17 0.07 -0.17 0.00 -0.02 0.00 0.00 41.12 41.17 2xao n ASP 12 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 2xao s TRP 13 N -2.11 2.62 0.10 1.24 0.52 -1.20 -0.60 118.94 119.51 2xao s TRP 13 Ca 0.30 -1.10 0.07 0.00 0.02 0.00 0.00 56.10 55.39 2xao s TRP 13 Cb 0.20 -1.76 -0.04 0.00 -1.15 0.00 0.00 33.47 30.73 2xao s TRP 13 CO 0.37 -0.46 -0.12 0.96 0.02 0.00 0.00 176.95 177.72 2xao s ILE 14 N 0.49 3.27 0.20 2.03 -4.36 -0.12 -4.90 121.20 117.81 2xao s ILE 14 Ca -0.15 -1.29 -0.32 0.00 -0.26 0.00 0.00 60.65 58.63 2xao s ILE 14 Cb -0.17 -2.51 -0.15 0.00 1.25 0.00 0.00 42.46 40.88 2xao s ILE 14 CO 0.05 0.13 1.27 0.00 0.24 0.00 0.00 174.94 176.63 2xao n TYR 15 N 0.78 1.68 -0.01 1.37 9.36 -1.26 -0.51 117.16 128.57 2xao n TYR 15 Ca -0.14 0.57 -0.02 0.00 3.32 0.00 0.00 57.90 61.64 2xao n TYR 15 Cb 0.52 -2.36 -0.01 0.00 -0.63 0.00 0.00 39.34 36.86 2xao n TYR 15 CO 0.00 0.00 0.00 -2.13 0.22 0.00 0.00 176.86 174.95 2xao n ARG 16 N 1.87 1.30 -3.18 2.98 3.00 -0.24 -4.71 116.66 117.68 2xao n ARG 16 Ca 0.13 0.01 0.00 0.00 -0.00 0.00 0.00 57.85 57.99 2xao n ARG 16 Cb 0.28 -1.05 0.00 0.00 0.00 0.00 0.00 32.46 31.68 2xao n ARG 16 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2xao n GLY 17 N 3.20 -0.68 3.46 5.14 0.00 -0.95 -5.01 105.19 110.36 2xao n GLY 17 Ca -0.04 -1.34 -0.15 0.00 0.00 0.00 0.00 46.02 44.48 2xao n GLY 17 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2xao s GLU 18 N -2.00 1.10 0.00 1.61 -1.05 -1.26 -0.47 118.70 116.63 2xao s GLU 18 Ca 0.00 -0.04 0.00 0.00 -0.15 0.00 0.00 54.97 54.78 2xao s GLU 18 Cb 0.00 0.51 0.00 0.00 -0.44 0.00 0.00 34.13 34.20 2xao s GLU 18 CO 0.00 -0.40 0.00 0.41 0.95 0.00 0.00 175.26 176.22 2xao n GLY 19 N 0.48 1.72 0.20 -3.83 0.00 -0.20 -4.50 105.19 99.05 2xao n GLY 19 Ca -0.18 -1.98 -0.14 0.00 0.00 0.00 0.00 46.02 43.72 2xao n GLY 19 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2xao h GLY 20 N 0.00 0.69 0.98 -0.02 0.00 -2.02 -3.37 103.07 99.33 2xao h GLY 20 Ca 0.00 -0.76 -0.32 0.00 0.00 0.00 0.00 47.33 46.25 2xao h GLY 20 CO 0.00 0.69 -1.72 0.00 0.00 0.00 0.00 176.54 175.51 2xao h ALA 21 N 0.65 0.49 -3.09 3.60 0.00 -1.96 -3.47 119.26 115.49 2xao h ALA 21 Ca 0.03 -1.31 -0.39 0.00 0.00 0.00 0.00 54.91 53.23 2xao h ALA 21 Cb 0.91 0.47 -0.20 0.00 0.00 0.00 0.00 17.79 18.97 2xao h ALA 21 CO 0.08 1.35 -0.76 -0.80 0.00 0.00 0.00 179.25 179.11 2xao s ASN 22 N -6.70 1.73 -0.18 0.00 -0.87 -1.26 -0.99 114.94 106.68 2xao s ASN 22 Ca -0.11 -0.72 -0.04 0.00 -1.57 0.00 0.00 52.86 50.41 2xao s ASN 22 Cb 0.07 -0.04 -0.02 0.00 -0.02 0.00 0.00 41.25 41.24 2xao s ASN 22 CO 0.82 -0.14 -0.03 -0.22 -2.57 0.00 0.00 177.10 174.96 2xao s LEU 23 N -2.13 3.18 -0.19 0.60 2.96 0.08 -1.03 118.68 122.14 2xao s LEU 23 Ca 0.03 -0.20 -0.03 0.00 -0.22 0.00 0.00 54.13 53.71 2xao s LEU 23 Cb -0.07 -1.78 -0.01 0.00 0.50 0.00 0.00 46.19 44.83 2xao s LEU 23 CO 0.02 0.11 -0.06 -0.69 -1.32 0.00 0.00 176.35 174.41 2xao s VAL 24 N 0.72 3.41 0.11 1.68 1.01 0.38 -0.88 120.40 126.83 2xao s VAL 24 Ca -0.01 -0.50 0.09 0.00 0.00 0.00 0.00 61.98 61.55 2xao s VAL 24 Cb -0.14 -2.51 -0.04 0.00 0.00 0.00 0.00 36.38 33.68 2xao s VAL 24 CO 0.02 0.46 -0.17 -0.76 0.00 0.00 0.00 175.10 174.65 2xao s LEU 25 N 0.98 2.73 0.09 3.92 2.01 -0.14 -1.07 118.68 127.19 2xao s LEU 25 Ca -0.00 -0.54 0.04 0.00 0.01 0.00 0.00 54.13 53.64 2xao s LEU 25 Cb -0.15 -1.57 -0.04 0.00 0.01 0.00 0.00 46.19 44.44 2xao s LEU 25 CO 0.00 0.18 0.05 0.00 1.01 0.00 0.00 176.35 177.59 2xao s ALA 26 N -1.14 3.44 0.12 4.21 0.00 0.34 0.12 121.76 128.85 2xao s ALA 26 Ca 0.18 -1.07 -0.30 0.00 0.00 0.00 0.00 51.96 50.77 2xao s ALA 26 Cb -0.11 -1.32 -0.06 0.00 0.00 0.00 0.00 23.12 21.63 2xao s ALA 26 CO 0.10 0.72 1.07 -0.47 0.00 0.00 0.00 175.76 177.18 2xao s TYR 27 N -1.37 3.63 -0.02 0.00 5.04 -1.01 -0.95 117.35 122.66 2xao s TYR 27 Ca 0.28 1.60 0.03 0.00 -2.44 0.00 0.00 57.07 56.54 2xao s TYR 27 Cb -0.12 -3.23 0.05 0.00 0.35 0.00 0.00 41.96 39.01 2xao s TYR 27 CO 0.20 -0.47 0.88 0.00 -1.34 0.00 0.00 175.55 174.82 2xao n ALA 28 N 2.89 1.74 -2.29 3.97 0.00 0.23 -4.81 120.51 122.25 2xao n ALA 28 Ca 0.04 -1.13 0.00 0.00 0.00 0.00 0.00 53.44 52.35 2xao n ALA 28 Cb 0.47 -0.13 0.00 0.00 0.00 0.00 0.00 19.45 19.80 2xao n ALA 28 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2xao n GLY 29 N -0.45 1.60 0.05 0.00 0.00 -1.17 -4.98 105.19 100.24 2xao n GLY 29 Ca 0.03 -2.03 -0.01 0.00 0.00 0.00 0.00 46.02 44.00 2xao n GLY 29 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2xao n SER 30 N -1.34 0.92 -4.70 1.61 7.64 -1.26 -4.83 113.62 111.66 2xao n SER 30 Ca 0.00 0.00 -0.59 0.00 1.01 0.00 0.00 58.87 59.29 2xao n SER 30 Cb 0.00 1.28 -0.08 0.00 -1.01 0.00 0.00 64.21 64.40 2xao n SER 30 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2xao n SER 31 N -2.41 2.04 0.21 6.43 2.88 -1.26 -4.80 113.62 116.71 2xao n SER 31 Ca -0.17 1.10 0.15 0.00 -1.33 0.00 0.00 58.87 58.62 2xao n SER 31 Cb 0.80 -1.10 0.74 0.00 -0.75 0.00 0.00 64.21 63.91 2xao n SER 31 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 2xao h PRO 32 N 6.45 0.00 0.00 -1.46 0.11 -1.95 -0.92 132.00 134.23 2xao h PRO 32 Ca -0.46 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.55 2xao h PRO 32 Cb 1.33 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.43 2xao h PRO 32 CO 0.94 0.00 -0.48 -0.07 -0.21 0.00 0.00 178.00 178.18 2xao h LEU 33 N 0.00 0.00 0.00 2.35 3.38 -2.03 -3.37 115.31 115.64 2xao h LEU 33 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2xao h LEU 33 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 2xao h LEU 33 CO 0.00 0.48 -0.80 0.49 0.09 0.00 0.00 178.44 178.70 2xao n PHE 34 N -3.87 0.00 -1.68 1.13 3.72 -0.62 -4.94 117.46 111.20 2xao n PHE 34 Ca -0.01 0.00 -0.45 0.00 -0.05 0.00 0.00 57.45 56.94 2xao n PHE 34 Cb 0.51 -0.06 -0.04 0.00 -0.94 0.00 0.00 39.48 38.96 2xao n PHE 34 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 2xao n VAL 35 N -1.43 0.18 -2.03 -4.37 0.31 -0.45 -1.71 118.33 108.84 2xao n VAL 35 Ca -0.00 -0.05 -0.10 0.00 -0.01 0.00 0.00 64.34 64.18 2xao n VAL 35 Cb 0.09 -1.64 -0.01 0.00 -0.91 0.00 0.00 33.84 31.38 2xao n VAL 35 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2xao n GLY 36 N 3.28 0.18 3.46 2.92 0.00 -1.26 -5.01 105.19 108.76 2xao n GLY 36 Ca 0.16 -0.47 -0.23 0.00 0.00 0.00 0.00 46.02 45.47 2xao n GLY 36 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2xao s LYS 37 N -4.20 1.65 0.14 1.61 -0.14 -0.69 -0.71 119.74 117.39 2xao s LYS 37 Ca 0.00 -1.77 0.08 0.00 -1.36 0.00 0.00 55.97 52.91 2xao s LYS 37 Cb 0.00 -1.64 -0.04 0.00 -1.68 0.00 0.00 37.83 34.47 2xao s LYS 37 CO 0.00 0.27 -0.17 0.14 -0.76 0.00 0.00 175.35 174.82 2xao s VAL 38 N -2.61 1.64 -0.15 3.17 -7.23 0.08 -2.41 120.40 112.88 2xao s VAL 38 Ca 0.29 -1.80 -0.01 0.00 -1.81 0.00 0.00 61.98 58.65 2xao s VAL 38 Cb -0.03 -1.70 -0.02 0.00 0.56 0.00 0.00 36.38 35.20 2xao s VAL 38 CO 0.14 -0.31 -0.10 -0.51 -0.31 0.00 0.00 175.10 174.01 2xao s ILE 39 N -1.95 3.28 -0.25 -0.62 2.07 0.31 -2.08 121.20 121.96 2xao s ILE 39 Ca 0.12 -0.57 -0.09 0.00 -1.41 0.00 0.00 60.65 58.70 2xao s ILE 39 Cb -0.06 -2.41 -0.04 0.00 0.13 0.00 0.00 42.46 40.08 2xao s ILE 39 CO 0.05 0.50 0.12 -0.60 -1.91 0.00 0.00 174.94 173.10 2xao s ARG 40 N 0.51 3.86 -0.10 3.50 3.52 -0.14 -0.96 118.95 129.13 2xao s ARG 40 Ca -0.07 -0.38 0.02 0.00 -0.13 0.00 0.00 55.73 55.17 2xao s ARG 40 Cb -0.15 -3.45 0.01 0.00 -1.56 0.00 0.00 34.95 29.80 2xao s ARG 40 CO 0.04 -0.08 -0.16 0.42 -0.81 0.00 0.00 175.30 174.71 2xao s ILE 41 N 1.40 1.53 0.36 4.11 1.01 -0.06 -2.57 121.20 126.97 2xao s ILE 41 Ca 0.06 -0.67 -0.26 0.00 0.00 0.00 0.00 60.65 59.78 2xao s ILE 41 Cb -0.15 -1.38 -0.09 0.00 0.01 0.00 0.00 42.46 40.85 2xao s ILE 41 CO 0.06 0.45 1.11 -1.10 0.00 0.00 0.00 174.94 175.45 2xao s GLN 42 N 0.87 4.29 -0.06 2.79 -0.21 -1.26 -0.75 119.66 125.33 2xao s GLN 42 Ca -0.09 1.72 -0.10 0.00 0.02 0.00 0.00 55.36 56.91 2xao s GLN 42 Cb -0.15 -2.81 -0.05 0.00 1.00 0.00 0.00 33.01 31.00 2xao s GLN 42 CO 0.00 -0.08 0.25 0.15 -2.12 0.00 0.00 175.29 173.50 2xao s LYS 43 N -2.08 3.63 -0.57 2.91 1.02 -0.16 -1.90 119.74 122.59 2xao s LYS 43 Ca 0.53 0.08 -0.25 0.00 0.02 0.00 0.00 55.97 56.35 2xao s LYS 43 Cb -0.28 -3.19 0.04 0.00 -0.52 0.00 0.00 37.83 33.88 2xao s LYS 43 CO 0.36 0.74 1.01 0.00 -0.92 0.00 0.00 175.35 176.54 2xao s ALA 44 N -1.07 3.10 -0.11 5.17 0.00 0.21 -4.69 121.76 124.37 2xao s ALA 44 Ca 0.19 -1.19 -0.30 0.00 0.00 0.00 0.00 51.96 50.67 2xao s ALA 44 Cb -0.14 -3.83 -0.03 0.00 0.00 0.00 0.00 23.12 19.12 2xao s ALA 44 CO 0.08 -2.51 1.35 1.03 0.00 0.00 0.00 175.76 175.72 2xao s ARG 45 N 4.26 4.24 0.00 0.00 0.52 -1.26 -3.06 118.95 123.64 2xao s ARG 45 Ca 0.33 1.81 0.24 0.00 -0.52 0.00 0.00 55.73 57.58 2xao s ARG 45 Cb -0.11 -3.77 1.08 0.00 0.52 0.00 0.00 34.95 32.67 2xao s ARG 45 CO 0.20 -0.69 1.77 0.54 0.02 0.00 0.00 175.30 177.14 2xao n ARG 46 N 6.42 0.11 0.10 3.54 1.74 -1.13 -2.12 116.66 125.33 2xao n ARG 46 Ca 0.14 0.08 -0.16 0.00 -0.77 0.00 0.00 57.85 57.14 2xao n ARG 46 Cb 0.44 -1.50 -0.12 0.00 -1.02 0.00 0.00 32.46 30.27 2xao n ARG 46 CO 0.00 0.00 0.00 -0.91 -1.52 0.00 0.00 177.63 175.20 2xao h ASN 47 N 0.00 0.50 -1.54 0.55 -0.26 -1.90 -3.52 115.58 109.41 2xao h ASN 47 Ca 0.00 -0.50 0.00 0.00 -0.56 0.00 0.00 56.30 55.24 2xao h ASN 47 Cb 0.35 -0.16 0.00 0.00 -1.06 0.00 0.00 38.32 37.45 2xao h ASN 47 CO 0.00 1.37 0.00 -0.67 -1.06 0.00 0.00 177.43 177.07 2xao n ASP 48 N -3.61 0.80 0.02 5.81 4.64 -0.90 -5.27 116.55 118.03 2xao n ASP 48 Ca -0.09 0.00 -0.22 0.00 -1.38 0.00 0.00 54.79 53.10 2xao n ASP 48 Cb 0.99 0.00 -0.14 0.00 -1.04 0.00 0.00 41.12 40.93 2xao n ASP 48 CO 0.00 0.00 0.00 -1.28 -0.82 0.00 0.00 177.20 175.10 2xao h SER 59 N 0.00 0.43 0.08 1.67 0.87 -1.99 -3.44 113.55 111.17 2xao h SER 59 Ca 0.00 -0.89 -0.24 0.00 -1.23 0.00 0.00 61.79 59.43 2xao h SER 59 Cb 0.00 -0.14 0.01 0.00 -0.44 0.00 0.00 62.40 61.83 2xao h SER 59 CO 0.00 1.76 -0.94 -0.37 -0.53 0.00 0.00 176.83 176.75 2xao h VAL 60 N -0.09 1.32 -4.05 2.23 -1.51 -1.91 -3.47 116.25 108.77 2xao h VAL 60 Ca -0.37 -2.23 -0.18 0.00 -1.23 0.00 0.00 66.70 62.69 2xao h VAL 60 Cb 1.93 2.28 -0.18 0.00 -2.13 0.00 0.00 31.29 33.19 2xao h VAL 60 CO 0.08 0.69 -0.70 -0.76 -1.23 0.00 0.00 177.57 175.65 2xao s LEU 61 N -8.06 2.37 0.75 4.19 1.43 -1.26 -4.92 118.68 113.18 2xao s LEU 61 Ca -0.08 -0.76 -0.08 0.00 -1.03 0.00 0.00 54.13 52.17 2xao s LEU 61 Cb 0.08 0.07 0.08 0.00 0.03 0.00 0.00 46.19 46.45 2xao s LEU 61 CO 0.90 -0.42 1.07 0.42 0.23 0.00 0.00 176.35 178.55 2xao s THR 62 N -2.66 2.18 0.09 5.49 -4.23 -1.26 -4.87 115.64 110.39 2xao s THR 62 Ca -0.03 -0.20 -0.24 0.00 -1.18 0.00 0.00 61.69 60.05 2xao s THR 62 Cb -0.01 -2.99 -0.13 0.00 1.34 0.00 0.00 72.50 70.71 2xao s THR 62 CO -0.05 0.00 1.72 -1.28 -0.54 0.00 0.00 174.62 174.48 2xao h SER 63 N -0.77 -0.12 -0.54 3.99 0.87 -2.02 -0.79 113.55 114.18 2xao h SER 63 Ca -0.45 0.01 -0.00 0.00 -1.23 0.00 0.00 61.79 60.12 2xao h SER 63 Cb 1.31 0.04 -0.03 0.00 -0.44 0.00 0.00 62.40 63.29 2xao h SER 63 CO 0.60 -0.07 0.33 0.44 -0.53 0.00 0.00 176.83 177.60 2xao h ASP 64 N -0.10 0.66 -0.34 6.23 3.32 -1.98 -1.93 116.42 122.29 2xao h ASP 64 Ca 0.01 -0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.02 2xao h ASP 64 Cb 0.10 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 2xao h ASP 64 CO -0.02 0.51 0.20 -0.33 -1.72 0.00 0.00 179.24 177.89 2xao h GLU 65 N 0.76 0.46 -0.90 3.56 5.08 -1.82 -2.03 114.58 119.70 2xao h GLU 65 Ca 0.20 -0.04 0.02 0.00 -1.00 0.00 0.00 59.36 58.53 2xao h GLU 65 Cb -0.02 -0.10 -0.05 0.00 0.50 0.00 0.00 28.75 29.09 2xao h GLU 65 CO -0.04 0.36 0.60 1.96 -1.00 0.00 0.00 179.01 180.89 2xao h GLN 66 N 0.43 1.16 -0.61 2.33 4.20 -0.41 -0.82 115.11 121.40 2xao h GLN 66 Ca 0.12 -0.07 -0.07 0.00 0.06 0.00 0.00 58.65 58.69 2xao h GLN 66 Cb 0.02 -0.26 -0.03 0.00 0.30 0.00 0.00 27.48 27.51 2xao h GLN 66 CO -0.02 0.77 0.12 1.25 -0.67 0.00 0.00 178.83 180.27 2xao h HIS 67 N 1.20 1.02 -0.36 2.96 2.76 -1.26 -1.84 115.15 119.64 2xao h HIS 67 Ca 0.34 -0.12 -0.13 0.00 -2.20 0.00 0.00 60.37 58.26 2xao h HIS 67 Cb -0.11 -0.29 -0.01 0.00 1.55 0.00 0.00 27.41 28.56 2xao h HIS 67 CO -0.00 0.86 -0.28 1.25 -1.30 0.00 0.00 177.93 178.46 2xao h LEU 68 N 0.92 0.86 -1.58 0.26 5.85 -0.44 -3.09 115.31 118.09 2xao h LEU 68 Ca 0.19 -0.44 0.00 0.00 0.84 0.00 0.00 57.88 58.47 2xao h LEU 68 Cb 0.38 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 41.16 2xao h LEU 68 CO 0.01 1.12 0.00 0.79 -0.34 0.00 0.00 178.44 180.02 2xao n TRP 69 N -4.20 0.42 -0.15 1.25 7.02 -0.62 -4.54 117.44 116.63 2xao n TRP 69 Ca -0.02 -0.21 0.06 0.00 -1.02 0.00 0.00 57.50 56.30 2xao n TRP 69 Cb 0.47 0.00 0.11 0.00 -2.42 0.00 0.00 31.31 29.47 2xao n TRP 69 CO 0.00 0.00 0.00 2.89 -2.02 0.00 0.00 177.69 178.56 2xao n ARG 70 N 0.77 -0.03 0.16 -0.99 1.85 -0.69 0.21 116.66 117.94 2xao n ARG 70 Ca 0.17 0.64 0.14 0.00 -1.00 0.00 0.00 57.85 57.80 2xao n ARG 70 Cb 0.41 -1.00 0.70 0.00 -1.05 0.00 0.00 32.46 31.52 2xao n ARG 70 CO 0.00 0.00 0.00 0.93 -0.01 0.00 0.00 177.63 178.55 2xao h GLU 71 N 0.00 0.00 -3.38 2.89 4.39 -1.85 -3.31 114.58 113.31 2xao h GLU 71 Ca 0.25 0.00 -0.66 0.00 0.34 0.00 0.00 59.36 59.29 2xao h GLU 71 Cb 0.48 0.00 -0.39 0.00 -0.10 0.00 0.00 28.75 28.74 2xao h GLU 71 CO -0.41 0.00 -0.51 -0.80 -1.16 0.00 0.00 179.01 176.14 2xao s ASN 72 N -6.51 4.77 0.32 1.42 0.01 0.13 -4.97 114.94 110.11 2xao s ASN 72 Ca -0.05 -3.16 0.05 0.00 -0.71 0.00 0.00 52.86 