#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2uwo s VAL 17 N 0.00 5.19 0.00 1.39 1.01 0.11 -4.11 120.40 123.99 2uwo s VAL 17 Ca 0.00 0.71 0.00 0.00 0.00 0.00 0.00 61.98 62.69 2uwo s VAL 17 Cb 0.00 -3.73 0.00 0.00 0.00 0.00 0.00 36.38 32.65 2uwo s VAL 17 CO 0.00 0.24 0.00 0.61 0.00 0.00 0.00 175.10 175.95 2uwo n GLY 18 N 3.98 -0.73 7.00 4.51 0.00 -1.26 -2.09 105.19 116.61 2uwo n GLY 18 Ca -0.08 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 44.76 2uwo n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2uwo n GLY 19 N 0.00 -0.86 3.22 -0.02 0.00 -1.26 -4.90 105.19 101.36 2uwo n GLY 19 Ca 0.00 -1.15 -0.13 0.00 0.00 0.00 0.00 46.02 44.74 2uwo n GLY 19 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2uwo s GLN 20 N 0.00 1.00 0.29 1.61 -1.52 0.10 -4.96 119.66 116.18 2uwo s GLN 20 Ca 0.00 -1.45 -0.29 0.00 -1.95 0.00 0.00 55.36 51.67 2uwo s GLN 20 Cb 0.00 -0.31 -0.10 0.00 -0.22 0.00 0.00 33.01 32.38 2uwo s GLN 20 CO 0.00 -0.05 1.24 -2.00 -0.25 0.00 0.00 175.29 174.22 2uwo s GLU 21 N -3.85 4.46 -0.02 2.91 2.12 -1.26 -0.14 118.70 122.92 2uwo s GLU 21 Ca 0.18 2.05 -0.30 0.00 0.36 0.00 0.00 54.97 57.26 2uwo s GLU 21 Cb 0.05 -3.13 -0.06 0.00 0.26 0.00 0.00 34.13 31.25 2uwo s GLU 21 CO 0.00 -0.06 1.51 0.00 -0.54 0.00 0.00 175.26 176.16 2uwo s LYS 23 N 2.98 1.63 0.06 0.00 -0.14 -1.26 -4.90 119.74 118.11 2uwo s LYS 23 Ca 0.67 -0.48 -0.33 0.00 -1.36 0.00 0.00 55.97 54.47 2uwo s LYS 23 Cb -0.33 -2.11 -0.12 0.00 -1.68 0.00 0.00 37.83 33.59 2uwo s LYS 23 CO 0.27 -1.63 1.76 -3.47 -0.76 0.00 0.00 175.35 171.53 2uwo n ASP 24 N -3.15 3.49 0.00 2.83 2.03 -1.26 -1.30 116.55 119.19 2uwo n ASP 24 Ca 0.12 1.01 0.00 0.00 0.52 0.00 0.00 54.79 56.44 2uwo n ASP 24 Cb 0.60 -1.44 0.00 0.00 -0.72 0.00 0.00 41.12 39.56 2uwo n ASP 24 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2uwo n GLY 25 N 4.01 1.30 0.15 0.27 0.00 -1.26 -4.92 105.19 104.73 2uwo n GLY 25 Ca 0.19 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.25 2uwo n GLY 25 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2uwo h GLU 26 N 2.41 0.00 -1.75 1.61 5.08 -1.55 -3.38 114.58 117.01 2uwo h GLU 26 Ca 0.00 0.00 -0.47 0.00 -1.00 0.00 0.00 59.36 57.89 2uwo h GLU 26 Cb 0.00 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 28.85 2uwo h GLU 26 CO 0.00 0.41 -1.09 0.00 -1.00 0.00 0.00 179.01 177.33 2uwo n PRO 28 N 0.07 0.20 0.00 0.00 -0.04 -1.26 -2.40 135.00 131.57 2uwo