48.99 2xao s ASN 72 Cb 0.18 -1.72 0.55 0.00 0.41 0.00 0.00 41.25 40.66 2xao s ASN 72 CO 0.66 -0.24 1.81 -1.13 -1.51 0.00 0.00 177.10 176.69 2xao h ASN 73 N 6.43 0.42 -0.64 -1.22 -1.24 -1.76 -2.26 115.58 115.32 2xao h ASN 73 Ca -0.01 -0.11 0.11 0.00 0.71 0.00 0.00 56.30 57.00 2xao h ASN 73 Cb 0.88 -0.11 -0.04 0.00 0.73 0.00 0.00 38.32 39.78 2xao h ASN 73 CO 0.71 0.60 0.43 1.05 -1.29 0.00 0.00 177.43 178.93 2xao h GLU 74 N 0.40 0.41 0.79 6.67 9.09 -1.93 -2.39 114.58 127.62 2xao h GLU 74 Ca 0.07 -0.02 -0.04 0.00 0.05 0.00 0.00 59.36 59.42 2xao h GLU 74 Cb 0.50 -0.09 0.01 0.00 -1.65 0.00 0.00 28.75 27.52 2xao h GLU 74 CO 0.03 0.27 -0.38 1.25 0.05 0.00 0.00 179.01 180.23 2xao h LEU 75 N 0.42 -0.90 -2.77 3.06 5.85 -1.77 -3.24 115.31 115.97 2xao h LEU 75 Ca 0.30 0.03 0.00 0.00 0.84 0.00 0.00 57.88 59.05 2xao h LEU 75 Cb 0.60 0.23 -0.00 0.00 0.37 0.00 0.00 40.66 41.87 2xao h LEU 75 CO -0.09 -0.54 0.07 0.16 -0.34 0.00 0.00 178.44 177.71 2xao h ILE 76 N -1.28 0.02 -0.68 4.05 -0.00 -1.50 -1.81 117.51 116.32 2xao h ILE 76 Ca -0.11 0.00 -0.29 0.00 -0.00 0.00 0.00 64.86 64.46 2xao h ILE 76 Cb 0.82 0.93 -0.17 0.00 -0.00 0.00 0.00 36.82 38.39 2xao h ILE 76 CO 0.18 0.00 0.28 -1.54 -0.00 0.00 0.00 178.15 177.07 2xao n SER 77 N -3.08 3.73 -4.70 2.16 3.41 -0.93 -4.98 113.62 109.24 2xao n SER 77 Ca -0.03 -3.49 -0.42 0.00 -0.26 0.00 0.00 58.87 54.67 2xao n SER 77 Cb 0.14 -0.73 -0.03 0.00 -0.26 0.00 0.00 64.21 63.33 2xao n SER 77 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2xao s SER 78 N -1.63 6.96 0.46 4.04 0.01 -0.68 -4.93 113.70 117.92 2xao s SER 78 Ca 0.52 2.02 0.13 0.00 1.31 0.00 0.00 55.95 59.92 2xao s SER 78 Cb 0.44 -2.57 1.05 0.00 0.21 0.00 0.00 66.02 65.15 2xao s SER 78 CO 0.08 -0.62 2.06 1.55 0.41 0.00 0.00 173.24 176.72 2xao h PRO 79 N 7.43 0.14 -3.27 12.44 0.13 -1.93 -3.46 132.00 143.48 2xao h PRO 79 Ca -0.38 -0.02 -0.00 0.00 -0.87 0.00 0.00 66.00 64.73 2xao h PRO 79 Cb 1.18 -0.03 -0.09 0.00 0.13 0.00 0.00 31.00 32.20 2xao h PRO 79 CO 0.87 0.17 0.07 0.54 -0.23 0.00 0.00 178.00 179.43 2xao s ASN 80 N -6.95 -0.25 0.33 1.44 2.20 -1.26 -4.92 114.94 105.52 2xao s ASN 80 Ca -0.05 -0.56 0.08 0.00 -0.94 0.00 0.00 52.86 51.39 2xao s ASN 80 Cb 0.16 0.62 0.79 0.00 -2.00 0.00 0.00 41.25 40.82 2xao s ASN 80 CO 0.70 -1.14 1.80 0.11 -2.94 0.00 0.00 177.10 175.63 2xao h LYS 81 N 2.14 0.70 0.51 3.55 1.79 -1.91 -0.90 116.57 122.46 2xao h LYS 81 Ca -0.26 -0.04 -0.02 0.00 -2.18 0.00 0.00 60.65 58.15 2xao h LYS 81 Cb 1.26 -0.16 -0.00 0.00 -1.58 0.00 0.00 32.23 31.75 2xao h LYS 81 CO 0.33 0.46 -0.30 0.93 -1.08 0.00 0.00 179.45 179.80 2xao h GLU 82 N 0.72 -0.73 -0.75 3.15 3.07 -1.96 -1.34 114.58 116.73 2xao h GLU 82 Ca 0.54 0.05 0.10 0.00 -0.50 0.00 0.00 59.36 59.56 2xao h GLU 82 Cb 0.90 0.17 -0.08 0.00 -0.84 0.00 0.00 28.75 28.90 2xao h GLU 82 CO -0.32 -0.49 0.38 0.28 -1.40 0.00 0.00 179.01 177.46 2xao h VAL 83 N -0.76 0.83 -0.24 3.13 2.07 -1.79 -1.66 116.25 117.82 2xao h VAL 83 Ca -0.06 -0.21 0.06 0.00 0.82 0.00 0.00 66.70 67.31 2xao h VAL 83 Cb 0.62 0.15 -0.07 0.00 -1.52 0.00 0.00 31.29 30.47 2xao h VAL 83 CO 0.07 0.11 -0.19 0.25 0.02 0.00 0.00 177.57 177.83 2xao h LEU 84 N 0.63 -0.61 -0.42 2.57 5.85 -0.86 0.10 115.31 122.56 2xao h LEU 84 Ca 0.38 0.12 -0.00 0.00 0.84 0.00 0.00 57.88 59.22 2xao h LEU 84 Cb 0.42 0.30 -0.02 0.00 0.37 0.00 0.00 40.66 41.74 2xao h LEU 84 CO -0.29 -0.23 0.24 -0.33 -0.34 0.00 0.00 178.44 177.50 2xao h GLU 85 N -0.18 0.57 -0.44 1.25 4.39 -0.80 0.09 114.58 119.45 2xao h GLU 85 Ca 0.14 -0.06 0.03 0.00 0.34 0.00 0.00 59.36 59.81 2xao h GLU 85 Cb 0.39 -0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 28.89 2xao h GLU 85 CO -0.35 0.44 0.25 0.37 -1.16 0.00 0.00 179.01 178.55 2xao h GLN 86 N 0.54 0.48 -0.14 2.33 4.15 -0.98 -1.61 115.11 119.88 2xao h GLN 86 Ca 0.15 -0.03 -0.19 0.00 0.77 0.00 0.00 58.65 59.34 2xao h GLN 86 Cb 0.02 -0.11 0.00 0.00 0.21 0.00 0.00 27.48 27.61 2xao h GLN 86 CO -0.03 0.32 -0.70 0.00 -1.93 0.00 0.00 178.83 176.49 2xao h ARG 87 N 0.49 0.62 0.10 1.69 3.08 -0.81 -1.12 114.38 118.42 2xao h ARG 87 Ca 0.18 -0.47 0.02 0.00 0.07 0.00 0.00 59.98 59.78 2xao h ARG 87 Cb 0.05 0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.16 2xao h ARG 87 CO -0.10 1.09 -0.24 -0.92 -1.07 0.00 0.00 179.97 178.73 2xao h TYR 88 N 0.44 -0.63 -0.34 3.04 3.20 -0.77 0.19 116.97 122.09 2xao h TYR 88 Ca -0.03 0.01 0.03 0.00 3.14 0.00 0.00 58.73 61.89 2xao h TYR 88 Cb 1.29 0.27 -0.03 0.00 1.54 0.00 0.00 36.73 39.80 2xao h TYR 88 CO 0.06 -0.34 0.15 0.28 -1.64 0.00 0.00 178.16 176.68 2xao h VAL 89 N -0.43 0.96 0.15 1.81 2.07 -1.21 -0.55 116.25 119.06 2xao h VAL 89 Ca 0.03 -0.11 -0.01 0.00 0.82 0.00 0.00 66.70 67.44 2xao h VAL 89 Cb 0.46 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 30.84 2xao h VAL 89 CO -0.15 0.06 -0.07 -0.61 0.02 0.00 0.00 177.57 176.82 2xao h GLN 90 N 0.32 -0.20 0.00 1.57 5.75 -0.91 0.11 115.11 121.75 2xao h GLN 90 Ca 0.15 0.01 -0.22 0.00 -0.15 0.00 0.00 58.65 58.44 2xao h GLN 90 Cb 0.08 0.05 -0.04 0.00 1.07 0.00 0.00 27.48 28.64 2xao h GLN 90 CO -0.12 0.08 -1.70 0.09 -2.65 0.00 0.00 178.83 174.53 2xao n ASN 91 N -5.06 0.66 -0.12 -0.69 3.02 0.64 -4.16 115.26 109.55 2xao n ASN 91 Ca -0.09 0.30 -0.24 0.00 -0.03 0.00 0.00 54.58 54.52 2xao n ASN 91 Cb 0.20 0.36 -0.09 0.00 -0.61 0.00 0.00 39.78 39.64 2xao n ASN 91 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 2xao n VAL 92 N -2.87 1.31 -0.06 2.41 0.31 -0.25 -4.62 118.33 114.56 2xao n VAL 92 Ca -0.15 -0.36 -0.11 0.00 -0.01 0.00 0.00 64.34 63.70 2xao n VAL 92 Cb 0.93 -1.73 -0.10 0.00 -0.91 0.00 0.00 33.84 32.03 2xao n VAL 92 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 2xao h ILE 93 N -0.71 1.39 -0.65 2.52 5.03 -1.19 -3.37 117.51 120.52 2xao h ILE 93 Ca -0.59 -1.98 0.14 0.00 -0.12 0.00 0.00 64.86 62.31 2xao h ILE 93 Cb 1.57 2.59 -0.11 0.00 -3.03 0.00 0.00 36.82 37.85 2xao h ILE 93 CO -0.32 0.46 0.04 0.40 -0.68 0.00 0.00 178.15 178.05 2xao h ILE 94 N -0.97 0.49 0.00 -0.67 1.08 -0.94 0.02 117.51 116.52 2xao h ILE 94 Ca -0.00 -0.05 0.00 0.00 -0.39 0.00 0.00 64.86 64.42 2xao h ILE 94 Cb 0.76 0.32 0.00 0.00 -3.07 0.00 0.00 36.82 34.83 2xao h ILE 94 CO 0.00 0.03 0.16 -0.65 -0.69 0.00 0.00 178.15 177.00 2xao h PRO 95 N 0.15 0.00 0.00 2.37 0.11 -1.76 0.35 132.00 133.22 2xao h PRO 95 Ca 0.35 0.00 -0.33 0.00 0.11 0.00 0.00 66.00 66.13 2xao h PRO 95 Cb 0.58 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 31.63 2xao h PRO 95 CO -0.53 0.00 -2.26 -0.11 -0.21 0.00 0.00 178.00 174.89 2xao n LEU 96 N -2.69 2.77 -0.01 2.35 7.94 -0.14 -4.64 117.00 122.59 2xao n LEU 96 Ca -0.02 -0.11 0.09 0.00 -1.11 0.00 0.00 56.01 54.86 2xao n LEU 96 Cb 0.20 -0.69 -0.14 0.00 0.53 0.00 0.00 43.42 43.32 2xao n LEU 96 CO 0.13 0.84 -0.73 0.18 -1.11 0.00 0.00 177.39 176.71 2xao n LEU 97 N -3.11 0.00 0.00 -1.96 4.77 -0.44 -5.05 117.00 111.21 2xao n LEU 97 Ca -0.39 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.59 2xao n LEU 97 Cb 0.93 0.02 0.00 0.00 -2.33 0.00 0.00 43.42 42.04 2xao n LEU 97 CO 0.23 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 176.92 2xao n GLY 98 N 1.47 1.18 0.25 -0.72 0.00 0.12 -4.76 105.19 102.72 2xao n GLY 98 Ca -0.04 -1.63 0.15 0.00 0.00 0.00 0.00 46.02 44.50 2xao n GLY 98 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2xao h PRO 99 N 0.00 0.00 -0.54 1.61 0.11 -1.84 -3.22 132.00 128.12 2xao h PRO 99 Ca 0.00 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.11 2xao h PRO 99 Cb 0.00 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.08 2xao h PRO 99 CO 0.00 0.00 0.31 -0.22 -0.21 0.00 0.00 178.00 177.88 2xao h LYS 100 N 0.00 0.72 -0.07 1.05 3.64 -1.96 -3.17 116.57 116.78 2xao h LYS 100 Ca 0.00 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 2xao h LYS 100 Cb 0.66 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.33 2xao h LYS 100 CO 0.00 0.52 0.00 0.72 -2.27 0.00 0.00 179.45 178.42 2xao n HIS 101 N -4.42 0.09 -4.68 1.91 8.25 -1.23 -4.91 115.22 110.23 2xao n HIS 101 Ca 0.05 -0.15 -0.23 0.00 -0.26 0.00 0.00 57.72 57.13 2xao n HIS 101 Cb 0.08 -0.01 -0.15 0.00 1.12 0.00 0.00 29.99 31.03 2xao n HIS 101 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2xao s VAL 102 N -0.72 1.17 -0.09 1.59 1.01 -1.20 0.57 120.40 122.73 2xao s VAL 102 Ca 0.11 -0.62 0.01 0.00 0.00 0.00 0.00 61.98 61.48 2xao s VAL 102 Cb 0.07 -0.98 0.02 0.00 0.00 0.00 0.00 36.38 35.48 2xao s VAL 102 CO 0.09 0.33 -0.11 -0.62 0.00 0.00 0.00 175.10 174.79 2xao s ASP 103 N -0.23 2.02 0.24 3.32 2.15 -1.26 -4.71 116.67 118.19 2xao s ASP 103 Ca 0.03 -0.32 0.18 0.00 0.43 0.00 0.00 52.55 52.86 2xao s ASP 103 Cb -0.07 -0.88 0.04 0.00 -0.30 0.00 0.00 42.92 41.71 2xao s ASP 103 CO -0.00 -0.02 1.25 0.00 -0.17 0.00 0.00 175.17 176.23 2xao h ALA 104 N 7.42 0.69 0.00 3.66 0.00 -1.94 -3.50 119.26 125.59 2xao h ALA 104 Ca -0.31 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.17 2xao h ALA 104 Cb 1.17 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.00 2xao h ALA 104 CO 0.46 0.52 0.00 0.41 0.00 0.00 0.00 179.25 180.64 2xao n GLY 105 N 1.25 -0.93 3.12 0.00 0.00 -1.26 -4.61 105.19 102.76 2xao n GLY 105 Ca -0.01 -1.62 -0.25 0.00 0.00 0.00 0.00 46.02 44.15 2xao n GLY 105 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2xao s VAL 106 N -2.85 1.33 0.52 1.61 1.01 -0.15 -4.91 120.40 116.95 2xao s VAL 106 Ca 0.00 -0.67 -0.23 0.00 0.00 0.00 0.00 61.98 61.08 2xao s VAL 106 Cb 0.00 -1.13 -0.06 0.00 0.00 0.00 0.00 36.38 35.19 2xao s VAL 106 CO 0.00 0.38 1.33 0.54 0.00 0.00 0.00 175.10 177.36 2xao n ARG 107 N 3.04 1.76 -3.77 2.72 5.12 -1.26 -0.74 116.66 123.53 2xao n ARG 107 Ca -0.17 0.64 -0.13 0.00 -1.93 0.00 0.00 57.85 56.26 2xao n ARG 107 Cb 0.53 -2.53 -0.11 0.00 -1.16 0.00 0.00 32.46 29.20 2xao n ARG 107 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 2xao s VAL 108 N -1.27 0.01 0.30 1.55 0.11 -0.56 -4.86 120.40 115.68 2xao s VAL 108 Ca 0.69 -0.06 -0.22 0.00 -2.93 0.00 0.00 61.98 59.45 2xao s VAL 108 Cb -0.44 -0.44 -0.09 0.00 -1.53 0.00 0.00 36.38 33.88 2xao s VAL 108 CO 0.52 -0.03 0.85 -0.44 -3.33 0.00 0.00 175.10 172.66 2xao s SER 109 N -0.02 7.13 0.01 3.54 0.01 -1.22 -0.63 113.70 122.53 2xao s SER 109 Ca -0.02 1.62 0.01 0.00 1.31 0.00 0.00 55.95 58.87 2xao s SER 109 Cb -0.03 -2.50 -0.01 0.00 0.21 0.00 0.00 66.02 63.69 2xao s SER 109 CO 0.01 -0.09 -0.03 0.68 0.41 0.00 0.00 173.24 174.21 2xao s VAL 110 N -1.70 0.22 0.35 3.43 -7.23 0.11 -1.75 120.40 113.82 2xao s VAL 110 Ca 0.50 -0.54 -0.17 0.00 -1.81 0.00 0.00 61.98 59.96 2xao s VAL 110 Cb -0.16 -0.27 -0.10 0.00 0.56 0.00 0.00 36.38 36.42 2xao s VAL 110 CO 0.21 -0.21 0.80 -0.94 -0.31 0.00 0.00 175.10 174.64 2xao s SER 111 N -0.79 6.83 0.24 4.85 1.04 -0.81 -4.46 113.70 120.60 2xao s SER 111 Ca -0.07 1.40 -0.05 0.00 0.48 0.00 0.00 55.95 57.71 2xao s SER 111 Cb -0.05 -2.42 0.46 0.00 0.10 0.00 0.00 66.02 64.10 2xao s SER 111 CO -0.00 -0.24 1.69 0.50 0.98 0.00 0.00 173.24 176.16 2xao h LYS 112 N 2.18 0.28 -0.81 4.02 3.64 -1.84 -1.56 116.57 122.48 2xao h LYS 112 Ca -0.48 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 58.88 2xao h LYS 112 Cb 1.18 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.89 2xao h LYS 112 CO 0.64 0.19 0.50 0.93 -2.27 0.00 0.00 179.45 179.44 2xao h GLU 113 N 0.29 1.09 0.10 1.90 3.07 -1.93 0.16 114.58 119.26 2xao h GLU 113 Ca 0.41 -0.09 0.02 0.00 -0.50 0.00 0.00 59.36 59.19 2xao h GLU 113 Cb 0.69 -0.23 -0.03 0.00 -0.84 0.00 0.00 28.75 28.34 2xao h GLU 113 CO -0.49 0.76 -0.20 0.35 -1.40 0.00 0.00 179.01 178.03 2xao h PHE 114 N 1.11 -0.53 0.23 4.33 3.57 -1.58 0.19 116.94 124.26 2xao h PHE 114 Ca 0.29 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.80 2xao h PHE 114 Cb -0.06 0.22 -0.01 0.00 2.79 0.00 0.00 35.95 38.89 2xao h PHE 114 CO -0.01 -0.29 -0.17 -0.07 -2.23 0.00 0.00 178.31 175.54 2xao h LEU 115 N -0.38 -0.44 -0.91 0.59 3.38 -0.96 0.31 115.31 116.89 2xao h LEU 115 Ca 0.03 0.03 0.17 0.00 0.09 0.00 0.00 57.88 58.20 2xao h LEU 115 Cb 0.40 0.14 -0.10 0.00 0.09 0.00 0.00 40.66 41.19 2xao h LEU 115 CO -0.11 -0.27 0.50 -0.33 0.09 0.00 0.00 178.44 178.32 2xao h GLU 116 N -0.40 0.63 -0.05 1.13 5.08 -0.65 0.70 114.58 121.01 2xao h GLU 116 Ca -0.01 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.28 2xao h GLU 116 Cb 0.35 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.46 2xao h GLU 116 CO -0.00 0.41 -0.08 0.00 -1.00 0.00 0.00 179.01 178.34 2xao h VAL 118 N -0.33 0.70 -0.89 0.00 2.07 0.11 -0.97 116.25 116.94 2xao h VAL 118 Ca 0.01 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.68 2xao h VAL 118 Cb 0.63 0.70 -0.10 0.00 -1.52 0.00 0.00 31.29 31.00 2xao h VAL 118 CO 0.02 0.00 0.48 -0.78 0.02 0.00 0.00 177.57 177.31 2xao h ASP 119 N -0.12 0.60 -0.25 0.57 3.58 -0.88 -1.11 116.42 118.80 2xao h ASP 119 Ca 0.08 0.09 -0.13 0.00 0.42 0.00 0.00 57.03 57.49 2xao h ASP 119 Cb 0.24 -0.01 -0.00 0.00 1.72 0.00 0.00 39.33 41.28 2xao h ASP 119 CO -0.20 0.24 -0.35 0.50 -2.88 0.00 0.00 179.24 176.55 2xao h LYS 120 N 0.67 0.68 -0.99 0.28 1.63 -1.09 -2.92 116.57 114.84 2xao h LYS 120 Ca 0.49 -0.40 0.06 0.00 -0.85 0.00 0.00 60.65 59.95 2xao h LYS 120 Cb 0.70 0.03 -0.07 0.00 -0.60 0.00 0.00 32.23 32.30 2xao h LYS 120 CO -0.36 1.01 0.64 -0.22 -3.45 0.00 0.00 179.45 177.07 2xao h LYS 121 N 0.40 1.13 -0.01 1.90 3.64 0.05 -3.13 116.57 120.55 2xao h LYS 121 Ca 0.03 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 2xao h LYS 121 Cb 0.94 -0.26 0.00 0.00 -0.41 0.00 0.00 32.23 32.50 2xao h LYS 121 CO 0.08 0.75 -0.59 1.33 -2.27 0.00 0.00 179.45 178.75 2xao n VAL 122 N -4.51 0.00 -0.27 2.00 0.24 -0.79 -4.47 118.33 110.53 2xao n VAL 122 Ca 0.15 -0.19 0.06 0.00 -2.04 0.00 0.00 64.34 62.32 2xao n VAL 122 Cb 0.17 1.15 0.18 0.00 -1.47 0.00 0.00 33.84 33.87 2xao n VAL 122 CO 0.00 0.00 0.00 0.74 -2.14 0.00 0.00 176.83 175.43 2xao h THR 123 N 1.79 0.31 -0.00 3.34 2.02 -1.45 -0.77 112.91 118.14 2xao h THR 123 Ca 0.00 -0.04 0.00 0.00 0.77 0.00 0.00 66.41 67.14 2xao h THR 123 Cb 0.68 0.20 0.00 0.00 -1.74 0.00 0.00 68.15 67.29 2xao h THR 123 CO 0.00 0.02 0.00 1.17 0.37 0.00 0.00 175.52 177.08 2xao n LYS 124 N -5.35 1.03 0.00 6.66 4.81 -1.26 -2.88 118.16 121.17 2xao n LYS 124 Ca 0.15 -0.04 0.05 0.00 -0.87 0.00 0.00 58.31 57.59 2xao n LYS 124 Cb 0.51 -1.40 -0.05 0.00 0.02 0.00 0.00 35.03 34.10 2xao n LYS 124 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 2xao n GLN 125 N -0.85 3.39 -3.06 1.64 6.02 -0.33 -5.00 117.38 119.19 2xao n GLN 125 Ca 0.19 -0.07 -0.36 0.00 -0.01 0.00 0.00 57.00 56.74 2xao n GLN 125 Cb 0.10 -1.00 -0.06 0.00 1.02 0.00 0.00 30.24 30.29 2xao n GLN 125 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 2xao s ARG 126 N -1.92 4.31 0.37 -1.09 0.52 -0.98 -5.05 118.95 115.11 2xao s ARG 126 Ca 0.05 0.94 -0.28 0.00 -0.52 0.00 0.00 55.73 55.92 2xao s ARG 126 Cb 0.08 -2.90 -0.11 0.00 0.52 0.00 0.00 34.95 32.54 2xao s ARG 126 CO 0.41 0.40 1.46 -2.14 0.02 0.00 0.00 175.30 175.44 2xao s PRO 127 N -1.91 4.15 0.29 3.54 0.02 -1.26 -4.86 135.00 134.96 2xao s PRO 127 Ca 0.43 2.51 -0.02 0.00 0.02 0.00 0.00 61.00 63.94 2xao s PRO 127 Cb -0.17 -2.99 0.42 0.00 0.02 0.00 0.00 34.50 31.78 2xao s PRO 127 CO 0.22 -0.48 1.95 -0.07 -0.33 0.00 0.00 177.00 178.28 2xao h LEU 128 N 3.13 0.99 -1.58 -5.54 3.38 -1.96 -0.88 115.31 112.84 2xao h LEU 128 Ca -0.50 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.41 2xao h LEU 128 Cb 1.24 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.74 2xao h LEU 128 CO 0.65 0.70 -0.18 4.11 0.09 0.00 0.00 178.44 183.81 2xao h TRP 129 N 1.15 0.05 -0.12 1.13 5.08 -1.98 0.11 115.95 121.37 2xao h TRP 129 Ca 0.34 -0.00 -0.08 0.00 1.08 0.00 0.00 58.89 60.22 2xao h TRP 129 Cb -0.06 -0.01 0.00 0.00 -3.00 0.00 0.00 29.16 26.09 2xao h TRP 129 CO -0.00 0.23 -0.25 0.00 -1.28 0.00 0.00 178.44 177.13 2xao h ARG 130 N 0.05 0.39 -0.55 0.12 2.47 -1.57 -2.06 114.38 113.23 2xao h ARG 130 Ca 0.01 -0.25 0.09 0.00 -1.26 0.00 0.00 59.98 58.57 2xao h ARG 130 Cb 0.34 0.03 -0.07 0.00 -1.65 0.00 0.00 29.97 28.62 2xao h ARG 130 CO 0.02 0.85 0.15 0.28 0.56 0.00 0.00 179.97 181.83 2xao h VAL 131 N -0.02 0.72 -0.34 2.04 2.07 -0.97 -1.93 116.25 117.82 2xao h VAL 131 Ca 0.00 -0.10 -0.00 0.00 0.82 0.00 0.00 66.70 67.42 2xao h VAL 131 Cb 0.84 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 31.00 2xao h VAL 131 CO 0.06 0.05 0.19 0.78 0.02 0.00 0.00 177.57 178.67 2xao h ASN 132 N 0.29 0.40 0.18 0.57 2.35 -0.66 -3.15 115.58 115.56 2xao h ASN 132 Ca 0.28 -0.02 -0.29 0.00 -0.55 0.00 0.00 56.30 55.72 2xao h ASN 132 Cb 0.37 -0.10 0.02 0.00 0.05 0.00 0.00 38.32 38.66 2xao h ASN 132 CO -0.33 0.32 -1.34 0.00 -1.65 0.00 0.00 177.43 174.42 2xao h ALA 133 N 1.75 -0.00 -2.04 -0.83 0.00 -0.79 -3.48 119.26 113.87 2xao h ALA 133 Ca 0.12 -0.93 -0.06 0.00 0.00 0.00 0.00 54.91 54.05 2xao h ALA 133 Cb -0.00 0.28 -0.20 0.00 0.00 0.00 0.00 17.79 17.88 2xao h ALA 133 CO -0.02 0.70 0.15 0.00 0.00 0.00 0.00 179.25 180.08 2xao s ALA 134 N -2.52 -1.71 0.45 0.00 0.00 -0.78 -2.82 121.76 114.39 2xao s ALA 134 Ca -0.14 1.41 0.06 0.00 0.00 0.00 0.00 51.96 53.29 2xao s ALA 134 Cb 0.04 -0.25 -0.03 0.00 0.00 0.00 0.00 23.12 22.88 2xao s ALA 134 CO 0.86 -0.35 0.21 -0.80 0.00 0.00 0.00 175.76 175.67 2xao s ASN 135 N -0.85 4.44 0.48 0.00 -0.87 -1.17 -4.28 114.94 112.70 2xao s ASN 135 Ca -0.09 -1.19 -0.24 0.00 -1.57 0.00 0.00 52.86 49.78 2xao s ASN 135 Cb -0.01 -0.15 -0.07 0.00 -0.02 0.00 0.00 41.25 40.99 2xao s ASN 135 CO 0.08 -0.71 1.41 0.68 -2.57 0.00 0.00 177.10 175.99 2xao s VAL 136 N -2.67 2.04 -0.65 1.60 -7.23 -1.26 0.66 120.40 112.89 2xao s VAL 136 Ca 0.35 0.04 -0.23 0.00 -1.81 0.00 0.00 61.98 60.32 2xao s VAL 136 Cb 0.02 -3.02 0.06 0.00 0.56 0.00 0.00 36.38 34.00 2xao s VAL 136 CO 0.20 0.00 1.00 -0.62 -0.31 0.00 0.00 175.10 175.37 2xao s ASP 137 N -0.64 6.20 0.00 4.85 -1.08 -0.80 -4.33 116.67 120.86 2xao s ASP 137 Ca 0.65 -0.81 0.26 0.00 -0.52 0.00 0.00 52.55 52.13 2xao s ASP 137 Cb -0.43 -2.44 1.52 0.00 -1.46 0.00 0.00 42.92 40.11 2xao s ASP 137 CO 0.54 -1.46 1.91 0.35 0.52 0.00 0.00 175.17 177.03 2xao n THR 138 N 6.03 0.04 0.53 1.71 -2.24 -1.26 -2.95 114.28 116.14 2xao n THR 138 Ca -0.02 0.01 0.12 0.00 -2.27 0.00 0.00 64.05 61.89 2xao n THR 138 Cb 0.46 -0.60 0.17 0.00 -2.10 0.00 0.00 70.33 68.27 2xao n THR 138 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 2xao h SER 139 N 0.00 0.00 -3.94 3.42 4.64 -1.95 -3.42 113.55 112.30 2xao h SER 139 Ca 0.00 -0.18 -0.48 0.00 -0.47 0.00 0.00 61.79 60.66 2xao h SER 139 Cb 0.05 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.15 2xao h SER 139 CO 0.00 0.09 0.39 -1.00 -0.87 0.00 0.00 176.83 175.45 2xao s HIS 140 N -3.18 3.40 -2.00 4.77 3.76 -1.15 -4.96 115.29 115.93 2xao s HIS 140 Ca 0.06 1.68 0.19 0.00 -0.15 0.00 0.00 55.06 56.84 2xao s HIS 140 Cb 0.13 -3.07 0.07 0.00 1.11 0.00 0.00 32.58 30.82 2xao s HIS 140 CO 0.72 -0.37 1.01 -0.40 -0.85 0.00 0.00 174.74 174.85 2xao n ASP 141 N 0.15 2.15 -4.31 1.40 5.68 -1.26 -4.70 116.55 115.66 2xao n ASP 141 Ca 0.04 -1.58 -0.16 0.00 -0.50 0.00 0.00 54.79 52.59 2xao n ASP 141 Cb 0.50 0.25 -0.10 0.00 -1.14 0.00 0.00 41.12 40.62 2xao n ASP 141 CO 0.00 0.00 0.00 -0.44 -1.33 0.00 0.00 177.20 175.43 2xao s SER 142 N -1.84 1.90 0.31 -1.12 0.01 -1.26 0.06 113.70 111.75 2xao s SER 142 Ca 0.18 -1.14 -0.07 0.00 1.31 0.00 0.00 55.95 56.24 2xao s SER 142 Cb 0.15 -0.01 0.00 0.00 0.21 0.00 0.00 66.02 66.37 2xao s SER 142 CO 0.35 -0.42 0.48 0.00 0.41 0.00 0.00 173.24 174.06 2xao s ALA 143 N -3.35 0.37 -0.07 1.44 0.00 0.20 -4.79 121.76 115.56 2xao s ALA 143 Ca 0.24 -1.28 0.04 0.00 0.00 0.00 0.00 51.96 50.97 2xao s ALA 143 Cb 0.04 1.11 -0.01 0.00 0.00 0.00 0.00 23.12 24.25 2xao s ALA 143 CO 0.06 -0.81 -0.20 -0.51 0.00 0.00 0.00 175.76 174.30 2xao s LEU 144 N -3.15 2.37 -0.19 0.00 1.43 -1.06 -1.49 118.68 116.57 2xao s LEU 144 Ca 0.27 -0.40 -0.04 0.00 -1.03 0.00 0.00 54.13 52.94 2xao s LEU 144 Cb -0.00 -1.47 -0.02 0.00 0.03 0.00 0.00 46.19 44.73 2xao s LEU 144 CO 0.16 0.25 -0.04 -0.63 0.23 0.00 0.00 176.35 176.31 2xao s ILE 145 N -0.17 3.55 0.14 -0.59 1.01 0.08 -0.97 121.20 124.25 2xao s ILE 145 Ca -0.02 -0.45 0.08 0.00 0.00 0.00 0.00 60.65 60.25 2xao s ILE 145 Cb -0.14 -2.59 -0.04 0.00 0.01 0.00 0.00 42.46 39.70 2xao s ILE 145 CO 0.04 0.45 -0.17 -0.76 0.00 0.00 0.00 174.94 174.49 2xao s LEU 146 N 1.04 2.40 0.30 2.97 1.43 -0.88 -0.98 118.68 124.96 2xao s LEU 146 Ca 0.01 -0.81 -0.30 0.00 -1.03 0.00 0.00 54.13 52.00 2xao s LEU 146 Cb -0.15 -0.75 -0.11 0.00 0.03 0.00 0.00 46.19 45.22 2xao s LEU 146 CO 0.00 -0.05 1.52 0.20 0.23 0.00 0.00 176.35 178.25 2xao s ASN 147 N -2.46 6.46 -0.59 2.29 -0.87 -1.26 -0.74 114.94 117.77 2xao s ASN 147 Ca 0.12 2.88 -0.26 0.00 -1.57 0.00 0.00 52.86 54.03 2xao s ASN 147 Cb -0.06 -2.64 0.04 0.00 -0.02 0.00 0.00 41.25 38.57 2xao s ASN 147 CO 0.05 -0.83 1.07 -0.62 -2.57 0.00 0.00 177.10 174.20 2xao s ASP 148 N 0.28 6.35 0.00 -1.22 -1.08 0.11 -4.66 116.67 116.45 2xao s ASP 148 Ca 0.59 -0.23 0.12 0.00 -0.52 0.00 0.00 52.55 52.51 2xao s ASP 148 Cb -0.46 -2.49 0.73 0.00 -1.46 0.00 0.00 42.92 39.24 2xao s ASP 148 CO 0.50 -1.40 1.37 1.41 0.52 0.00 0.00 175.17 177.57 2xao n HIS 149 N 8.03 0.00 1.20 -5.34 8.25 -1.26 -1.82 115.22 124.29 2xao n HIS 149 Ca 0.04 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.63 2xao n HIS 149 Cb 0.48 0.00 0.40 0.00 1.12 0.00 0.00 29.99 31.99 2xao n HIS 149 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2xao n SER 150 N -0.72 0.76 -4.90 0.41 3.41 -1.26 -4.57 113.62 106.75 2xao n SER 150 Ca 0.09 -0.63 -0.31 0.00 -0.26 0.00 0.00 58.87 57.76 2xao n SER 150 Cb 0.04 0.10 -0.05 0.00 -0.26 0.00 0.00 64.21 64.05 2xao n SER 150 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2xao s LEU 151 N -2.64 4.27 0.00 1.04 2.96 -0.75 -4.15 118.68 119.41 2xao s LEU 151 Ca 0.21 0.59 0.00 0.00 -0.22 0.00 0.00 54.13 54.71 2xao s LEU 151 Cb 0.19 -3.31 0.00 0.00 0.50 0.00 0.00 46.19 43.57 2xao s LEU 151 CO 0.56 0.05 0.34 0.33 -1.32 0.00 0.00 176.35 176.31 2xao n PHE 152 N 0.09 0.00 0.00 5.38 7.35 -1.26 -4.92 117.46 124.10 2xao n PHE 152 Ca -0.02 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.67 2xao n PHE 152 Cb 0.52 -0.08 0.00 0.00 0.35 0.00 0.00 39.48 40.27 2xao n PHE 152 CO 0.00 0.00 0.00 -1.13 -0.76 0.00 0.00 176.76 174.87 2xao n SER 153 N -0.73 0.00 0.00 -2.13 3.41 -1.26 -4.94 113.62 107.97 2xao n SER 153 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2xao n SER 153 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2xao n SER 153 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2xao n GLY 160 N 0.33 0.00 3.81 5.00 0.00 -1.26 -5.11 105.19 107.95 2xao n GLY 160 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 2xao n GLY 160 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2xao s ASP 161 N 0.00 7.05 -0.11 1.61 1.01 -1.26 -5.08 116.67 119.90 2xao s ASP 161 Ca 0.00 1.74 -0.03 0.00 0.71 0.00 0.00 52.55 54.97 2xao s ASP 161 Cb 0.00 -2.55 0.04 0.00 1.01 0.00 0.00 42.92 41.42 2xao s ASP 161 CO 0.00 -0.28 0.05 0.00 0.21 0.00 0.00 175.17 175.15 2xao s ILE 163 N 2.05 5.36 0.04 0.00 -1.09 -1.12 -0.60 121.20 125.83 2xao s ILE 163 Ca 0.03 0.39 0.02 0.00 -2.23 0.00 0.00 60.65 58.86 2xao s ILE 163 Cb -0.14 -3.53 -0.02 0.00 -1.58 0.00 0.00 42.46 37.19 2xao s ILE 163 CO -0.06 0.49 -0.08 -0.55 -1.23 0.00 0.00 174.94 173.52 2xao s SER 164 N -0.18 0.84 -0.07 3.58 0.15 0.63 -0.72 113.70 117.93 2xao s SER 164 Ca 0.15 -0.49 -0.01 0.00 0.70 0.00 0.00 55.95 56.30 2xao s SER 164 Cb -0.13 0.02 0.03 0.00 -1.71 0.00 0.00 66.02 64.23 2xao s SER 164 CO 0.03 -0.16 -0.01 -0.69 1.20 0.00 0.00 173.24 173.61 2xao s VAL 165 N -1.20 0.45 -0.27 4.45 1.01 -0.40 0.84 120.40 125.28 2xao s VAL 165 Ca -0.08 0.06 -0.07 0.00 0.00 0.00 0.00 61.98 61.89 2xao s VAL 165 Cb -0.09 -0.58 -0.01 0.00 0.00 0.00 0.00 36.38 35.71 2xao s VAL 165 CO 0.00 0.26 0.07 -0.70 0.00 0.00 0.00 175.10 174.74 2xao s GLU 166 N 1.81 3.35 -0.13 2.72 2.12 0.23 -1.34 118.70 127.45 2xao s GLU 166 Ca 0.03 -0.68 -0.00 0.00 0.36 0.00 0.00 54.97 54.68 2xao s GLU 166 Cb -0.13 -3.33 -0.02 0.00 0.26 0.00 0.00 34.13 30.92 2xao s GLU 166 CO -0.05 -0.32 -0.12 0.42 -0.54 0.00 0.00 175.26 174.65 2xao s ILE 167 N 1.55 3.16 -0.74 -3.70 1.01 0.25 -0.76 121.20 121.95 2xao s ILE 167 Ca 0.05 -0.63 -0.10 0.00 0.00 0.00 0.00 60.65 59.96 2xao s ILE 167 Cb -0.16 -2.33 0.19 0.00 0.01 0.00 0.00 42.46 40.18 2xao s ILE 167 CO 0.03 0.53 0.64 -0.75 0.00 0.00 0.00 174.94 175.38 2xao s LYS 168 N 0.26 3.22 0.45 2.79 2.20 0.63 0.13 119.74 129.41 2xao s LYS 168 Ca -0.08 -2.44 0.24 0.00 -0.36 0.00 0.00 55.97 53.32 2xao s LYS 168 Cb -0.15 -4.19 1.01 0.00 -1.51 0.00 0.00 37.83 32.99 2xao s LYS 168 CO 0.05 -1.25 1.87 -1.00 -0.36 0.00 0.00 175.35 174.66 2xao h PRO 169 N 7.59 0.00 0.00 4.03 0.13 -1.85 -3.44 132.00 138.47 2xao h PRO 169 Ca 0.04 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.17 2xao h PRO 169 Cb 1.01 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.14 2xao h PRO 169 CO 0.75 0.23 0.00 1.63 -0.23 0.00 0.00 178.00 180.38 2xao n LYS 170 N -3.49 0.00 -3.05 0.86 4.76 -1.24 -4.72 118.16 111.28 2xao n LYS 170 Ca -0.00 0.00 -0.40 0.00 -2.87 0.00 0.00 58.31 55.04 2xao n LYS 170 Cb 0.39 0.00 -0.05 0.00 -1.84 0.00 0.00 35.03 33.54 2xao n LYS 170 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2xao n GLY 172 N 3.14 4.62 3.27 0.00 0.00 -1.26 -4.67 105.19 110.28 2xao n GLY 172 Ca -0.01 -1.16 -0.09 0.00 0.00 0.00 0.00 46.02 44.75 2xao n GLY 172 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2xao s PHE 173 N -3.17 0.52 -0.15 1.61 -0.12 -1.26 -4.60 117.98 110.80 2xao s PHE 173 Ca 0.47 -0.89 -0.08 0.00 -0.05 0.00 0.00 56.93 56.38 2xao s PHE 173 Cb 0.41 -0.19 -0.04 0.00 -0.63 0.00 0.00 43.02 42.57 2xao s PHE 173 CO 0.04 -0.65 0.13 -0.51 -0.05 0.00 0.00 175.22 174.18 2xao s LEU 174 N -2.98 4.27 0.69 -1.99 1.02 -1.26 -4.83 118.68 113.59 2xao s LEU 174 Ca 0.18 0.36 -0.16 0.00 0.02 0.00 0.00 54.13 54.53 2xao s LEU 174 Cb 0.05 -2.06 0.02 0.00 0.02 0.00 0.00 46.19 44.21 2xao s LEU 174 CO -0.00 0.32 1.20 -2.16 0.02 0.00 0.00 176.35 175.72 2xao s PRO 175 N -0.48 2.43 0.00 1.29 0.04 -1.26 -4.95 135.00 132.07 2xao s PRO 175 Ca 0.12 1.74 0.00 0.00 0.04 0.00 0.00 61.00 62.89 2xao s PRO 175 Cb -0.12 -1.87 0.00 0.00 0.04 0.00 0.00 34.50 32.55 2xao s PRO 175 CO 0.02 -1.61 0.00 -2.37 0.04 0.00 0.00 177.00 173.08 2xao n THR 176 N -2.40 0.00 -0.90 1.26 5.66 -1.26 -4.63 114.28 112.00 2xao n THR 176 Ca 0.13 0.00 -0.31 0.00 -3.05 0.00 0.00 64.05 60.82 2xao n THR 176 Cb 0.50 0.02 -0.02 0.00 -1.55 0.00 0.00 70.33 69.28 2xao n THR 176 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 2xao n SER 177 N -1.17 -0.79 0.22 1.09 2.88 -1.26 -4.86 113.62 109.74 2xao n SER 177 Ca 0.00 0.73 0.15 0.00 -1.33 0.00 0.00 58.87 58.42 2xao n SER 177 Cb 0.11 -0.61 0.77 0.00 -0.75 0.00 0.00 64.21 63.73 2xao n SER 177 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 2xao h