n PRO 28 Ca 0.23 0.38 0.15 0.00 -0.04 0.00 0.00 63.50 64.21 2uwo n PRO 28 Cb 0.67 -1.85 0.73 0.00 -0.04 0.00 0.00 33.50 33.01 2uwo n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 2uwo n TRP 29 N -2.21 0.00 -2.40 0.54 2.14 -1.04 -1.44 117.44 113.03 2uwo n TRP 29 Ca 0.03 0.00 -0.41 0.00 2.07 0.00 0.00 57.50 59.19 2uwo n TRP 29 Cb 0.26 -0.00 -0.04 0.00 -0.81 0.00 0.00 31.31 30.72 2uwo n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 2uwo s GLN 30 N -2.01 4.56 0.18 -2.67 2.00 -1.01 -0.73 119.66 119.98 2uwo s GLN 30 Ca 0.43 1.88 0.09 0.00 -2.00 0.00 0.00 55.36 55.75 2uwo s GLN 30 Cb 0.21 -3.19 -0.04 0.00 0.80 0.00 0.00 33.01 30.79 2uwo s GLN 30 CO 0.35 0.07 -0.18 0.00 -0.50 0.00 0.00 175.29 175.03 2uwo s ALA 31 N -0.81 2.06 -0.07 1.58 0.00 -0.39 -4.39 121.76 119.75 2uwo s ALA 31 Ca 0.48 -1.55 0.02 0.00 0.00 0.00 0.00 51.96 50.90 2uwo s ALA 31 Cb -0.33 -0.17 0.02 0.00 0.00 0.00 0.00 23.12 22.63 2uwo s ALA 31 CO 0.41 0.21 -0.11 -1.17 0.00 0.00 0.00 175.76 175.10 2uwo s LEU 32 N -2.84 1.52 -0.11 0.00 2.96 -0.21 -1.38 118.68 118.63 2uwo s LEU 32 Ca 0.18 -0.29 -0.18 0.00 -0.22 0.00 0.00 54.13 53.62 2uwo s LEU 32 Cb -0.05 -0.81 -0.04 0.00 0.50 0.00 0.00 46.19 45.79 2uwo s LEU 32 CO 0.07 -0.01 0.48 -0.76 -1.32 0.00 0.00 176.35 174.82 2uwo s LEU 33 N 0.92 4.29 -0.02 -0.68 1.43 0.34 -0.48 118.68 124.48 2uwo s LEU 33 Ca -0.10 0.85 0.07 0.00 -1.03 0.00 0.00 54.13 53.91 2uwo s LEU 33 Cb -0.15 -2.71 -0.02 0.00 0.03 0.00 0.00 46.19 43.34 2uwo s LEU 33 CO 0.01 0.02 -0.22 0.27 0.23 0.00 0.00 176.35 176.66 2uwo s ILE 34 N 0.52 1.71 0.13 -0.59 -4.36 -0.27 -1.62 121.20 116.72 2uwo s ILE 34 Ca 0.26 -0.93 -0.02 0.00 -0.26 0.00 0.00 60.65 59.70 2uwo s ILE 34 Cb -0.15 -1.42 0.03 0.00 1.25 0.00 0.00 42.46 42.16 2uwo s ILE 34 CO 0.11 0.48 0.18 -0.46 0.24 0.00 0.00 174.94 175.49 2uwo n ASN 35 N 2.54 0.02 -0.05 4.36 0.23 0.28 -1.75 115.26 120.89 2uwo n ASN 35 Ca -0.15 -1.07 0.10 0.00 -0.53 0.00 0.00 54.58 52.93 2uwo n ASN 35 Cb 0.52 -0.13 0.49 0.00 -2.08 0.00 0.00 39.78 38.58 2uwo n ASN 35 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 2uwo h GLU 36 N 0.00 0.42 -0.03 -3.83 5.08 -1.90 0.39 114.58 114.70 2uwo h GLU 36 Ca -0.06 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 2uwo h GLU 36 Cb 0.16 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.31 2uwo h GLU 36 CO 0.04 0.28 0.00 0.39 -1.00 0.00 0.00 179.01 178.72 2uwo n GLU 37 N -4.47 