ARG 178 N 0.68 0.00 -0.35 -1.46 3.08 -1.95 -3.26 114.38 111.12 2xao h ARG 178 Ca -0.18 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.87 2xao h ARG 178 Cb 0.93 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.98 2xao h ARG 178 CO 0.37 0.00 0.00 1.19 -1.07 0.00 0.00 179.97 180.46 2xao n PHE 179 N -2.58 0.46 -2.89 3.04 3.01 -1.26 -4.86 117.46 112.37 2xao n PHE 179 Ca -0.01 -0.23 -0.41 0.00 1.01 0.00 0.00 57.45 57.81 2xao n PHE 179 Cb 0.10 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.53 2xao n PHE 179 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 2xao s ILE 180 N -1.54 4.93 0.62 4.37 1.01 -1.23 -4.53 121.20 124.83 2xao s ILE 180 Ca 0.35 1.69 -0.19 0.00 0.00 0.00 0.00 60.65 62.51 2xao s ILE 180 Cb 0.19 -4.16 -0.02 0.00 0.01 0.00 0.00 42.46 38.49 2xao s ILE 180 CO 0.27 0.14 1.28 -0.83 0.00 0.00 0.00 174.94 175.81 2xao s GLY 181 N 0.99 2.84 0.26 6.18 0.00 -1.26 -4.87 107.32 111.46 2xao s GLY 181 Ca 0.42 1.19 -0.07 0.00 0.00 0.00 0.00 44.72 46.25 2xao s GLY 181 CO 0.18 1.62 1.59 1.70 0.00 0.00 0.00 173.10 178.19 2xao h LYS 182 N 0.72 0.02 0.00 2.90 3.64 -1.97 0.45 116.57 122.33 2xao h LYS 182 Ca -0.51 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.87 2xao h LYS 182 Cb 1.33 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.14 2xao h LYS 182 CO 0.54 0.01 0.00 0.93 -2.27 0.00 0.00 179.45 178.66 2xao h GLU 183 N 0.02 0.00 -0.54 1.90 4.39 -2.04 -3.21 114.58 115.10 2xao h GLU 183 Ca 0.45 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.15 2xao h GLU 183 Cb 0.76 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.41 2xao h GLU 183 CO -0.87 0.00 0.00 0.09 -1.16 0.00 0.00 179.01 177.07 2xao n ASN 184 N -2.70 4.71 0.12 1.42 3.02 0.15 -4.70 115.26 117.27 2xao n ASN 184 Ca 0.01 -2.64 0.10 0.00 -0.03 0.00 0.00 54.58 52.02 2xao n ASN 184 Cb 0.25 -0.57 0.46 0.00 -0.61 0.00 0.00 39.78 39.30 2xao n ASN 184 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 2xao n MET 185 N 0.65 0.13 0.27 3.52 2.81 -1.22 -2.11 117.12 121.17 2xao n MET 185 Ca 0.24 0.51 0.16 0.00 -1.81 0.00 0.00 57.70 56.81 2xao n MET 185 Cb 0.93 -1.83 0.66 0.00 -0.71 0.00 0.00 33.22 32.27 2xao n MET 185 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 2xao h LEU 186 N 0.00 0.00 0.00 4.03 5.85 -1.91 -1.74 115.31 121.54 2xao h LEU 186 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2xao h LEU 186 Cb 0.15 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.18 2xao h LEU 186 CO 0.00 0.02 0.05 0.29 -0.34 0.00 0.00 178.44 178.46 2xao n LYS 187 N -3.13 0.00 0.01 1.25 5.02 -0.90 -1.67 118.16 118.75 2xao n LYS 187 Ca 0.01 0.43 -0.04 0.00 -2.02 0.00 0.00 58.31 56.69 2xao n LYS 187 Cb 0.32 -1.55 -0.10 0.00 -0.02 0.00 0.00 35.03 33.68 2xao n LYS 187 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 2xao h THR 188 N 0.00 0.68 0.00 -0.18 2.02 -1.56 -3.36 112.91 110.51 2xao h THR 188 Ca 0.00 -2.32 -0.36 0.00 0.77 0.00 0.00 66.41 64.50 2xao h THR 188 Cb 0.09 2.22 -0.06 0.00 -1.74 0.00 0.00 68.15 68.66 2xao h THR 188 CO 0.00 0.39 -2.35 -1.20 0.37 0.00 0.00 175.52 172.73 2xao n SER 189 N -2.98 2.07 -4.51 4.18 7.64 -0.88 -4.79 113.62 114.36 2xao n SER 189 Ca -0.12 -0.12 -0.34 0.00 1.01 0.00 0.00 58.87 59.30 2xao n SER 189 Cb 0.92 -0.32 -0.12 0.00 -1.01 0.00 0.00 64.21 63.69 2xao n SER 189 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2xao s VAL 190 N -2.47 3.96 0.71 0.44 1.01 -0.67 -5.09 120.40 118.29 2xao s VAL 190 Ca -0.31 -0.33 -0.14 0.00 0.00 0.00 0.00 61.98 61.19 2xao s VAL 190 Cb 0.08 -2.74 0.03 0.00 0.00 0.00 0.00 36.38 33.75 2xao s VAL 190 CO 0.56 0.49 1.15 -0.94 0.00 0.00 0.00 175.10 176.36 2xao s SER 191 N 0.33 4.61 0.17 3.32 1.04 -1.26 -4.56 113.70 117.35 2xao s SER 191 Ca -0.03 2.13 -0.14 0.00 0.48 0.00 0.00 55.95 58.39 2xao s SER 191 Cb -0.14 -2.56 0.06 0.00 0.10 0.00 0.00 66.02 63.47 2xao s SER 191 CO 0.03 -1.97 1.78 -0.09 0.98 0.00 0.00 173.24 173.96 2xao h ARG 192 N -0.26 0.74 -1.01 4.02 9.65 -1.89 -2.47 114.38 123.17 2xao h ARG 192 Ca -0.47 -0.09 0.04 0.00 -1.10 0.00 0.00 59.98 58.36 2xao h ARG 192 Cb 1.26 -0.15 -0.06 0.00 -1.39 0.00 0.00 29.97 29.64 2xao h ARG 192 CO 0.52 0.57 0.66 0.35 2.80 0.00 0.00 179.97 184.87 2xao h PHE 193 N 0.71 1.24 -0.53 2.20 3.57 -1.92 0.25 116.94 122.46 2xao h PHE 193 Ca 0.19 0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.63 2xao h PHE 193 Cb 0.05 -0.41 -0.02 0.00 2.79 0.00 0.00 35.95 38.35 2xao h PHE 193 CO -0.02 0.72 -0.01 -0.22 -2.23 0.00 0.00 178.31 176.55 2xao h LYS 194 N 1.28 0.90 -0.06 1.11 3.64 -1.82 -2.13 116.57 119.49 2xao h LYS 194 Ca 0.40 -0.27 -0.05 0.00 -1.27 0.00 0.00 60.65 59.46 2xao h LYS 194 Cb -0.01 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 31.72 2xao h LYS 194 CO -0.12 0.90 -0.16 0.52 -2.27 0.00 0.00 179.45 178.32 2xao h MET 195 N 0.83 0.22 -0.91 1.90 2.86 -0.87 -3.13 114.93 115.83 2xao h MET 195 Ca 0.15 -0.15 0.11 0.00 -2.06 0.00 0.00 59.70 57.76 2xao h MET 195 Cb 0.51 0.02 -0.07 0.00 0.06 0.00 0.00 31.60 32.12 2xao h MET 195 CO 0.03 0.76 0.59 1.25 1.06 0.00 0.00 176.91 180.59 2xao h HIS 196 N -0.28 0.96 -0.76 -0.22 -0.00 -0.97 -1.59 115.15 112.29 2xao h HIS 196 Ca -0.00 0.03 0.17 0.00 -0.00 0.00 0.00 60.37 60.57 2xao h HIS 196 Cb 0.76 -0.31 -0.12 0.00 -0.00 0.00 0.00 27.41 27.75 2xao h HIS 196 CO 0.12 0.40 0.14 1.96 -0.00 0.00 0.00 177.93 180.55 2xao h GLN 197 N 0.85 0.21 -0.61 5.26 1.08 -1.32 0.21 115.11 120.78 2xao h GLN 197 Ca 0.44 -0.01 -0.09 0.00 -1.45 0.00 0.00 58.65 57.53 2xao h GLN 197 Cb 0.51 -0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.87 2xao h GLN 197 CO -0.20 0.14 0.02 -0.07 -0.95 0.00 0.00 178.83 177.76 2xao h LEU 198 N 0.21 1.05 -0.23 1.46 3.38 -1.36 -1.53 115.31 118.29 2xao h LEU 198 Ca 0.43 -0.30 -0.06 0.00 0.09 0.00 0.00 57.88 58.04 2xao h LEU 198 Cb 0.77 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 2xao h LEU 198 CO -0.57 1.09 -0.09 0.25 0.09 0.00 0.00 178.44 179.21 2xao h LEU 199 N 0.97 0.48 -1.00 1.67 5.85 -1.21 -2.51 115.31 119.57 2xao h LEU 199 Ca 0.18 -0.39 0.14 0.00 0.84 0.00 0.00 57.88 58.65 2xao h LEU 199 Cb 0.54 -0.13 -0.09 0.00 0.37 0.00 0.00 40.66 41.35 2xao h LEU 199 CO 0.03 0.76 0.62 0.11 -0.34 0.00 0.00 178.44 179.62 2xao h LYS 200 N 0.19 0.88 -0.11 1.25 1.57 -0.49 -1.44 116.57 118.42 2xao h LYS 200 Ca 0.05 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 2xao h LYS 200 Cb 0.57 -0.20 -0.00 0.00 0.08 0.00 0.00 32.23 32.68 2xao h LYS 200 CO 0.03 0.58 0.02 1.25 -0.57 0.00 0.00 179.45 180.76 2xao h LEU 201 N 0.91 0.17 -1.61 2.94 5.85 -1.16 -0.45 115.31 121.95 2xao h LEU 201 Ca 0.52 -0.26 0.13 0.00 0.84 0.00 0.00 57.88 59.12 2xao h LEU 201 Cb 0.63 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.57 2xao h LEU 201 CO -0.31 0.39 0.47 -0.08 -0.34 0.00 0.00 178.44 178.57 2xao h GLU 202 N -0.05 0.39 -0.65 1.25 4.57 -0.97 -1.09 114.58 118.02 2xao h GLU 202 Ca 0.03 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.19 2xao h GLU 202 Cb 0.29 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 28.79 2xao h GLU 202 CO 0.00 0.26 0.00 0.66 -1.18 0.00 0.00 179.01 178.75 2xao n TYR 203 N -4.47 1.39 -3.46 0.92 4.01 -0.59 -4.92 117.16 110.05 2xao n TYR 203 Ca 0.13 -0.51 -0.25 0.00 -0.16 0.00 0.00 57.90 57.11 2xao n TYR 203 Cb 0.49 -0.32 0.00 0.00 -0.31 0.00 0.00 39.34 39.20 2xao n TYR 203 CO 0.00 0.00 0.00 -0.89 -0.46 0.00 0.00 176.86 175.51 2xao n ILE 204 N 0.64 -1.22 0.09 -0.72 -0.00 -0.41 -4.85 119.36 112.89 2xao n ILE 204 Ca 0.21 0.00 0.11 0.00 -0.00 0.00 0.00 62.75 63.07 2xao n ILE 204 Cb 0.86 -2.10 -0.02 0.00 -0.00 0.00 0.00 39.64 38.38 2xao n ILE 204 CO 0.00 0.00 0.00 -0.62 -0.00 0.00 0.00 176.55 175.93 2xao n GLU 205 N -3.92 0.61 -3.95 0.38 1.02 -0.23 -4.92 120.64 109.63 2xao n GLU 205 Ca -0.01 0.09 -0.09 0.00 -0.02 0.00 0.00 57.16 57.13 2xao n GLU 205 Cb 0.54 -1.79 -0.10 0.00 -0.02 0.00 0.00 31.44 30.07 2xao n GLU 205 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 2xao s ILE 206 N -3.38 0.14 0.02 -3.67 -4.36 -1.24 -4.98 121.20 103.73 2xao s ILE 206 Ca -0.01 -1.14 -0.10 0.00 -0.26 0.00 0.00 60.65 59.14 2xao s ILE 206 Cb 0.10 -0.86 -0.32 0.00 1.25 0.00 0.00 42.46 42.63 2xao s ILE 206 CO 0.80 -0.63 0.94 0.28 0.24 0.00 0.00 174.94 176.57 2xao h SER 207 N 3.76 0.62 -5.11 4.36 0.02 -1.94 -3.43 113.55 111.83 2xao h SER 207 Ca -0.33 -0.74 -0.08 0.00 -0.84 0.00 0.00 61.79 59.81 2xao h SER 207 Cb 1.18 -0.20 -0.14 0.00 0.14 0.00 0.00 62.40 63.38 2xao h SER 207 CO 0.51 1.60 -0.27 -1.83 -1.14 0.00 0.00 176.83 175.69 2xao s GLU 208 N -2.61 0.89 0.38 3.45 -1.05 -1.26 -5.09 118.70 113.40 2xao s GLU 208 Ca -0.09 -0.80 -0.28 0.00 -0.15 0.00 0.00 54.97 53.66 2xao s GLU 208 Cb 0.06 0.37 -0.10 0.00 -0.44 0.00 0.00 34.13 34.02 2xao s GLU 208 CO 0.90 -0.30 1.39 -2.00 0.95 0.00 0.00 175.26 176.19 2xao s GLU 209 N -3.55 4.12 0.51 -4.83 2.12 -1.26 -4.98 118.70 110.82 2xao s GLU 209 Ca 0.02 2.36 -0.20 0.00 0.36 0.00 0.00 54.97 57.51 2xao s GLU 209 Cb 0.03 -2.93 -0.07 0.00 0.26 0.00 0.00 34.13 31.42 2xao s GLU 209 CO -0.10 -0.44 1.11 0.45 -0.54 0.00 0.00 175.26 175.74 2xao s SER 210 N -0.41 5.99 0.00 -1.70 0.15 -1.26 -4.94 113.70 111.53 2xao s SER 210 Ca 0.53 2.14 0.28 0.00 0.70 0.00 0.00 55.95 59.60 2xao s SER 210 Cb -0.42 -2.58 1.09 0.00 -1.71 0.00 0.00 66.02 62.39 2xao s SER 210 CO 0.56 -1.03 1.76 -0.62 1.20 0.00 0.00 173.24 175.12 2xao n GLU 211 N -1.02 1.30 -2.90 5.44 1.02 -1.26 -4.92 120.64 118.29 2xao n GLU 211 Ca 0.10 -0.68 -0.40 0.00 -0.02 0.00 0.00 57.16 56.17 2xao n GLU 211 Cb 0.51 -1.49 -0.06 0.00 -0.02 0.00 0.00 31.44 30.38 2xao n GLU 211 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 2xao s TYR 212 N -2.17 3.89 -0.24 -0.32 5.04 -1.26 -4.83 117.35 117.46 2xao s TYR 212 Ca 0.35 1.70 -0.02 0.00 -2.44 0.00 0.00 57.07 56.66 2xao s TYR 212 Cb 0.21 -2.86 0.08 0.00 0.35 0.00 0.00 41.96 39.74 2xao s TYR 212 CO 0.40 0.44 0.05 0.34 -1.34 0.00 0.00 175.55 175.43 2xao s ASP 213 N -0.88 3.44 0.56 4.32 -1.08 -1.26 -4.88 116.67 116.88 2xao s ASP 213 Ca 0.39 -1.17 0.25 0.00 -0.52 0.00 0.00 52.55 51.49 2xao s ASP 213 Cb -0.23 -0.75 1.50 0.00 -1.46 0.00 0.00 42.92 41.97 2xao s ASP 213 CO 0.28 -0.34 2.09 -0.65 0.52 0.00 0.00 175.17 177.06 2xao h PRO 214 N 8.16 0.00 -0.30 4.34 0.11 -1.85 0.26 132.00 142.72 2xao h PRO 214 Ca -0.16 0.00 0.09 0.00 0.11 0.00 0.00 66.00 66.04 2xao h PRO 214 Cb 1.07 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 2xao h PRO 214 CO 0.40 0.00 0.25 -0.07 -0.21 0.00 0.00 178.00 178.37 2xao h LEU 215 N 0.00 0.00 0.01 2.35 3.38 -1.83 0.53 115.31 119.75 2xao h LEU 215 Ca 0.11 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.00 2xao h LEU 215 Cb 0.52 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.28 2xao h LEU 215 CO -0.00 0.00 -0.34 0.44 0.09 0.00 0.00 178.44 178.63 2xao h ASP 216 N 0.00 0.29 -0.86 -0.43 3.32 -1.24 -2.82 116.42 114.68 2xao h ASP 216 Ca 0.14 -0.79 -0.00 0.00 0.02 0.00 0.00 57.03 56.40 2xao h ASP 216 Cb 0.65 -0.09 -0.04 0.00 0.22 0.00 0.00 39.33 40.07 2xao h ASP 216 CO -0.00 1.04 0.54 0.25 -1.72 0.00 0.00 179.24 179.35 2xao h LEU 217 N -0.44 1.02 -0.99 1.55 5.85 -0.99 -2.13 115.31 119.18 2xao h LEU 217 Ca -0.04 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.62 2xao h LEU 217 Cb 1.10 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.88 2xao h LEU 217 CO 0.07 0.77 0.00 0.49 -0.34 0.00 0.00 178.44 179.43 2xao n PHE 218 N -4.44 0.01 0.27 1.25 3.72 -0.28 -4.46 117.46 113.53 2xao n PHE 218 Ca 0.09 -0.01 0.16 0.00 -0.05 0.00 0.00 57.45 57.64 2xao n PHE 218 Cb 0.04 0.00 0.73 0.00 -0.94 0.00 0.00 39.48 39.31 2xao n PHE 218 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2xao h SER 219 N 2.38 0.00 0.00 4.37 4.64 -1.10 -3.46 113.55 120.38 2xao h SER 219 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2xao h SER 219 Cb 0.51 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 2xao h SER 219 CO 0.00 0.08 0.00 0.61 -0.87 0.00 0.00 176.83 176.65 2xao n GLY 220 N -0.28 2.22 3.70 -0.77 0.00 -1.26 -5.00 105.19 103.80 2xao n GLY 220 Ca -0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.61 2xao n GLY 220 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2xao s SER 221 N -3.59 6.91 0.19 1.61 0.15 -1.26 -4.99 113.70 112.72 2xao s SER 221 Ca 0.00 1.11 -0.10 0.00 0.70 0.00 0.00 55.95 57.66 2xao s SER 221 Cb 0.00 -2.40 0.10 0.00 -1.71 0.00 0.00 66.02 62.01 2xao s SER 221 CO 0.00 -0.19 1.72 0.50 1.20 0.00 0.00 173.24 176.48 2xao h LYS 222 N 6.98 1.05 -0.46 5.44 3.64 -1.95 -0.74 116.57 130.52 2xao h LYS 222 Ca -0.37 -0.22 -0.10 0.00 -1.27 0.00 0.00 60.65 58.68 2xao h LYS 222 Cb 1.18 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.83 2xao h LYS 222 CO 0.77 0.91 -0.10 1.49 -2.27 0.00 0.00 179.45 180.24 2xao h GLU 223 N 0.98 0.89 0.00 1.90 4.81 -1.98 -2.27 114.58 118.91 2xao h GLU 223 Ca 0.22 -0.34 -0.06 0.00 -0.13 0.00 0.00 59.36 59.06 2xao h GLU 223 Cb 0.30 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.62 2xao h GLU 223 CO -0.01 0.98 -0.27 0.00 -0.73 0.00 0.00 179.01 178.99 2xao h ARG 224 N 0.73 0.00 -0.07 1.92 3.08 -1.82 -1.20 114.38 117.01 2xao h ARG 224 Ca 0.12 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.15 2xao h ARG 224 Cb 0.65 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.70 2xao h ARG 224 CO 0.04 0.27 -0.01 0.28 -1.07 0.00 0.00 179.97 179.47 2xao h VAL 225 N 0.00 1.29 -0.20 2.04 2.07 -0.78 -1.85 116.25 118.81 2xao h VAL 225 Ca -0.00 -0.90 -0.03 0.00 0.82 0.00 0.00 66.70 66.59 2xao h VAL 225 Cb 0.63 1.74 -0.01 0.00 -1.52 0.00 0.00 31.29 32.13 2xao h VAL 225 CO 0.03 0.25 0.00 0.25 0.02 0.00 0.00 177.57 178.13 2xao h LEU 226 N -0.19 0.26 -0.63 2.57 5.85 -1.23 -1.72 115.31 120.22 2xao h LEU 226 Ca 0.02 -0.03 -0.10 0.00 0.84 0.00 0.00 57.88 58.61 2xao h LEU 226 Cb 0.40 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.34 2xao h LEU 226 CO 0.01 0.32 -0.01 -0.08 -0.34 0.00 0.00 178.44 178.33 2xao h GLU 227 N 0.29 1.07 -0.62 1.25 4.81 -1.12 -1.59 114.58 118.67 2xao h GLU 227 Ca 0.07 -0.34 -0.07 0.00 -0.13 0.00 0.00 59.36 58.89 2xao h GLU 227 Cb 0.19 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.45 2xao h GLU 227 CO 0.00 1.04 0.11 0.00 -0.73 0.00 0.00 179.01 179.44 2xao h ALA 228 N 1.00 0.82 -0.50 2.92 0.00 -0.51 -2.16 119.26 120.84 2xao h ALA 228 Ca 0.17 -0.25 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 2xao h ALA 228 Cb 0.57 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2xao h ALA 228 CO 0.03 0.56 0.07 0.82 0.00 0.00 0.00 179.25 180.74 2xao h ILE 229 N 0.92 1.25 -0.63 0.00 1.08 -1.25 0.15 117.51 119.03 2xao h ILE 229 Ca 0.19 -0.94 0.03 0.00 -0.39 0.00 0.00 64.86 63.74 2xao h ILE 229 Cb 0.41 0.90 -0.04 0.00 -3.07 0.00 0.00 36.82 35.02 2xao h ILE 229 CO 0.01 0.34 0.39 0.11 -0.69 0.00 0.00 178.15 178.30 2xao h LYS 230 N 0.70 0.73 -0.50 2.37 1.57 -1.23 -0.99 116.57 119.23 2xao h LYS 230 Ca 0.15 -0.04 -0.09 0.00 -1.87 0.00 0.00 60.65 58.80 2xao h LYS 230 Cb 0.41 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.53 2xao h LYS 230 CO 0.01 0.49 -0.03 0.00 -0.57 0.00 0.00 179.45 179.35 2xao h ALA 231 N 1.27 0.67 -0.69 3.86 0.00 -1.10 -1.64 119.26 121.64 2xao h ALA 231 Ca 0.25 -0.30 0.02 0.00 0.00 0.00 0.00 54.91 54.88 2xao h ALA 231 Cb 0.03 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.60 2xao h ALA 231 CO -0.11 0.51 0.44 -0.07 0.00 0.00 0.00 179.25 180.02 2xao h LEU 232 N 0.76 0.74 -0.70 0.00 3.38 -0.44 -0.88 115.31 118.18 2xao h LEU 232 Ca 0.14 -0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.16 2xao h LEU 232 Cb 0.56 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 41.08 2xao h LEU 232 CO 0.03 0.52 0.40 0.22 0.09 0.00 0.00 178.44 179.70 2xao h TYR 233 N 0.88 0.73 0.39 1.13 3.20 -1.03 -2.51 116.97 119.75 2xao h TYR 233 Ca 0.27 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 62.14 2xao h TYR 233 Cb -0.03 -0.23 0.00 0.00 1.54 0.00 0.00 36.73 38.01 2xao h TYR 233 CO -0.04 0.35 -0.19 1.03 -1.64 0.00 0.00 178.16 177.68 2xao h SER 234 N 0.73 -0.44 -2.90 -2.11 0.87 -0.24 -3.37 113.55 106.10 2xao h SER 234 Ca 0.31 -0.09 -0.61 0.00 -1.23 0.00 0.00 61.79 60.17 2xao h SER 234 Cb 0.18 0.11 -0.40 0.00 -0.44 0.00 0.00 62.40 61.85 2xao h SER 234 CO -0.18 -0.16 -0.73 0.42 -0.53 0.00 0.00 176.83 175.66 2xao s THR 235 N -5.22 1.90 0.25 2.23 -4.23 -0.45 0.08 115.64 110.19 2xao s THR 235 Ca -0.15 -3.58 -0.04 0.00 -1.18 0.00 0.00 61.69 56.75 2xao s THR 235 Cb 0.03 -2.26 0.25 0.00 1.34 0.00 0.00 72.50 71.85 2xao s THR 235 CO 0.58 -1.07 1.87 -0.65 -0.54 0.00 0.00 174.62 174.80 2xao h PRO 236 N 5.59 1.07 0.00 3.99 0.11 -1.62 -3.43 132.00 137.71 2xao h PRO 236 Ca 0.17 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 66.22 2xao h PRO 236 Cb 0.82 -0.24 0.00 0.00 0.11 0.00 0.00 31.00 31.69 2xao h PRO 236 CO 0.58 0.71 0.00 1.04 -0.21 0.00 0.00 178.00 180.12 2xao n GLN 237 N -4.55 0.00 -0.50 1.05 6.02 -0.86 -0.79 117.38 117.75 2xao n GLN 237 Ca 0.14 0.00 0.06 0.00 -0.01 0.00 0.00 57.00 57.19 2xao n GLN 237 Cb 0.17 0.00 0.24 0.00 1.02 0.00 0.00 30.24 31.67 2xao n GLN 237 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 2xao n ASN 238 N 3.26 3.52 -0.00 1.08 2.04 -1.26 -1.55 115.26 122.34 2xao n ASN 238 Ca 0.00 -3.18 0.04 0.00 -0.44 0.00 0.00 54.58 51.01 2xao n ASN 238 Cb 0.00 -0.56 -0.06 0.00 -2.53 0.00 0.00 39.78 36.63 2xao n ASN 238 CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 2xao n ASN 239 N -0.70 1.84 -4.00 0.53 4.13 0.03 -4.64 115.26 112.45 2xao n ASN 239 Ca 0.24 -0.31 -0.21 0.00 1.68 0.00 0.00 54.58 55.98 2xao n ASN 239 Cb 0.92 1.23 -0.16 0.00 -1.54 0.00 0.00 39.78 40.23 2xao n ASN 239 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 2xao s PHE 240 N -2.28 1.06 -0.07 3.10 5.36 -1.17 -0.27 117.98 123.71 2xao s PHE 240 Ca -0.00 -0.29 -0.08 0.00 -0.96 0.00 0.00 56.93 55.59 2xao s PHE 240 Cb 0.06 -0.77 0.02 0.00 -0.34 0.00 0.00 43.02 41.99 2xao s PHE 240 CO 0.37 -0.14 0.22 1.03 -1.46 0.00 0.00 175.22 175.24 2xao s ARG 241 N 0.32 0.34 -0.03 10.12 0.52 0.06 -4.44 118.95 125.84 2xao s ARG 241 Ca -0.06 0.16 0.05 0.00 -0.52 0.00 0.00 55.73 55.37 2xao s ARG 241 Cb -0.10 0.16 -0.01 0.00 0.52 0.00 0.00 34.95 35.51 2xao s ARG 241 CO 0.01 -0.06 -0.18 0.08 0.02 0.00 0.00 175.30 175.17 2xao s VAL 242 N -0.24 1.46 -0.05 3.52 1.01 -1.04 0.74 120.40 125.80 2xao s VAL 242 Ca -0.03 -0.76 0.05 0.00 0.00 0.00 0.00 61.98 61.23 2xao s VAL 242 Cb -0.03 -1.23 -0.01 0.00 0.00 0.00 0.00 36.38 35.11 2xao s VAL 242 CO 0.01 0.42 -0.20 -0.36 0.00 0.00 0.00 175.10 174.97 2xao s PHE 243 N -0.22 1.94 -0.29 5.22 0.40 0.25 -0.46 117.98 124.80 2xao s PHE 243 Ca 0.02 -0.56 -0.07 0.00 -0.60 0.00 0.00 56.93 55.72 2xao s PHE 243 Cb -0.09 -1.29 0.01 0.00 0.51 0.00 0.00 43.02 42.16 2xao s PHE 243 CO 0.01 -0.18 0.08 -1.17 0.70 0.00 0.00 175.22 174.65 2xao s LEU 244 N -0.02 3.85 -1.38 -0.37 0.20 -0.18 -0.27 118.68 120.50 2xao s LEU 244 Ca -0.04 -0.71 -0.12 0.00 0.69 0.00 0.00 54.13 53.95 2xao s LEU 244 Cb -0.12 -1.88 0.10 0.00 -0.43 0.00 0.00 46.19 43.86 2xao s LEU 244 CO 0.03 -0.19 0.58 0.59 -0.29 0.00 0.00 176.35 177.06 2xao n ASN 245 N 4.86 -3.54 0.00 3.68 3.02 0.23 -1.81 115.26 121.71 2xao n ASN 245 Ca -0.14 -0.56 0.00 0.00 -0.03 0.00 0.00 54.58 53.84 2xao n ASN 245 Cb 0.48 -2.92 0.00 0.00 -0.61 0.00 0.00 39.78 36.73 2xao n ASN 245 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2xao n GLY 246 N -1.23 2.95 3.71 7.41 0.00 -1.26 -5.00 105.19 111.78 2xao n GLY 246 Ca 0.02 -0.15 -0.41 0.00 0.00 0.00 0.00 46.02 45.48 2xao n GLY 246 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2xao s SER 247 N 0.74 7.24 0.20 1.61 1.04 -0.75 -4.99 113.70 118.79 2xao s SER 247 Ca 0.00 1.50 -0.33 0.00 0.48 0.00 0.00 55.95 57.60 2xao s SER 247 Cb 0.00 -2.51 -0.13 0.00 0.10 0.00 0.00 66.02 63.47 2xao s SER 247 CO 0.00 -0.20 1.58 -0.11 0.98 0.00 0.00 173.24 175.48 2xao n LEU 248 N 3.81 3.37 0.00 2.42 7.94 -1.26 -1.01 117.00 132.27 2xao n LEU 248 Ca 0.03 1.10 0.00 0.00 -1.11 0.00 0.00 56.01 56.03 2xao n LEU 248 Cb 0.51 -1.47 0.00 0.00 0.53 0.00 0.00 43.42 42.99 2xao n LEU 248 CO 0.50 -0.20 0.15 2.30 -1.11 0.00 0.00 177.39 179.03 2xao n ILE 249 N 3.13 0.03 -3.59 1.96 -5.35 0.39 -4.87 119.36 111.07 2xao n ILE 249 Ca 0.15 -0.28 -0.16 0.00 -0.27 0.00 0.00 62.75 62.19 2xao n ILE 249 Cb 0.31 1.42 -0.07 0.00 -1.74 0.00 0.00 39.64 39.56 2xao n ILE 249 CO 0.00 0.00 0.00 -0.22 -1.76 0.00 0.00 176.55 174.57 2xao s LEU 250 N -0.03 -0.49 0.00 7.28 2.96 -1.10 -4.59 118.68 122.70 2xao s LEU 250 Ca 0.00 0.93 0.00 0.00 -0.22 0.00 0.00 54.13 54.84 2xao s LEU 250 Cb 0.00 2.33 0.00 0.00 0.50 0.00 0.00 46.19 49.02 2xao s LEU 250 CO 0.00 -0.44 0.00 0.61 -1.32 0.00 0.00 176.35 175.20 2xao n GLY 251 N 1.69 -1.35 0.00 7.98 0.00 -1.26 -2.50 105.19 109.74 2xao n GLY 251 Ca -0.17 -1.57 0.00 0.00 0.00 0.00 0.00 46.02 44.28 2xao n GLY 251 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2xao n GLY 252 N -1.39 0.60 2.72 -0.02 0.00 -1.26 -4.96 105.19 100.87 2xao n GLY 252 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2xao n GLY 252 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2xao n GLU 255 N 0.00 0.00 -3.15 1.61 0.28 -1.26 -5.00 120.64 113.12 2xao n GLU 255 Ca 0.00 0.00 -0.39 0.00 -0.16 0.00 0.00 57.16 56.61 2xao n GLU 255 Cb 0.00 0.00 -0.05 0.00 1.43 0.00 0.00 31.44 32.82 2xao n GLU 255 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 2xao s SER 256 N -2.02 6.98 0.12 -1.84 0.15 -1.26 -4.44 113.70 111.38 2xao s SER 256 Ca 0.00 1.17 0.08 0.00 0.70 0.00 0.00 55.95 57.90 2xao s SER 256 Cb 0.00 -2.38 -0.04 0.00 -1.71 0.00 0.00 66.02 61.89 2xao s SER 256 CO 0.00 0.04 -0.15 0.28 1.20 0.00 0.00 173.24 174.61 2xao s THR 257 N 0.12 3.05 1.11 6.45 -1.32 -0.59 -4.90 115.64 119.56 2xao s THR 257 Ca 0.33 -1.44 -0.14 0.00 -1.21 0.00 0.00 61.69 59.23 2xao s THR 257 Cb -0.18 -2.42 0.25 0.00 -1.51 0.00 0.00 72.50 68.64 2xao s THR 257 CO 0.17 0.08 1.06 -0.83 -2.21 0.00 0.00 174.62 172.90 2xao s GLY 258 N -2.23 1.55 0.44 6.08 0.00 -1.26 -2.03 107.32 109.87 2xao s GLY 258 Ca 0.20 -0.42 -0.21 0.00 0.00 0.00 0.00 44.72 44.29 2xao s GLY 258 CO 0.12 0.30 0.22 -2.13 0.00 0.00 0.00 173.10 171.61 2xao n ARG 259 N -4.60 0.20 -2.37 2.90 0.63 -1.26 -4.50 116.66 107.65 2xao n ARG 259 Ca 0.06 0.08 -0.43 0.00 -0.92 0.00 0.00 57.85 56.63 2xao n ARG 259 Cb 0.57 -1.21 -0.02 0.00 0.45 0.00 0.00 32.46 32.25 2xao n ARG 259 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 2xao s THR 260 N -1.68 3.98 0.59 5.15 2.01 0.11 -4.99 115.64 120.80 2xao s THR 260 Ca 0.61 1.03 -0.08 0.00 0.31 0.00 0.00 61.69 63.56 2xao s THR 260 Cb -0.59 -4.19 -0.02 0.00 0.01 0.00 0.00 72.50 67.71 2xao s THR 260 CO 0.61 -0.67 0.94 -0.94 -0.69 0.00 0.00 174.62 173.87 2xao s SER 261 N 3.56 5.99 0.40 3.53 1.04 -1.26 -4.83 113.70 122.13 2xao s SER 261 Ca 0.60 1.08 0.17 0.00 0.48 0.00 0.00 55.95 58.28 2xao s SER 261 Cb -0.15 -2.17 1.07 0.00 0.10 0.00 0.00 66.02 64.88 2xao s SER 261 CO 0.30 -0.89 1.80 -0.65 0.98 0.00 0.00 173.24 174.77 2xao h PRO 262 N -0.18 0.42 0.42 4.02 0.11 -1.97 0.86 132.00 135.68 2xao h PRO 262 Ca -0.45 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 65.61 2xao h PRO 262 Cb 1.22 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2xao h PRO 262 CO 0.62 0.27 -0.20 0.93 -0.21 0.00 0.00 178.00 179.41 2xao h GLU 263 N 0.43 -0.55 -0.10 1.05 3.07 -1.99 -0.35 114.58 116.14 2xao h GLU 263 Ca 0.55 0.04 0.02 0.00 -0.50 0.00 0.00 59.36 59.48 2xao h GLU 263 Cb 1.36 0.12 -0.02 0.00 -0.84 0.00 0.00 28.75 29.37 2xao h GLU 263 CO -0.26 -0.33 -0.05 0.82 -1.40 0.00 0.00 179.01 177.79 2xao h ILE 264 N -0.64 0.84 -0.39 3.13 1.08 -1.72 -2.27 117.51 117.54 2xao h ILE 264 Ca -0.06 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.42 2xao h ILE 264 Cb 0.48 0.84 -0.02 0.00 -3.07 0.00 0.00 36.82 35.05 2xao h ILE 264 CO 0.10 0.00 0.26 1.23 -0.69 0.00 0.00 178.15 179.05 2xao h GLY 265 N -0.04 0.55 0.93 5.37 0.00 0.81 -1.63 103.07 109.06 2xao h GLY 265 Ca 0.06 -0.20 -0.20 0.00 0.00 0.00 0.00 47.33 46.98 2xao h GLY 265 CO -0.13 0.20 -0.80 -1.82 0.00 0.00 0.00 176.54 173.99 2xao h TYR 266 N 0.53 0.76 -0.97 5.60 3.20 -0.88 -2.03 116.97 123.18 2xao h TYR 266 Ca 0.14 -0.43 0.04 0.00 3.14 0.00 0.00 58.73 61.62 2xao h TYR 266 Cb -0.05 -0.08 -0.06 0.00 1.54 0.00 0.00 36.73 38.08 2xao h TYR 266 CO -0.00 1.27 0.63 0.00 -1.64 0.00 0.00 178.16 178.42 2xao h ALA 267 N 0.32 1.38 -0.07 1.82 0.00 -0.95 -0.17 119.26 121.60 2xao h ALA 267 Ca -0.11 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 2xao h ALA 267 Cb 1.51 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 2xao h ALA 267 CO 0.16 0.52 -0.04 0.35 0.00 0.00 0.00 179.25 180.23 2xao h PHE 268 N 1.21 0.17 -0.68 0.00 3.57 -1.38 -1.52 116.94 118.32 2xao h PHE 268 Ca 0.39 -0.05 0.13 0.00 3.53 0.00 0.00 57.97 61.97 2xao h PHE 268 Cb 0.03 -0.04 -0.09 0.00 2.79 0.00 0.00 35.95 38.64 2xao h PHE 268 CO -0.00 0.54 0.21 1.49 -2.23 0.00 0.00 178.31 178.32 2xao h GLU 269 N -0.25 0.33 -0.54 1.11 4.57 -0.89 -1.36 114.58 117.55 2xao h GLU 269 Ca 0.01 -0.02 -0.08 0.00 -1.18 0.00 0.00 59.36 58.09 2xao h GLU 269 Cb 0.50 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 29.00 2xao h GLU 269 CO 0.01 0.22 0.01 0.22 -1.18 0.00 0.00 179.01 178.29 2xao h ASP 270 N 0.34 0.92 0.23 1.04 3.58 -0.94 -2.72 116.42 118.87 2xao h ASP 270 Ca 0.37 -0.30 0.00 0.00 0.42 0.00 0.00 57.03 57.52 2xao h ASP 270 Cb 0.56 -0.25 0.00 0.00 1.72 0.00 0.00 39.33 41.36 2xao h ASP 270 CO -0.42 1.00 0.00 0.00 -2.88 0.00 0.00 179.24 176.94 2xao h ALA 271 N 0.96 1.00 0.00 -0.78 0.00 -0.18 -2.47 119.26 117.79 2xao h ALA 271 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2xao h ALA 271 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2xao h ALA 271 CO 0.02 0.00 -0.85 1.28 0.00 0.00 0.00 179.25 179.71 2xao n LEU 272 N -2.42 0.72 -4.70 0.00 4.77 -1.00 -4.91 117.00 109.46 2xao n LEU 272 Ca -0.01 0.20 -0.43 0.00 -0.03 0.00 0.00 56.01 55.75 2xao n LEU 272 Cb 0.10 -0.12 -0.01 0.00 -2.33 0.00 0.00 43.42 41.06 2xao n LEU 272 CO 0.14 -0.08 0.97 2.29 -1.33 0.00 0.00 177.39 179.39 2xao n LYS 273 N -2.26 2.19 0.00 3.23 2.85 -0.93 -2.08 118.16 121.15 2xao n LYS 273 Ca 0.02 0.77 0.00 0.00 -1.05 0.00 0.00 58.31 58.05 2xao n LYS 273 Cb 0.47 -2.40 0.00 0.00 -0.65 0.00 0.00 35.03 32.46 2xao n LYS 273 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2xao n GLY 274 N 1.22 2.47 0.12 2.58 0.00 -1.26 -4.75 105.19 105.56 2xao n GLY 274 Ca 0.07 -0.51 -0.12 0.00 0.00 0.00 0.00 46.02 45.45 2xao n GLY 274 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2xao h PHE 275 N 0.00 0.33 -3.61 1.61 3.04 -1.78 -3.39 116.94 113.13 2xao h PHE 275 Ca 0.00 -0.07 -0.70 0.00 3.98 0.00 0.00 57.97 61.19 2xao h PHE 275 Cb 0.00 -0.08 -0.22 0.00 2.56 0.00 0.00 35.95 38.20 2xao h PHE 275 CO 0.00 0.56 -0.51 0.42 -2.02 0.00 0.00 178.31 176.76 2xao s ILE 276 N -4.81 4.81 -1.31 1.41 1.09 -0.88 -5.00 121.20 116.51 2xao s ILE 276 Ca -0.14 -0.59 -0.13 0.00 -1.10 0.00 0.00 60.65 58.68 2xao