1.11 -2.73 2.33 1.02 -1.26 -4.89 120.64 111.74 2uwo n GLU 37 Ca 0.08 -0.17 -0.20 0.00 -0.02 0.00 0.00 57.16 56.85 2uwo n GLU 37 Cb 0.29 -1.25 0.02 0.00 -0.02 0.00 0.00 31.44 30.47 2uwo n GLU 37 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2uwo n ASN 38 N -0.57 -5.64 -4.60 1.62 3.02 0.13 -5.00 115.26 104.21 2uwo n ASN 38 Ca 0.12 -0.17 -0.34 0.00 -0.03 0.00 0.00 54.58 54.15 2uwo n ASN 38 Cb 0.09 -4.55 -0.11 0.00 -0.61 0.00 0.00 39.78 34.60 2uwo n ASN 38 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2uwo s GLU 39 N -5.36 3.54 0.19 3.52 2.02 -1.26 -4.82 118.70 116.53 2uwo s GLU 39 Ca 0.17 -0.43 -0.30 0.00 0.02 0.00 0.00 54.97 54.44 2uwo s GLU 39 Cb -0.08 -2.96 -0.08 0.00 0.10 0.00 0.00 34.13 31.11 2uwo s GLU 39 CO 0.22 0.40 1.19 0.20 0.02 0.00 0.00 175.26 177.29 2uwo s GLY 40 N -0.05 2.71 0.00 -1.39 0.00 -1.26 -0.55 107.32 106.77 2uwo s GLY 40 Ca 0.04 0.95 0.00 0.00 0.00 0.00 0.00 44.72 45.70 2uwo s GLY 40 CO 0.02 1.83 0.00 1.97 0.00 0.00 0.00 173.10 176.92 2uwo n PHE 41 N 2.40 0.00 -3.60 1.90 1.16 -0.64 -4.94 117.46 113.74 2uwo n PHE 41 Ca 0.04 0.00 -0.10 0.00 -1.87 0.00 0.00 57.45 55.52 2uwo n PHE 41 Cb 0.45 0.00 -0.02 0.00 -1.61 0.00 0.00 39.48 38.29 2uwo n PHE 41 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2uwo n GLY 43 N -0.38 2.39 3.77 0.00 0.00 0.43 -0.50 105.19 110.90 2uwo n GLY 43 Ca -0.13 -2.27 -0.08 0.00 0.00 0.00 0.00 46.02 43.54 2uwo n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2uwo s GLY 44 N -4.38 0.27 -0.08 -0.02 0.00 -0.48 -3.47 107.32 99.16 2uwo s GLY 44 Ca 0.44 -0.63 0.03 0.00 0.00 0.00 0.00 44.72 44.56 2uwo s GLY 44 CO 0.28 -0.32 -0.17 -1.59 0.00 0.00 0.00 173.10 171.30 2uwo s THR 45 N -3.43 1.53 -0.06 0.90 2.01 0.63 -1.26 115.64 115.95 2uwo s THR 45 Ca 0.16 -0.70 -0.30 0.00 0.31 0.00 0.00 61.69 61.16 2uwo s THR 45 Cb -0.04 -1.36 -0.05 0.00 0.01 0.00 0.00 72.50 71.06 2uwo s THR 45 CO 0.10 0.44 1.46 -0.63 -0.69 0.00 0.00 174.62 175.30 2uwo s ILE 46 N 0.59 3.80 -0.16 1.82 1.01 0.09 -0.16 121.20 128.17 2uwo s ILE 46 Ca -0.15 1.06 0.16 0.00 0.00 0.00 0.00 60.65 61.72 2uwo s ILE 46 Cb -0.17 -3.68 -0.23 0.00 0.01 0.00 0.00 42.46 38.39 2uwo s ILE 46 CO 0.05 -0.06 0.10 0.18 0.00 0.00 0.00 174.94 175.21 2uwo n LEU 47 N 6.32 0.00 0.00 2.97 4.77 -0.04 -1.44 117.00 129.57 2uwo n LEU 47 Ca 0.15 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 56.10 2uwo n LEU 47 Cb 0.44 0.40 0.02 0.00 -2.33 