s ILE 276 Cb 0.06 -3.58 0.12 0.00 -1.06 0.00 0.00 42.46 38.00 2xao s ILE 276 CO 0.73 -0.12 1.82 0.00 -0.10 0.00 0.00 174.94 177.27 2xao n GLN 277 N 5.04 3.30 -4.14 2.79 6.02 -1.26 -4.73 117.38 124.40 2xao n GLN 277 Ca -0.12 -3.35 -0.10 0.00 -0.01 0.00 0.00 57.00 53.42 2xao n GLN 277 Cb 0.48 -3.14 -0.10 0.00 1.02 0.00 0.00 30.24 28.49 2xao n GLN 277 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2xao s SER 278 N 2.51 0.93 0.50 1.08 0.15 -1.26 -4.79 113.70 112.82 2xao s SER 278 Ca 0.45 -0.96 -0.22 0.00 0.70 0.00 0.00 55.95 55.92 2xao s SER 278 Cb 0.07 0.12 -0.08 0.00 -1.71 0.00 0.00 66.02 64.41 2xao s SER 278 CO -0.00 -0.48 1.00 1.21 1.20 0.00 0.00 173.24 176.17 2xao n GLU 279 N 0.14 1.20 -1.62 5.44 2.13 -1.26 -4.73 120.64 121.94 2xao n GLU 279 Ca -0.14 0.44 -0.48 0.00 0.66 0.00 0.00 57.16 57.64 2xao n GLU 279 Cb 0.60 -2.12 -0.05 0.00 0.27 0.00 0.00 31.44 30.14 2xao n GLU 279 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 2xao n ASP 280 N -0.04 3.10 0.00 4.31 4.64 -1.26 -1.31 116.55 125.99 2xao n ASP 280 Ca 0.11 0.74 0.00 0.00 -1.38 0.00 0.00 54.79 54.25 2xao n ASP 280 Cb 0.43 -1.37 0.00 0.00 -1.04 0.00 0.00 41.12 39.14 2xao n ASP 280 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 2xao n GLY 281 N 5.08 2.82 0.76 0.27 0.00 -1.26 -4.94 105.19 107.93 2xao n GLY 281 Ca 0.28 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.37 2xao n GLY 281 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2xao n HIS 282 N -1.31 0.54 0.02 1.61 8.25 -0.43 -4.55 115.22 119.35 2xao n HIS 282 Ca 0.00 -0.48 -0.16 0.00 -0.26 0.00 0.00 57.72 56.82 2xao n HIS 282 Cb 0.00 -0.02 -0.05 0.00 1.12 0.00 0.00 29.99 31.04 2xao n HIS 282 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2xao h ARG 283 N 2.45 0.65 -0.01 -0.41 3.08 -1.85 -3.17 114.38 115.11 2xao h ARG 283 Ca 0.00 -0.58 -0.00 0.00 0.07 0.00 0.00 59.98 59.47 2xao h ARG 283 Cb 0.77 0.14 -0.00 0.00 0.08 0.00 0.00 29.97 30.96 2xao h ARG 283 CO 0.00 1.19 0.00 1.15 -1.07 0.00 0.00 179.97 181.24 2xao h THR 284 N 0.42 1.07 -0.41 2.04 2.02 -1.92 -0.80 112.91 115.33 2xao h THR 284 Ca -0.07 -0.21 -0.03 0.00 0.77 0.00 0.00 66.41 66.87 2xao h THR 284 Cb 1.47 1.21 -0.02 0.00 -1.74 0.00 0.00 68.15 69.06 2xao h THR 284 CO 0.16 0.06 0.13 1.05 0.37 0.00 0.00 175.52 177.29 2xao h GLU 285 N -0.08 0.59 -0.28 6.66 4.11 -1.87 -0.45 114.58 123.25 2xao h GLU 285 Ca 0.00 -0.09 -0.01 0.00 0.07 0.00 0.00 59.36 59.34 2xao h GLU 285 Cb 0.09 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 2xao h GLU 285 CO -0.00 0.52 0.15 0.00 0.07 0.00 0.00 179.01 179.75 2xao h PHE 287 N 0.34 0.35 -0.98 0.00 3.57 0.05 0.42 116.94 120.69 2xao h PHE 287 Ca 0.10 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.62 2xao h PHE 287 Cb 0.06 -0.11 -0.05 0.00 2.79 0.00 0.00 35.95 38.64 2xao h PHE 287 CO -0.03 0.27 0.65 -0.07 -2.23 0.00 0.00 178.31 176.89 2xao h LEU 288 N 0.32 1.10 -0.71 0.59 3.38 -1.09 0.23 115.31 119.13 2xao h LEU 288 Ca 0.09 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 57.96 2xao h LEU 288 Cb 0.02 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 2xao h LEU 288 CO -0.02 0.77 0.07 -0.61 0.09 0.00 0.00 178.44 178.75 2xao h GLN 289 N 1.28 1.06 -0.06 1.13 5.75 -0.88 -0.98 115.11 122.41 2xao h GLN 289 Ca 0.37 -0.29 0.02 0.00 -0.15 0.00 0.00 58.65 58.60 2xao h GLN 289 Cb -0.07 -0.12 -0.02 0.00 1.07 0.00 0.00 27.48 28.34 2xao h GLN 289 CO -0.10 0.99 -0.05 1.25 -2.65 0.00 0.00 178.83 178.27 2xao h LEU 290 N 0.99 -0.15 -0.33 -2.39 5.85 0.14 -1.00 115.31 118.41 2xao h LEU 290 Ca 0.19 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.94 2xao h LEU 290 Cb 0.47 0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.56 2xao h LEU 290 CO 0.02 -0.07 0.21 0.58 -0.34 0.00 0.00 178.44 178.84 2xao h VAL 291 N -0.06 1.10 0.05 1.05 2.07 -0.84 -2.50 116.25 117.12 2xao h VAL 291 Ca 0.04 -0.20 0.02 0.00 0.82 0.00 0.00 66.70 67.38 2xao h VAL 291 Cb 0.12 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 30.49 2xao h VAL 291 CO -0.10 0.10 -0.17 -1.28 0.02 0.00 0.00 177.57 176.14 2xao h SER 292 N 0.44 -0.48 -0.43 0.57 0.87 -0.85 -1.05 113.55 112.63 2xao h SER 292 Ca 0.12 0.06 0.07 0.00 -1.23 0.00 0.00 61.79 60.81 2xao h SER 292 Cb -0.03 0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.10 2xao h SER 292 CO -0.02 -0.24 0.29 0.44 -0.53 0.00 0.00 176.83 176.77 2xao h ASP 293 N -0.30 0.26 0.25 6.23 3.32 -1.15 -0.33 116.42 124.69 2xao h ASP 293 Ca 0.04 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.08 2xao h ASP 293 Cb 0.34 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.84 2xao h ASP 293 CO -0.13 0.17 -0.12 0.00 -1.72 0.00 0.00 179.24 177.44 2xao h ALA 294 N 1.77 -0.33 -0.37 3.45 0.00 -0.94 0.28 119.26 123.11 2xao h ALA 294 Ca 0.19 -0.15 0.05 0.00 0.00 0.00 0.00 54.91 55.01 2xao h ALA 294 Cb 0.39 0.13 -0.08 0.00 0.00 0.00 0.00 17.79 18.23 2xao h ALA 294 CO -0.04 -0.34 -0.51 0.28 0.00 0.00 0.00 179.25 178.63 2xao h VAL 295 N -1.03 0.04 -0.12 0.00 2.07 -1.12 -0.03 116.25 116.07 2xao h VAL 295 Ca -0.03 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.48 2xao h VAL 295 Cb 0.40 0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.20 2xao h VAL 295 CO 0.06 0.00 0.07 0.22 0.02 0.00 0.00 177.57 177.94 2xao h TYR 296 N -0.40 0.15 -0.91 1.57 3.20 -1.14 -2.97 116.97 116.48 2xao h TYR 296 Ca 0.09 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.96 2xao h TYR 296 Cb 0.61 -0.05 -0.04 0.00 1.54 0.00 0.00 36.73 38.78 2xao h TYR 296 CO -0.67 0.14 0.59 0.78 -1.64 0.00 0.00 178.16 177.36 2xao h GLY 297 N 0.12 1.29 2.00 1.82 0.00 -0.22 -2.08 103.07 106.00 2xao h GLY 297 Ca 0.04 -0.50 0.00 0.00 0.00 0.00 0.00 47.33 46.87 2xao h GLY 297 CO -0.01 0.49 0.00 -1.14 0.00 0.00 0.00 176.54 175.88 2xao n SER 298 N -4.38 0.11 -1.89 0.19 3.41 -0.05 -4.87 113.62 106.14 2xao n SER 298 Ca 0.10 0.52 -0.03 0.00 -0.26 0.00 0.00 58.87 59.20 2xao n SER 298 Cb 0.03 -0.55 -0.01 0.00 -0.26 0.00 0.00 64.21 63.43 2xao n SER 298 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2xao n GLY 299 N 0.33 -0.15 0.16 5.00 0.00 -0.78 -4.76 105.19 104.99 2xao n GLY 299 Ca 0.04 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.19 2xao n GLY 299 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2xao h VAL 300 N 0.00 0.00 0.00 1.61 3.04 -1.86 -2.95 116.25 116.09 2xao h VAL 300 Ca -0.07 -0.39 -0.18 0.00 -1.01 0.00 0.00 66.70 65.04 2xao h VAL 300 Cb 0.70 1.25 -0.03 0.00 -2.01 0.00 0.00 31.29 31.20 2xao h VAL 300 CO 0.09 0.00 -0.88 -0.07 -1.01 0.00 0.00 177.57 175.70 2xao h LEU 301 N 0.00 0.00 -0.98 3.16 4.07 -1.86 -3.24 115.31 116.47 2xao h LEU 301 Ca 0.00 0.00 -0.09 0.00 0.08 0.00 0.00 57.88 57.87 2xao h LEU 301 Cb 0.52 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.24 2xao h LEU 301 CO 0.00 0.88 -0.18 0.44 -1.08 0.00 0.00 178.44 178.51 2xao h ASP 302 N 0.00 0.53 0.81 -0.43 3.32 -1.88 -1.49 116.42 117.29 2xao h ASP 302 Ca -0.01 -0.16 -0.24 0.00 0.02 0.00 0.00 57.03 56.64 2xao h ASP 302 Cb 1.64 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 41.02 2xao h ASP 302 CO 0.11 0.72 -1.22 0.03 -1.72 0.00 0.00 179.24 177.16 2xao h ARG 303 N 0.49 0.04 -0.30 3.56 3.08 -1.71 -2.57 114.38 116.97 2xao h ARG 303 Ca 0.08 -0.06 -0.11 0.00 0.07 0.00 0.00 59.98 59.96 2xao h ARG 303 Cb 0.58 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.64 2xao h ARG 303 CO 0.04 0.90 -0.27 1.25 -1.07 0.00 0.00 179.97 180.83 2xao h LEU 304 N 0.01 0.61 -1.16 3.04 5.85 -1.55 -2.96 115.31 119.14 2xao h LEU 304 Ca -0.10 -0.22 -0.08 0.00 0.84 0.00 0.00 57.88 58.32 2xao h LEU 304 Cb 1.86 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 42.71 2xao h LEU 304 CO 0.12 0.85 -0.30 0.25 -0.34 0.00 0.00 178.44 179.02 2xao h LEU 305 N 0.52 0.20 -0.74 2.25 5.85 -1.06 -1.44 115.31 120.88 2xao h LEU 305 Ca 0.07 -0.06 -0.13 0.00 0.84 0.00 0.00 57.88 58.60 2xao h LEU 305 Cb 0.73 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.69 2xao h LEU 305 CO 0.06 0.50 -0.47 -0.33 -0.34 0.00 0.00 178.44 177.85 2xao h GLU 306 N 0.18 0.37 -0.20 1.25 5.08 -1.30 -1.23 114.58 118.73 2xao h GLU 306 Ca 0.02 -0.20 -0.21 0.00 -1.00 0.00 0.00 59.36 57.97 2xao h GLU 306 Cb 0.63 0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.90 2xao h GLU 306 CO 0.05 0.77 -0.68 0.82 -1.00 0.00 0.00 179.01 178.96 2xao h ILE 307 N 0.30 1.28 -0.92 3.13 2.04 -1.42 -3.06 117.51 118.85 2xao h ILE 307 Ca 0.02 -1.87 0.10 0.00 1.00 0.00 0.00 64.86 64.10 2xao h ILE 307 Cb 0.95 1.85 -0.08 0.00 -0.74 0.00 0.00 36.82 38.80 2xao h ILE 307 CO 0.08 0.60 0.56 1.56 0.00 0.00 0.00 178.15 180.95 2xao h GLN 308 N 0.58 0.90 0.00 2.37 4.20 -1.01 -1.89 115.11 120.26 2xao h GLN 308 Ca -0.03 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.63 2xao h GLN 308 Cb 1.31 -0.20 0.00 0.00 0.30 0.00 0.00 27.48 28.88 2xao h GLN 308 CO 0.15 0.60 0.00 1.63 -0.67 0.00 0.00 178.83 180.53 2xao n LYS 309 N -4.66 0.66 0.16 1.46 5.02 -0.49 -1.93 118.16 118.38 2xao n LYS 309 Ca 0.16 0.00 0.13 0.00 -2.02 0.00 0.00 58.31 56.58 2xao n LYS 309 Cb 0.29 -1.33 0.55 0.00 -0.02 0.00 0.00 35.03 34.53 2xao n LYS 309 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 2xao h LEU 310 N 0.00 0.00 -6.20 -0.35 4.07 -1.38 -3.18 115.31 108.27 2xao h LEU 310 Ca 0.00 0.00 -0.67 0.00 0.08 0.00 0.00 57.88 57.29 2xao h LEU 310 Cb 0.00 0.00 0.01 0.00 1.08 0.00 0.00 40.66 41.75 2xao h LEU 310 CO 0.00 0.00 2.72 -0.67 -1.08 0.00 0.00 178.44 179.41 2xao n ASP 311 N -2.38 3.32 -0.02 -0.43 2.03 -0.81 -4.32 116.55 113.93 2xao n ASP 311 Ca 0.01 -2.74 0.05 0.00 0.52 0.00 0.00 54.79 52.64 2xao n ASP 311 Cb 0.21 -1.36 0.44 0.00 -0.72 0.00 0.00 41.12 39.68 2xao n ASP 311 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 2xao h LYS 312 N 6.94 0.52 -0.00 -0.67 1.57 -1.86 -3.30 116.57 119.77 2xao h LYS 312 Ca 0.50 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.25 2xao h LYS 312 Cb 0.63 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.83 2xao h LYS 312 CO 1.91 0.35 -0.28 1.28 -0.57 0.00 0.00 179.45 182.14 2xao n LEU 313 N -4.47 0.57 -0.83 2.94 4.77 -1.26 -4.65 117.00 114.06 2xao n LEU 313 Ca 0.05 -0.59 0.03 0.00 -0.03 0.00 0.00 56.01 55.47 2xao n LEU 313 Cb 0.12 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.19 2xao n LEU 313 CO 0.35 0.13 -0.30 -0.67 -1.33 0.00 0.00 177.39 175.57 2xao n ASP 314 N -0.89 -4.51 -0.26 -1.43 2.03 -1.25 -3.23 116.55 107.02 2xao n ASP 314 Ca 0.02 0.95 0.24 0.00 0.52 0.00 0.00 54.79 56.52 2xao n ASP 314 Cb 0.13 -2.47 0.59 0.00 -0.72 0.00 0.00 41.12 38.64 2xao n ASP 314 CO 0.00 0.00 0.00 -0.29 -1.92 0.00 0.00 177.20 174.99 2xao h ILE 315 N -0.23 0.58 0.00 5.18 6.09 -1.97 0.25 117.51 127.41 2xao h ILE 315 Ca -0.04 -0.09 -0.01 0.00 -1.37 0.00 0.00 64.86 63.35 2xao h ILE 315 Cb 0.61 0.29 -0.00 0.00 0.47 0.00 0.00 36.82 38.19 2xao h ILE 315 CO 0.02 0.05 -0.04 -0.33 -3.07 0.00 0.00 178.15 174.77 2xao h GLU 316 N 0.26 0.00 0.00 2.19 5.08 -1.89 -1.33 114.58 118.90 2xao h GLU 316 Ca 0.50 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.83 2xao h GLU 316 Cb 1.51 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.75 2xao h GLU 316 CO -0.15 0.04 -0.71 0.41 -1.00 0.00 0.00 179.01 177.59 2xao n GLY 317 N -0.52 -0.87 0.40 -3.84 0.00 0.69 -4.61 105.19 96.45 2xao n GLY 317 Ca -0.01 -0.16 0.20 0.00 0.00 0.00 0.00 46.02 46.04 2xao n GLY 317 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2xao h ALA 318 N -0.95 2.37 -0.92 4.61 0.00 -0.90 -1.85 119.26 121.62 2xao h ALA 318 Ca -0.05 -0.01 0.11 0.00 0.00 0.00 0.00 54.91 54.96 2xao h ALA 318 Cb 0.69 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.41 2xao h ALA 318 CO -0.03 -0.59 0.59 0.97 0.00 0.00 0.00 179.25 180.19 2xao h ILE 319 N 0.24 0.93 -0.58 0.00 6.09 -1.49 -0.80 117.51 121.90 2xao h ILE 319 Ca 0.38 -0.30 -0.02 0.00 -1.37 0.00 0.00 64.86 63.54 2xao h ILE 319 Cb 1.13 -0.03 -0.03 0.00 0.47 0.00 0.00 36.82 38.37 2xao h ILE 319 CO -0.08 0.16 0.27 0.45 -3.07 0.00 0.00 178.15 175.87 2xao h HIS 320 N 0.88 0.85 -0.08 2.19 3.86 -1.61 -2.25 115.15 119.00 2xao h HIS 320 Ca 0.44 -0.05 -0.05 0.00 -1.16 0.00 0.00 60.37 59.56 2xao h HIS 320 Cb 0.48 -0.26 -0.01 0.00 1.06 0.00 0.00 27.41 28.68 2xao h HIS 320 CO -0.00 0.66 -0.16 0.00 0.86 0.00 0.00 177.93 179.29 2xao h TYR 322 N 0.12 0.23 0.00 0.00 3.20 -0.74 -2.47 116.97 117.31 2xao h TYR 322 Ca 0.02 -0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.85 2xao h TYR 322 Cb 0.36 -0.07 -0.00 0.00 1.54 0.00 0.00 36.73 38.57 2xao h TYR 322 CO 0.00 0.36 -0.07 1.88 -1.64 0.00 0.00 178.16 178.70 2xao h TYR 323 N 0.04 0.00 -0.45 -3.82 0.05 -1.19 0.53 116.97 112.13 2xao h TYR 323 Ca 0.05 0.00 -0.08 0.00 0.05 0.00 0.00 58.73 58.75 2xao h TYR 323 Cb 0.24 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.97 2xao h TYR 323 CO 0.00 0.07 -0.02 -0.44 -1.05 0.00 0.00 178.16 176.72 2xao h ASP 324 N 0.00 0.80 -0.32 3.88 3.32 -1.41 -0.31 116.42 122.37 2xao h ASP 324 Ca -0.00 -0.32 -0.01 0.00 0.02 0.00 0.00 57.03 56.71 2xao h ASP 324 Cb 0.12 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 2xao h ASP 324 CO 0.01 0.93 0.14 0.40 -1.72 0.00 0.00 179.24 179.00 2xao h ILE 325 N 0.65 1.17 0.00 0.35 2.04 -0.44 -1.40 117.51 119.88 2xao h ILE 325 Ca 0.12 -0.49 0.00 0.00 1.00 0.00 0.00 64.86 65.49 2xao h ILE 325 Cb 0.53 0.90 0.00 0.00 -0.74 0.00 0.00 36.82 37.51 2xao h ILE 325 CO 0.03 0.18 0.00 2.30 0.00 0.00 0.00 178.15 180.65 2xao n ILE 326 N -4.75 0.01 -3.66 -0.67 -5.35 -0.80 -4.91 119.36 99.23 2xao n ILE 326 Ca -0.02 0.00 -0.24 0.00 -0.27 0.00 0.00 62.75 62.22 2xao n ILE 326 Cb 0.12 -0.51 0.06 0.00 -1.74 0.00 0.00 39.64 37.57 2xao n ILE 326 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 2xao n ASN 327 N -1.08 -5.00 -4.67 7.28 4.13 -0.53 -5.04 115.26 110.34 2xao n ASN 327 Ca 0.21 -0.63 -0.31 0.00 1.68 0.00 0.00 54.58 55.53 2xao n ASN 327 Cb 0.15 -4.70 -0.08 0.00 -1.54 0.00 0.00 39.78 33.60 2xao n ASN 327 CO 0.00 0.00 0.00 -1.58 0.28 0.00 0.00 177.26 175.96 2xao s GLN 328 N -6.23 2.58 0.30 3.52 0.74 -0.16 -5.03 119.66 115.37 2xao s GLN 328 Ca 0.48 -0.79 -0.30 0.00 0.05 0.00 0.00 55.36 54.80 2xao s GLN 328 Cb -0.22 -2.55 -0.12 0.00 1.10 0.00 0.00 33.01 31.22 2xao s GLN 328 CO 0.76 0.56 1.53 -2.30 -0.55 0.00 0.00 175.29 175.29 2xao n PRO 329 N 0.81 2.55 -2.36 1.67 -0.02 -1.26 -4.35 135.00 132.04 2xao n PRO 329 Ca -0.12 0.90 -0.43 0.00 -2.02 0.00 0.00 63.50 61.84 2xao n PRO 329 Cb 0.52 -2.65 -0.02 0.00 -0.02 0.00 0.00 33.50 31.33 2xao n PRO 329 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2xao h PRO 331 N 8.97 0.00 -0.16 0.00 0.13 -1.99 -3.35 132.00 135.60 2xao h PRO 331 Ca -0.28 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.80 2xao h PRO 331 Cb 1.11 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.24 2xao h PRO 331 CO 0.99 0.08 -0.10 0.82 -0.23 0.00 0.00 178.00 179.57 2xao h ILE 332 N 0.00 1.32 -3.98 -3.56 1.08 -1.98 -3.39 117.51 107.00 2xao h ILE 332 Ca -0.00 -1.19 -0.50 0.00 -0.39 0.00 0.00 64.86 62.78 2xao h ILE 332 Cb 1.01 1.75 0.06 0.00 -3.07 0.00 0.00 36.82 36.57 2xao h ILE 332 CO 0.01 0.35 0.48 0.00 -0.69 0.00 0.00 178.15 178.30 2xao n LYS 334 N -0.32 2.04 -1.55 0.00 5.02 -1.26 -4.89 118.16 117.19 2xao n LYS 334 Ca 0.06 0.00 -0.36 0.00 -2.02 0.00 0.00 58.31 56.00 2xao n LYS 334 Cb 0.48 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 35.45 2xao n LYS 334 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2xao n GLU 335 N -0.32 3.77 -3.20 1.97 1.02 -1.26 -5.12 120.64 117.49 2xao n GLU 335 Ca 0.00 -2.57 -0.33 0.00 -0.02 0.00 0.00 57.16 54.24 2xao n GLU 335 Cb 0.00 -2.60 -0.06 0.00 -0.02 0.00 0.00 31.44 28.76 2xao n GLU 335 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2xao s GLU 342 N 0.44 4.00 -0.41 3.49 8.01 -1.26 -5.34 118.70 127.63 2xao s GLU 342 Ca 0.63 0.61 -0.06 0.00 0.01 0.00 0.00 54.97 56.15 2xao s GLU 342 Cb 0.21 -2.58 -0.16 0.00 -4.31 0.00 0.00 34.13 27.30 2xao s GLU 342 CO -0.08 0.25 3.30 -0.11 0.01 0.00 0.00 175.26 178.63 2xao n LEU 343 N -0.07 6.17 0.00 1.80 -0.00 -1.26 -3.64 117.00 119.99 2xao n LEU 343 Ca 0.01 -3.62 0.00 0.00 -0.00 0.00 0.00 56.01 52.40 2xao n LEU 343 Cb 0.53 -1.40 0.00 0.00 -0.00 0.00 0.00 43.42 42.54 2xao n LEU 343 CO 0.42 1.78 0.00 -0.24 -0.00 0.00 0.00 177.39 179.36 2xao n SER 344 N 2.32 0.00 0.05 1.96 2.88 -1.26 -4.71 113.62 114.86 2xao n SER 344 Ca 0.51 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.94 2xao n SER 344 Cb 0.71 0.14 -0.13 0.00 -0.75 0.00 0.00 64.21 64.18 2xao n SER 344 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 2xao h LEU 345 N 0.00 0.14 0.00 2.46 3.38 -1.99 -3.23 115.31 116.07 2xao h LEU 345 Ca 0.00 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.79 2xao h LEU 345 Cb 0.00 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.70 2xao h LEU 345 CO 0.00 1.14 0.00 1.41 0.09 0.00 0.00 178.44 181.08 2xao n HIS 346 N -3.35 0.00 0.77 1.13 8.25 -1.25 -2.72 115.22 118.05 2xao n HIS 346 Ca -0.07 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.50 2xao n HIS 346 Cb 0.99 -0.40 0.02 0.00 1.12 0.00 0.00 29.99 31.71 2xao n HIS 346 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2xao n ALA 347 N -1.40 3.84 -1.75 -1.41 0.00 -1.22 -4.95 120.51 113.61 2xao n ALA 347 Ca 0.08 -0.46 -0.38 0.00 0.00 0.00 0.00 53.44 52.67 2xao n ALA 347 Cb 0.22 -0.93 0.04 0.00 0.00 0.00 0.00 19.45 18.78 2xao n ALA 347 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2xao s LEU 348 N -3.46 3.85 0.57 0.00 1.02 -1.10 -4.99 118.68 114.57 2xao s LEU 348 Ca 0.06 2.77 -0.20 0.00 0.02 0.00 0.00 54.13 56.78 2xao s LEU 348 Cb 0.16 -4.27 -0.05 0.00 0.02 0.00 0.00 46.19 42.04 2xao s LEU 348 CO 0.81 -1.58 1.06 -0.81 0.02 0.00 0.00 176.35 175.85 2xao n PRO 349 N -1.03 1.11 -0.22 1.29 -0.04 -1.26 -4.82 135.00 130.03 2xao n PRO 349 Ca 0.10 0.42 -0.01 0.00 -0.04 0.00 0.00 63.50 63.98 2xao n PRO 349 Cb 0.45 -2.24 0.21 0.00 -0.04 0.00 0.00 33.50 31.88 2xao n PRO 349 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 2xao h LEU 350 N 0.80 0.90 -0.77 1.53 7.12 -1.98 -1.43 115.31 121.48 2xao h LEU 350 Ca -0.48 -0.05 0.12 0.00 0.13 0.00 0.00 57.88 57.59 2xao h LEU 350 Cb 1.35 -0.23 -0.13 0.00 -0.53 0.00 0.00 40.66 41.12 2xao h LEU 350 CO 0.53 0.69 -0.39 0.44 -0.13 0.00 0.00 178.44 179.58 2xao h ASP 351 N 1.03 -1.39 -0.51 1.25 5.19 -2.00 -1.68 116.42 118.31 2xao h ASP 351 Ca 0.27 0.27 -0.11 0.00 -0.62 0.00 0.00 57.03 56.84 2xao h ASP 351 Cb -0.04 0.69 -0.02 0.00 0.18 0.00 0.00 39.33 40.15 2xao h ASP 351 CO -0.05 -0.30 -0.10 -0.08 -3.12 0.00 0.00 179.24 175.59 2xao h GLU 352 N -0.10 0.97 -0.84 3.56 4.57 -1.66 -2.45 114.58 118.64 2xao h GLU 352 Ca 0.26 -0.36 0.07 0.00 -1.18 0.00 0.00 59.36 58.15 2xao h GLU 352 Cb 0.56 -0.06 -0.05 0.00 -0.16 0.00 0.00 28.75 29.04 2xao h GLU 352 CO -0.82 1.03 0.55 0.77 -1.18 0.00 0.00 179.01 179.36 2xao h SER 353 N 0.83 0.81 0.02 1.04 0.02 -0.84 -1.92 113.55 113.51 2xao h SER 353 Ca 0.13 0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 61.09 2xao h SER 353 Cb 0.66 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 63.04 2xao h SER 353 CO 0.05 0.52 -0.01 -0.07 -1.14 0.00 0.00 176.83 176.17 2xao h LEU 354 N 0.92 -0.03 -0.76 5.07 3.38 -1.01 -2.49 115.31 120.38 2xao h LEU 354 Ca 0.36 -0.53 0.14 0.00 0.09 0.00 0.00 57.88 57.94 2xao h LEU 354 Cb 0.23 0.01 -0.14 0.00 0.09 0.00 0.00 40.66 40.85 2xao h LEU 354 CO -0.13 0.53 -0.27 0.50 0.09 0.00 0.00 178.44 179.16 2xao h LYS 355 N -0.59 -0.05 -0.05 1.13 3.64 -1.30 0.44 116.57 119.80 2xao h LYS 355 Ca -0.00 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2xao h LYS 355 Cb 0.55 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.38 2xao h LYS 355 CO 0.01 -0.03 0.03 0.82 -2.27 0.00 0.00 179.45 178.00 2xao h ILE 356 N -0.05 1.04 -0.40 2.00 2.04 -1.32 0.14 117.51 120.96 2xao h ILE 356 Ca 0.33 -0.12 -0.09 0.00 1.00 0.00 0.00 64.86 65.99 2xao h ILE 356 Cb 0.58 1.04 -0.01 0.00 -0.74 0.00 0.00 36.82 37.69 2xao h ILE 356 CO -0.80 0.04 -0.09 0.58 0.00 0.00 0.00 178.15 177.87 2xao h VAL 357 N 0.02 1.27 -0.20 1.67 2.07 -0.94 0.32 116.25 120.47 2xao h VAL 357 Ca 0.02 -1.18 0.06 0.00 0.82 0.00 0.00 66.70 66.41 2xao h VAL 357 Cb 0.04 1.21 -0.06 0.00 -1.52 0.00 0.00 31.29 30.95 2xao h VAL 357 CO -0.00 0.40 -0.22 0.50 0.02 0.00 0.00 177.57 178.26 2xao h LYS 358 N 0.59 -0.24 -0.33 1.57 3.64 0.09 -0.83 116.57 121.05 2xao h LYS 358 Ca 0.10 0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.48 2xao h LYS 358 Cb 0.62 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.47 2xao h LYS 358 CO 0.04 -0.16 0.14 0.93 -2.27 0.00 0.00 179.45 178.13 2xao h GLU 359 N -0.25 0.46 -0.54 1.90 5.08 -0.46 -1.66 114.58 119.11 2xao h GLU 359 Ca 0.12 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.41 2xao h GLU 359 Cb 0.44 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.57 2xao h GLU 359 CO -0.34 0.38 0.26 -0.92 -1.00 0.00 0.00 179.01 177.39 2xao h TYR 360 N 0.46 0.78 -0.15 4.33 3.20 0.40 -1.07 116.97 124.92 2xao h TYR 360 Ca 0.12 -0.04 -0.11 0.00 3.14 0.00 0.00 58.73 61.84 2xao h TYR 360 Cb 0.09 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.10 2xao h TYR 360 CO 0.00 0.60 -0.40 -0.07 -1.64 0.00 0.00 178.16 176.65 2xao h LEU 361 N 0.73 0.34 -0.39 2.82 3.38 -0.43 -1.43 115.31 120.32 2xao h LEU 361 Ca 0.19 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 2xao h LEU 361 Cb 0.11 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 2xao h LEU 361 CO -0.02 0.72 0.13 0.40 0.09 0.00 0.00 178.44 179.76 2xao h ILE 362 N 0.28 1.21 -0.77 1.22 2.04 -1.07 -2.48 117.51 117.94 2xao h ILE 362 Ca 0.03 -0.68 0.02 0.00 1.00 0.00 0.00 64.86 65.22 2xao h ILE 362 Cb 0.83 0.91 -0.04 0.00 -0.74 0.00 0.00 36.82 37.79 2xao h ILE 362 CO 0.07 0.24 0.50 0.00 0.00 0.00 0.00 178.15 178.96 2xao h ALA 363 N 0.98 0.98 -0.94 1.87 0.00 -0.77 0.97 119.26 122.35 2xao h ALA 363 Ca 0.13 -0.05 0.11 0.00 0.00 0.00 0.00 54.91 55.10 2xao h ALA 363 Cb 0.24 -0.29 -0.07 0.00 0.00 0.00 0.00 17.79 17.67 2xao h ALA 363 CO -0.01 0.36 0.60 0.00 0.00 0.00 0.00 179.25 180.20 2xao h ALA 364 N 1.29 1.61 0.19 0.00 0.00 -1.16 0.11 119.26 121.31 2xao h ALA 364 Ca 0.29 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.20 2xao h ALA 364 Cb -0.08 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 2xao h ALA 364 CO -0.08 0.19 -0.14 1.15 0.00 0.00 0.00 179.25 180.37 2xao h THR 365 N 0.92 0.69 -0.01 0.00 2.02 -0.35 -2.83 112.91 113.35 2xao h THR 365 Ca 0.44 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.59 2xao h THR 365 Cb 0.45 0.69 -0.01 0.00 -1.74 0.00 0.00 68.15 67.54 2xao h THR 365 CO -0.21 0.00 -0.15 0.00 0.37 0.00 0.00 175.52 175.53 2xao h ALA 366 N 0.44 1.73 0.00 6.16 0.00 -0.67 -2.31 119.26 124.60 2xao h ALA 366 Ca -0.01 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 2xao h ALA 366 Cb 0.30 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 2xao h ALA 366 CO -0.00 0.20 -0.29 0.87 0.00 0.00 0.00 179.25 180.03 2xao h LYS 367 N 0.01 0.00 -0.04 0.00 1.57 -0.67 -3.30 116.57 114.14 2xao h LYS 367 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2xao h LYS 367 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.59 2xao h LYS 367 CO 0.02 0.29 0.00 -3.47 -0.57 0.00 0.00 179.45 175.72 2xao n ASP 368 N -3.50 2.48 -4.80 0.86 2.03 -0.91 -3.65 116.55 109.06 2xao n ASP 368 Ca -0.00 -2.83 -0.22 0.00 0.52 0.00 0.00 54.79 52.26 2xao n ASP 368 Cb 0.45 -0.35 0.09 0.00 -0.72 0.00 0.00 41.12 40.59 2xao n ASP 368 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2xao s SER 370 N -4.73 1.99 -0.09 0.00 0.01 -0.96 -4.24 113.70 105.68 2xao s SER 370 Ca 0.65 -1.28 0.04 0.00 1.31 0.00 0.00 55.95 56.68 2xao s SER 370 Cb -0.05 -0.02 0.00 0.00 0.21 0.00 0.00 66.02 66.16 2xao s SER 370 CO 0.43 -0.54 -0.22 -0.63 0.41 0.00 0.00 173.24 172.68 2xao s ILE 371 N -3.38 1.89 -0.20 1.44 1.01 0.34 -1.86 121.20 120.44 2xao s ILE 371 Ca 0.32 -0.93 -0.03 0.00 0.00 0.00 0.00 60.65 60.00 2xao s ILE 371 Cb 0.07 -1.64 -0.01 0.00 0.01 0.00 0.00 42.46 40.89 2xao s ILE 371 CO 0.11 0.52 -0.06 -0.04 0.00 0.00 0.00 174.94 175.48 2xao s MET 372 N 0.29 3.41 -0.22 2.79 -1.94 -0.48 -0.59 119.30 122.57 2xao s MET 372 Ca -0.15 -0.63 -0.04 0.00 -1.71 0.00 0.00 55.69 53.17 2xao s MET 372 Cb -0.17 -2.93 -0.01 0.00 2.01 0.00 0.00 34.83 33.73 2xao s MET 372 CO 0.07 -0.08 -0.05 0.42 -0.01 0.00 0.00 175.02 175.37 2xao s ILE 373 N 1.16 3.34 -0.15 2.53 1.01 -0.45 -1.19 121.20 127.45 2xao s ILE 373 Ca 0.02 -0.50 -0.08 0.00 0.00 0.00 0.00 60.65 60.09 2xao s ILE 373 Cb -0.14 -2.52 -0.04 0.00 0.01 0.00 0.00 42.46 39.77 2xao s ILE 373 CO -0.01 0.43 0.12 -0.44 0.00 0.00 0.00 174.94 175.04 2xao s SER 374 N 1.45 6.23 -0.03 3.58 0.01 -0.16 -1.28 113.70 123.49 2xao s SER 374 Ca 0.05 0.35 0.07 0.00 1.31 0.00 0.00 55.95 57.74 2xao s SER 374 Cb -0.14 -2.04 -0.02 0.00 0.21 0.00 0.00 66.02 64.03 2xao s SER 374 CO -0.03 0.32 -0.25 -0.36 0.41 0.00 0.00 173.24 173.32 2xao s PHE 375 N -0.47 2.31 -0.04 2.43 0.40 0.10 -2.32 117.98 120.39 2xao s PHE 375 Ca 0.12 -0.52 -0.10 0.00 -0.60 0.00 0.00 56.93 55.83 2xao s PHE 375 Cb -0.12 -1.50 0.02 0.00 0.51 0.00 0.00 43.02 41.93 2xao s PHE 375 CO 0.02 -0.10 0.23 1.14 0.70 0.00 0.00 175.22 177.21 2xao s GLN 376 N -0.45 0.46 0.45 0.44 -2.07 -0.66 -2.80 119.66 115.03 2xao s GLN 376 Ca 0.05 -0.04 -0.24 0.00 -1.82 0.00 0.00 55.36 53.32 2xao s GLN 376 Cb -0.11 0.20 -0.09 0.00 -1.09 0.00 0.00 33.01 31.92 2xao s GLN 376 CO 0.00 -0.10 1.12 0.45 -1.32 0.00 0.00 175.29 175.44 2xao n SER 377 N 2.01 1.75 -4.95 12.60 2.88 -1.26 -0.43 113.62 126.23 2xao n SER 377 Ca -0.18 1.03 -0.24 0.00 -1.33 0.00 0.00 58.87 58.15 2xao n SER 377 Cb 0.57 -1.43 0.04 0.00 -0.75 0.00 0.00 64.21 62.65 2xao n SER 377 CO 0.00 0.00 0.00 -0.60 -1.23 0.00 0.00 175.04 173.21 2xao s ARG 378 N -2.24 2.54 0.00 -1.46 6.06 0.11 -4.67 118.95 119.29 2xao s ARG 378 Ca 0.65 -0.46 0.00 0.00 -2.50 0.00 0.00 55.73 53.42 2xao s ARG 378 Cb -0.51 -2.36 0.00 0.00 0.06 0.00 0.00 34.95 32.14 2xao s ARG 378 CO 0.55 -0.84 0.00 0.45 -2.50 0.00 0.00 175.30 172.96 2xao n SER 386 N -2.54 -0.28 -1.01 -2.12 2.88 -1.26 -4.85 113.62 104.43 2xao n SER 386 Ca 0.07 0.00 0.10 0.00 -1.33 0.00 0.00 58.87 57.71 2xao n SER 386 Cb 0.59 0.54 0.19 0.00 -0.75 0.00 0.00 64.21 64.79 2xao n SER 386 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2xao n GLY 387 N 0.24 1.66 3.18 0.46 0.00 -1.26 -4.92 105.19 104.55 2xao n GLY 387 Ca 0.00 -0.65 -0.40 0.00 0.00 0.00 0.00 46.02 44.97 2xao n GLY 387 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2xao s ASP 388 N -1.34 5.71 0.13 1.61 1.01 -1.26 -5.02 116.67 117.51 2xao s ASP 388 Ca 0.34 -2.47 -0.20 0.00 0.71 0.00 0.00 52.55 50.93 2xao s ASP 388 Cb 0.20 -1.98 0.05 0.00 1.01 0.00 0.00 42.92 42.20 2xao s ASP 388 CO 0.28 -0.53 0.50 -0.72 0.21 0.00 0.00 175.17 174.91 2xao s TYR 389 N 0.52 -0.38 -0.01 4.23 -0.85 -1.26 -2.52 117.35 117.08 2xao s TYR 389 Ca 0.13 0.15 0.04 0.00 -0.52 0.00 0.00 57.07 56.87 2xao s TYR 389 Cb -0.20 0.41 -0.01 0.00 0.38 0.00 0.00 41.96 42.53 2xao s TYR 389 CO -0.04 -0.76 -0.14 0.08 -1.52 0.00 0.00 175.55 173.17 2xao s VAL 390 N -3.64 1.09 -0.18 -3.49 1.01 0.12 -4.96 120.40 110.34 2xao s VAL 390 Ca 0.01 -0.60 -0.09 0.00 0.00 0.00 0.00 61.98 61.30 2xao s VAL 390 Cb 0.00 -0.91 -0.05 0.00 0.00 0.00 0.00 36.38 35.43 2xao s VAL 390 CO -0.11 0.30 0.12 -0.44 0.00 0.00 0.00 175.10 174.96 2xao s SER 391 N -0.35 6.12 -0.80 3.32 0.01 -1.26 -0.81 113.70 119.93 2xao s SER 391 Ca 0.05 0.25 -0.19 0.00 1.31 0.00 0.00 55.95 57.37 2xao s SER 391 Cb -0.05 -2.05 0.12 0.00 0.21 0.00 0.00 66.02 64.25 2xao s SER 391 CO -0.00 0.23 0.99 -0.76 0.41 0.00 0.00 173.24 174.10 2xao s LEU 392 N 0.06 5.09 0.23 2.44 1.43 -0.53 -4.94 118.68 122.46 2xao s LEU 392 Ca 0.09 -1.75 -0.18 0.00 -1.03 0.00 0.00 54.13 51.27 2xao s LEU 392 Cb -0.11 -2.37 0.24 0.00 0.03 0.00 0.00 46.19 43.97 2xao s LEU 392 CO -0.00 -1.12 1.55 0.11 0.23 0.00 0.00 176.35 177.12 2xao h LYS 393 N 8.98 -0.01 -0.74 1.70 1.79 -1.96 0.52 116.57 126.85 2xao h LYS 393 Ca -0.03 0.00 -0.06 0.00 -2.18 0.00 0.00 60.65 58.38 2xao h LYS 393 Cb 1.05 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.67 2xao h LYS 393 CO 1.10 -0.01 0.23 -1.00 -1.08 0.00 0.00 179.45 178.69 2xao h PRO 394 N -0.01 1.15 0.00 3.15 0.13 -1.99 -3.33 132.00 131.11 2xao h PRO 394 Ca 0.34 -0.25 -0.19 0.00 -0.87 0.00 0.00 66.00 65.04 2xao h PRO 394 Cb 0.60 -0.17 -0.04 0.00 0.13 0.00 0.00 31.00 31.52 2xao h PRO 394 CO -0.98 0.98 -2.02 0.25 -0.23 0.00 0.00 178.00 176.00 2xao n THR 395 N -4.25 0.85 -0.93 1.56 -2.24 -0.60 -5.01 114.28 103.66 2xao n THR 395 Ca 0.06 -0.69 0.00 0.00 -2.27 0.00 0.00 64.05 61.15 2xao n THR 395 Cb 0.23 -0.36 0.00 0.00 -2.10 0.00 0.00 70.33 68.10 2xao n THR 395 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2xao n ASN 396 N -2.61 -2.70 -4.82 3.42 4.13 0.17 -5.05 115.26 107.80 2xao n ASN 396 Ca -0.17 0.00 -0.33 0.00 1.68 0.00 0.00 54.58 55.76 2xao n ASN 396 Cb 0.87 -0.45 -0.04 0.00 -1.54 0.00 0.00 39.78 38.63 2xao n ASN 396 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 2xao s GLN 397 N -0.07 3.91 -0.15 3.52 -0.21 -1.25 -4.86 119.66 120.54 2xao s GLN 397 Ca 0.00 1.13 0.01 0.00 0.02 0.00 0.00 55.36 56.52 2xao s GLN 397 Cb 0.00 -2.13 0.00 0.00 1.00 0.00 0.00 33.01 31.89 2xao s GLN 397 CO 0.00 -0.31 -0.19 0.99 -2.12 0.00 0.00 175.29 173.66 2xao s THR 398 N -2.32 2.34 -0.12 -0.19 2.01 -1.26 -1.46 115.64 114.64 2xao s THR 398 Ca 0.62 -0.88 -0.01 0.00 0.31 0.00 0.00 61.69 61.73 2xao s THR 398 Cb -0.12 -1.96 -0.03 0.00 0.01 0.00 0.00 72.50 70.40 2xao s THR 398 CO 0.24 0.53 -0.07 -0.36 -0.69 0.00 0.00 174.62 174.27 2xao s PHE 399 N 0.83 2.94 0.29 4.92 0.40 0.01 0.05 117.98 127.42 2xao s PHE 399 Ca -0.06 -0.27 -0.18 0.00 -0.60 0.00 0.00 56.93 55.82 2xao s PHE 399 Cb -0.15 -1.85 -0.09 0.00 0.51 0.00 0.00 43.02 41.44 2xao s PHE 399 CO -0.01 0.05 0.76 -0.51 0.70 0.00 0.00 175.22 176.21 2xao s ASP 400 N -0.03 6.96 0.01 1.36 1.01 0.43 0.12 116.67 126.54 2xao s ASP 400 Ca -0.00 1.42 -0.03 0.00 0.71 0.00 0.00 52.55 54.64 2xao s ASP 400 Cb -0.13 -2.42 -0.01 0.00 1.01 0.00 0.00 42.92 41.36 2xao s ASP 400 CO 0.03 -0.10 0.04 -0.72 0.21 0.00 0.00 175.17 174.63 2xao s TYR 401 N -1.76 0.16 0.09 4.23 -0.85 -1.05 -1.65 117.35 116.52 2xao s TYR 401 Ca 0.49 -0.34 0.08 0.00 -0.52 0.00 0.00 57.07 56.78 2xao s TYR 401 Cb -0.14 -0.12 -0.03 0.00 0.38 0.00 0.00 41.96 42.05 2xao s TYR 401 CO 0.19 -0.23 -0.20 0.15 -1.52 0.00 0.00 175.55 173.95 2xao s LYS 402 N -1.39 1.09 -0.08 -3.49 1.02 -0.98 -4.78 119.74 111.13 2xao s LYS 402 Ca -0.15 -1.09 0.03 0.00 0.02 0.00 0.00 55.97 54.78 2xao s LYS 402 Cb -0.09 -1.30 0.01 0.00 -0.52 0.00 0.00 37.83 35.93 2xao s LYS 402 CO 0.00 0.30 -0.18 0.08 -0.92 0.00 0.00 175.35 174.64 2xao s VAL 403 N -1.13 1.55 -0.03 3.17 1.01 -1.26 -0.99 120.40 122.72 2xao s VAL 403 Ca 0.05 -0.72 0.03 0.00 0.00 0.00 0.00 61.98 61.33 2xao s VAL 403 Cb -0.10 -1.37 0.00 0.00 0.00 0.00 0.00 36.38 34.91 2xao s VAL 403 CO 0.04 0.45 -0.10 -1.00 0.00 0.00 0.00 175.10 174.49 2xao s HIS 404 N 0.51 1.00 -0.15 5.22 3.76 -0.34 -4.45 115.29 120.85 2xao s HIS 404 Ca -0.16 -0.25 -0.26 0.00 -0.15 0.00 0.00 55.06 54.24 2xao s HIS 404 Cb -0.17 -0.70 -0.02 0.00 1.11 0.00 0.00 32.58 32.80 2xao s HIS 404 CO 0.06 -0.10 0.84 -0.06 -0.85 0.00 0.00 174.74 174.64 2xao s PHE 405 N 0.13 3.45 0.48 1.40 0.40 0.19 -1.38 117.98 122.66 2xao s PHE 405 Ca -0.02 1.30 0.01 0.00 -0.60 0.00 0.00 56.93 57.62 2xao s PHE 405 Cb -0.08 -3.02 -0.00 0.00 0.51 0.00 0.00 43.02 40.43 2xao s PHE 405 CO 0.00 -0.20 0.04 0.44 0.70 0.00 0.00 175.22 176.20 2xao n ILE 406 N 4.61 0.00 -3.82 0.64 -5.35 -0.78 -4.47 119.36 110.19 2xao n ILE 406 Ca 0.04 -2.39 -0.25 0.00 -0.27 0.00 0.00 62.75 59.89 2xao n ILE 406 Cb 0.49 0.59 0.01 0.00 -1.74 0.00 0.00 39.64 38.99 2xao n ILE 406 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 2xao n ASP 407 N -1.37 -1.34 -4.30 7.28 8.00 -1.26 -2.27 116.55 121.29 2xao n ASP 407 Ca -0.17 -0.94 -0.46 0.00 0.71 0.00 0.00 54.79 53.93 2xao n ASP 407 Cb 0.63 -3.45 -0.05 0.00 -0.02 0.00 0.00 41.12 38.23 2xao n ASP 407 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2xao s LEU 408 N -6.78 6.27 -0.03 0.64 1.43 -1.26 -4.14 118.68 114.81 2xao s LEU 408 Ca 0.07 -2.00 -0.03 0.00 -1.03 0.00 0.00 54.13 51.15 2xao s LEU 408 Cb -0.02 -2.19 -0.04 0.00 0.03 0.00 0.00 46.19 43.96 2xao s LEU 408 CO 0.86 -0.78 0.13 -0.44 0.23 0.00 0.00 176.35 176.34 2xao s SER 409 N 3.20 6.07 0.36 2.29 0.01 -1.26 -4.88 113.70 119.48 2xao s SER 409 Ca 0.06 0.28 -0.28 0.00 1.31 0.00 0.00 55.95 57.33 2xao s SER 409 Cb -0.25 -1.85 -0.10 0.00 0.21 0.00 0.00 66.02 64.03 2xao s SER 409 CO 0.00 0.30 1.31 -0.22 0.41 0.00 0.00 173.24 175.03 2xao s LEU 410 N -1.66 4.35 -0.20 2.44 2.96 -1.26 -4.50 118.68 120.81 2xao s LEU 410 Ca 0.23 2.68 -0.06 0.00 -0.22 0.00 0.00 54.13 56.75 2xao s LEU 410 Cb -0.12 -3.74 -0.03 0.00 0.50 0.00 0.00 46.19 42.80 2xao s LEU 410 CO 0.14 -0.64 0.04 -0.54 -1.32 0.00 0.00 176.35 174.03 2xao s LYS 411 N -1.95 3.77 0.42 1.98 -0.14 -1.26 -5.07 119.74 117.49 2xao s LYS 411 Ca 0.52 -0.44 -0.26 0.00 -1.36 0.00 0.00 55.97 54.42 2xao s LYS 411 Cb -0.39 -3.19 -0.09 0.00 -1.68 0.00 0.00 37.83 32.48 2xao s LYS 411 CO 0.52 0.08 1.44 -1.25 -0.76 0.00 0.00 175.35 175.37 2xao s PRO 412 N 0.88 3.85 0.31 -1.68 0.04 -1.26 -4.88 135.00 132.25 2xao s PRO 412 Ca 0.03 2.45 0.00 0.00 0.04 0.00 0.00 61.00 63.52 2xao s PRO 412 Cb -0.14 -2.77 0.53 0.00 0.04 0.00 0.00 34.50 32.16 2xao s PRO 412 CO 0.02 -0.70 1.94 1.25 0.04 0.00 0.00 177.00 179.55 2xao h LEU 413 N 2.58 0.89 -1.98 -3.56 5.85 -1.99 -2.49 115.31 114.61 2xao h LEU 413 Ca -0.51 -0.01 0.18 0.00 0.84 0.00 0.00 57.88 58.39 2xao h LEU 413 Cb 1.26 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 42.06 2xao h LEU 413 CO 0.62 0.60 0.51 0.50 -0.34 0.00 0.00 178.44 180.33 2xao h LYS 414 N 1.03 0.00 0.00 1.25 1.63 -2.01 -1.49 116.57 116.98 2xao h LYS 414 Ca 0.35 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.15 2xao h LYS 414 Cb 0.08 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.71 2xao h LYS 414 CO -0.11 0.00 0.00 -0.09 -3.45 0.00 0.00 179.45 175.80 2xao h ARG 415 N 0.00 0.00 -0.99 1.90 2.43 -1.81 -3.00 114.38 112.91 2xao h ARG 415 Ca 0.29 0.00 0.19 0.00 -0.81 0.00 0.00 59.98 59.65 2xao h ARG 415 Cb 1.31 0.00 -0.11 0.00 -0.42 0.00 0.00 29.97 30.75 2xao h ARG 415 CO -0.00 0.00 0.59 0.52 -1.51 0.00 0.00 179.97 179.56 2xao h MET 416 N 0.00 0.71 -0.40 0.20 2.86 -1.47 0.65 114.93 117.48 2xao h MET 416 Ca 0.00 -0.04 -0.08 0.00 -2.06 0.00 0.00 59.70 57.51 2xao h MET 416 Cb 0.24 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 31.72 2xao h MET 416 CO 0.00 0.47 -0.07 0.93 1.06 0.00 0.00 176.91 179.30 2xao h GLU 417 N 0.73 0.76 -0.00 1.72 5.08 -1.77 -2.84 114.58 118.25 2xao h GLU 417 Ca 0.57 -0.28 -0.13 0.00 -1.00 0.00 0.00 59.36 58.52 2xao h GLU 417 Cb 0.90 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.08 2xao h GLU 417 CO -0.39 0.88 -0.63 0.66 -1.00 0.00 0.00 179.01 178.53 2xao h SER 418 N 0.57 0.01 -0.00 1.42 4.64 -1.14 -2.50 113.55 116.56 2xao h SER 418 Ca 0.10 -0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.42 2xao h SER 418 Cb 0.59 -0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.67 2xao h SER 418 CO 0.03 0.64 0.00 1.88 -0.87 0.00 0.00 176.83 178.51 2xao h TYR 419 N 0.01 0.01 -0.37 4.77 0.99 0.26 -1.63 116.97 121.00 2xao h TYR 419 Ca -0.01 -0.00 0.05 0.00 2.00 0.00 0.00 58.73 60.78 2xao h TYR 419 Cb 1.11 -0.00 -0.05 0.00 1.00 0.00 0.00 36.73 38.79 2xao h TYR 419 CO 0.00 0.13 0.08 -0.92 -0.00 0.00 0.00 178.16 177.45 2xao h TYR 420 N -0.12 0.13 -0.53 4.88 3.20 -1.46 0.47 116.97 123.53 2xao h TYR 420 Ca 0.00 0.02 0.04 0.00 3.14 0.00 0.00 58.73 61.93 2xao h TYR 420 Cb 0.13 -0.00 -0.04 0.00 1.54 0.00 0.00 36.73 38.35 2xao h TYR 420 CO -0.03 0.02 0.29 0.87 -1.64 0.00 0.00 178.16 177.66 2xao h LYS 421 N 0.20 0.54 -0.23 1.82 1.57 -1.32 -1.37 116.57 117.79 2xao h LYS 421 Ca 0.18 -0.03 -0.11 0.00 -1.87 0.00 0.00 60.65 58.81 2xao h LYS 421 Cb 0.20 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 32.39 2xao h LYS 421 CO -0.23 0.36 -0.29 1.25 -0.57 0.00 0.00 179.45 179.97 2xao h LEU 422 N 0.56 0.65 -0.51 2.94 5.85 -1.00 -1.48 115.31 122.31 2xao h LEU 422 Ca 0.23 -0.50 0.07 0.00 0.84 0.00 0.00 57.88 58.52 2xao h LEU 422 Cb 0.11 -0.18 -0.06 0.00 0.37 0.00 0.00 40.66 40.90 2xao h LEU 422 CO -0.14 1.02 0.20 -0.78 -0.34 0.00 0.00 178.44 178.39 2xao h ASP 423 N 0.29 0.22 -0.89 1.25 3.58 -0.84 0.16 116.42 120.20 2xao h ASP 423 Ca 0.03 0.06 0.01 0.00 0.42 0.00 0.00 57.03 57.55 2xao h ASP 423 Cb 0.86 0.03 -0.05 0.00 1.72 0.00 0.00 39.33 41.89 2xao h ASP 423 CO 0.07 0.16 0.59 0.50 -2.88 0.00 0.00 179.24 177.67 2xao h LYS 424 N 0.39 1.15 -0.26 0.28 3.64 -1.02 -1.20 116.57 119.56 2xao h LYS 424 Ca 0.24 -0.07 -0.14 0.00 -1.27 0.00 0.00 60.65 59.41 2xao h LYS 424 Cb 0.24 -0.26 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 2xao h LYS 424 CO -0.23 0.76 -0.43 -0.22 -2.27 0.00 0.00 179.45 177.06 2xao h LYS 425 N 1.19 0.63 0.78 1.90 3.64 -0.48 -1.14 116.57 123.10 2xao h LYS 425 Ca 0.33 -0.34 -0.04 0.00 -1.27 0.00 0.00 60.65 59.34 2xao h LYS 425 Cb -0.11 0.01 0.01 0.00 -0.41 0.00 0.00 32.23 31.74 2xao h LYS 425 CO -0.08 0.94 -0.38 0.82 -2.27 0.00 0.00 179.45 178.48 2xao h ILE 426 N 0.51 0.23 -0.37 2.00 1.08 -0.32 -2.61 117.51 118.04 2xao h ILE 426 Ca 0.04 -0.00 -0.10 0.00 -0.39 0.00 0.00 64.86 64.40 2xao h ILE 426 Cb 0.95 0.23 -0.02 0.00 -3.07 0.00 0.00 36.82 34.92 2xao h ILE 426 CO 0.09 0.00 -0.20 -0.29 -0.69 0.00 0.00 178.15 177.06 2xao h ILE 427 N -1.06 1.27 -0.44 -0.67 6.09 -1.23 -2.00 117.51 119.47 2xao h ILE 427 Ca -0.11 -1.28 -0.10 0.00 -1.37 0.00 0.00 64.86 62.00 2xao h ILE 427 Cb 0.81 1.20 -0.02 0.00 0.47 0.00 0.00 36.82 39.28 2xao h ILE 427 CO 0.18 0.42 -0.14 0.77 -3.07 0.00 0.00 178.15 176.31 2xao h SER 428 N 0.62 0.82 0.14 2.19 4.64 -1.25 -1.28 113.55 119.43 2xao h SER 428 Ca 0.09 -0.26 -0.13 0.00 -0.47 0.00 0.00 61.79 61.01 2xao h SER 428 Cb 0.68 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 62.54 2xao h SER 428 CO 0.05 0.97 -0.48 0.15 -0.87 0.00 0.00 176.83 176.65 2xao h PHE 429 N 0.73 0.49 -0.14 4.77 3.57 -1.31 -1.92 116.94 123.13 2xao h PHE 429 Ca 0.12 -0.15 -0.10 0.00 3.53 0.00 0.00 57.97 61.36 2xao h PHE 429 Cb 0.65 -0.10 0.00 0.00 2.79 0.00 0.00 35.95 39.29 2xao h PHE 429 CO 0.04 0.81 -0.31 -0.92 -2.23 0.00 0.00 178.31 175.69 2xao h TYR 430 N 0.32 0.58 -0.69 0.41 3.20 -1.19 -1.73 116.97 117.88 2xao h TYR 430 Ca 0.02 -0.22 0.02 0.00 3.14 0.00 0.00 58.73 61.70 2xao h TYR 430 Cb 0.96 -0.11 -0.04 0.00 1.54 0.00 0.00 36.73 39.09 2xao h TYR 430 CO 0.03 0.93 0.45 -0.91 -1.64 0.00 0.00 178.16 177.03 2xao h ASN 431 N 0.06 0.74 0.19 -2.11 2.35 -1.23 -1.27 115.58 114.31 2xao h ASN 431 Ca 0.00 -0.01 -0.12 0.00 -0.55 0.00 0.00 56.30 55.62 2xao h ASN 431 Cb 0.91 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 39.09 2xao h ASN 431 CO 0.07 0.52 -0.43 -0.09 -1.65 0.00 0.00 177.43 175.84 2xao h ARG 432 N 0.86 0.31 -0.11 0.81 2.43 -1.24 0.14 114.38 117.57 2xao h ARG 432 Ca 0.27 -0.15 -0.15 0.00 -0.81 0.00 0.00 59.98 59.13 2xao h ARG 432 Cb 0.01 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.55 2xao h ARG 432 CO -0.07 0.69 -0.58 0.87 -1.51 0.00 0.00 179.97 179.36 2xao h LYS 433 N 0.25 0.35 0.00 0.20 1.79 -0.34 -2.94 116.57 115.89 2xao h LYS 433 Ca 0.02 -0.23 -0.06 0.00 -2.18 0.00 0.00 60.65 58.20 2xao h LYS 433 Cb 0.87 0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 31.54 2xao h LYS 433 CO 0.07 0.84 -0.70 1.96 -1.08 0.00 0.00 179.45 180.54 2xao h GLN 434 N 0.27 0.00 -0.76 3.15 1.08 -1.08 -3.18 115.11 114.58 2xao h GLN 434 Ca -0.00 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.17 2xao h GLN 434 Cb 1.10 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 28.49 2xao h GLN 434 CO 0.10 0.17 0.38 -0.22 -0.95 0.00 0.00 178.83 178.31 2xao h LYS 435 N 0.00 1.08 -5.82 1.46 3.11 -0.68 -3.15 116.57 112.56 2xao h LYS 435 Ca -0.03 -0.14 -0.58 0.00 -2.81 0.00 0.00 60.65 57.08 2xao h LYS 435 Cb 1.21 -0.20 -0.07 0.00 -1.00 0.00 0.00 32.23 32.16 2xao h LYS 435 CO 0.02 0.82 1.79 0.00 -2.81 0.00 0.00 179.45 179.28 2xao s ALA 436 N -5.64 2.84 -1.89 5.00 0.00 -1.12 -5.09 121.76 115.87 2xao s ALA 436 Ca -0.11 -2.58 0.00 0.00 0.00 0.00 0.00 51.96 49.26 2xao s ALA 436 Cb 0.17 -4.63 0.00 0.00 0.00 0.00 0.00 23.12 18.66 2xao s ALA 436 CO 0.81 -3.80 0.47 0.39 0.00 0.00 0.00 175.76 173.63