0.00 0.00 43.42 41.94 2uwo n LEU 47 CO 0.59 0.40 0.69 -1.54 -1.33 0.00 0.00 177.39 176.20 2uwo n SER 48 N -2.62 -1.45 0.26 -1.43 3.41 -1.15 -4.70 113.62 105.95 2uwo n SER 48 Ca -0.27 -1.75 0.09 0.00 -0.26 0.00 0.00 58.87 56.68 2uwo n SER 48 Cb 1.03 2.35 0.67 0.00 -0.26 0.00 0.00 64.21 68.00 2uwo n SER 48 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 175.04 175.93 2uwo h GLU 49 N 0.00 0.00 0.00 4.33 4.11 -1.98 -3.01 114.58 118.03 2uwo h GLU 49 Ca -0.23 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.20 2uwo h GLU 49 Cb 1.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.26 2uwo h GLU 49 CO 0.31 0.03 -0.92 1.19 0.07 0.00 0.00 179.01 179.68 2uwo n PHE 50 N -4.36 0.00 -5.07 2.06 3.72 -1.26 -0.30 117.46 112.24 2uwo n PHE 50 Ca -0.03 0.00 -0.28 0.00 -0.05 0.00 0.00 57.45 57.09 2uwo n PHE 50 Cb 0.11 -0.07 -0.16 0.00 -0.94 0.00 0.00 39.48 38.43 2uwo n PHE 50 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 176.76 177.42 2uwo s TYR 51 N -2.59 2.01 -0.03 1.38 2.02 -1.14 0.01 117.35 119.01 2uwo s TYR 51 Ca 0.04 -0.47 0.07 0.00 -0.37 0.00 0.00 57.07 56.34 2uwo s TYR 51 Cb 0.11 -1.31 -0.01 0.00 -0.40 0.00 0.00 41.96 40.35 2uwo s TYR 51 CO 0.64 -0.10 -0.23 0.42 -1.57 0.00 0.00 175.55 174.71 2uwo s ILE 52 N -0.33 1.88 -0.17 2.71 -1.09 -0.54 -0.86 121.20 122.80 2uwo s ILE 52 Ca 0.04 -1.00 -0.09 0.00 -2.23 0.00 0.00 60.65 57.37 2uwo s ILE 52 Cb -0.10 -1.57 -0.05 0.00 -1.58 0.00 0.00 42.46 39.16 2uwo s ILE 52 CO 0.01 0.53 0.13 -0.22 -1.23 0.00 0.00 174.94 174.16 2uwo s LEU 53 N -0.38 4.26 0.00 2.97 2.96 0.77 -0.57 118.68 128.68 2uwo s LEU 53 Ca 0.04 0.31 -0.01 0.00 -0.22 0.00 0.00 54.13 54.25 2uwo s LEU 53 Cb -0.11 -2.08 0.00 0.00 0.50 0.00 0.00 46.19 44.51 2uwo s LEU 53 CO 0.01 0.26 0.15 1.07 -1.32 0.00 0.00 176.35 176.51 2uwo n THR 54 N 3.01 0.00 -3.58 3.68 5.66 -0.44 -0.27 114.28 122.34 2uwo n THR 54 Ca -0.17 -0.50 -0.37 0.00 -3.05 0.00 0.00 64.05 59.96 2uwo n THR 54 Cb 0.53 0.32 -0.06 0.00 -1.55 0.00 0.00 70.33 69.56 2uwo n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2uwo s ALA 55 N -1.86 3.69 0.39 1.79 0.00 -1.26 -1.08 121.76 123.42 2uwo s ALA 55 Ca 0.08 -0.38 0.08 0.00 0.00 0.00 0.00 51.96 51.75 2uwo s ALA 55 Cb -0.00 -2.32 0.84 0.00 0.00 0.00 0.00 23.12 21.63 2uwo s ALA 55 CO 0.06 0.35 1.98 0.00 0.00 0.00 0.00 175.76 178.15 2uwo h ALA 56 N 5.52 1.79 0.00 0.00 0.00 -1.70 -2.08 119.26 122.78 2uwo h ALA 56 Ca -0.48 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.39 2uwo h ALA 56 Cb 1.20 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.83 2uwo h ALA 56 CO 0.66 0.11 -0.07 1.12 0.00 0.00 0.00 179.25 181.07 2uwo h HIS 57 N 0.63 0.00 0.00 0.00 2.07 -1.93 -1.91 115.15 114.01 2uwo h HIS 57 Ca 0.28 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.77 2uwo h HIS 57 Cb 0.28 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.26 2uwo h HIS 57 CO -0.00 0.07 -0.11 0.00 -3.07 0.00 0.00 177.93 174.81 2uwo n LEU 59 N -3.46 0.00 -0.00 0.00 4.77 -0.72 -2.03 117.00 115.56 2uwo n LEU 59 Ca -0.01 0.01 0.05 0.00 -0.03 0.00 0.00 56.01 56.03 2uwo n LEU 59 Cb 0.27 -0.01 -0.06 0.00 -2.33 0.00 0.00 43.42 41.29 2uwo n LEU 59 CO 0.29 -0.00 -0.03 -1.22 -1.33 0.00 0.00 177.39 175.10 2uwo n TYR 60 N -1.01 0.00 1.44 -1.77 4.02 -1.18 -4.55 117.16 114.11 2uwo n TYR 60 Ca 0.16 0.00 0.09 0.00 -0.01 0.00 0.00 57.90 58.14 2uwo n TYR 60 Cb 0.08 -0.00 0.37 0.00 -0.02 0.00 0.00 39.34 39.77 2uwo n TYR 60 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 2uwo n GLN 61 N -1.25 1.50 -3.62 -0.72 6.02 -0.86 -4.81 117.38 113.63 2uwo n GLN 61 Ca 0.02 -0.75 -0.11 0.00 -0.01 0.00 0.00 57.00 56.15 2uwo n GLN 61 Cb 0.16 -1.33 -0.07 0.00 1.02 0.00 0.00 30.24 30.03 2uwo n GLN 61 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2uwo s ALA 61 N -1.83 -1.91 -0.01 -1.58 0.00 -1.26 -5.06 121.76 110.11 2uwo s ALA 61 Ca 0.28 1.82 -0.12 0.00 0.00 0.00 0.00 51.96 53.94 2uwo s ALA 61 Cb 0.14 -1.16 -0.33 0.00 0.00 0.00 0.00 23.12 21.78 2uwo s ALA 61 CO 0.22 -0.28 0.84 0.87 0.00 0.00 0.00 175.76 177.41 2uwo h LYS 62 N 4.03 0.45 -4.50 0.00 1.57 -1.89 -3.45 116.57 112.77 2uwo h LYS 62 Ca -0.27 -0.76 -0.43 0.00 -1.87 0.00 0.00 60.65 57.32 2uwo h LYS 62 Cb 1.17 0.28 -0.32 0.00 0.08 0.00 0.00 32.23 33.45 2uwo h LYS 62 CO 0.15 1.36 -0.79 0.50 -0.57 0.00 0.00 179.45 180.10 2uwo s ARG 63 N -2.59 1.02 0.11 3.15 3.52 -1.26 -5.14 118.95 117.76 2uwo s ARG 63 Ca -0.12 -0.29 -0.09 0.00 -0.13 0.00 0.00 55.73 55.10 2uwo s ARG 63 Cb 0.05 -0.94 0.00 0.00 -1.56 0.00 0.00 34.95 32.50 2uwo s ARG 63 CO 0.90 0.08 0.22 -0.59 -0.81 0.00 0.00 175.30 175.10 2uwo s PHE 64 N 0.34 0.17 0.38 5.12 -0.71 -1.26 -3.91 117.98 118.11 2uwo s PHE 64 Ca -0.06 -0.58 0.04 0.00 -1.04 0.00 0.00 56.93 55.30 2uwo s PHE 64 Cb -0.10 -0.03 -0.06 0.00 -1.21 0.00 0.00 43.02 41.62 2uwo s PHE 64 CO 0.01 -0.59 0.05 0.15 -1.34 0.00 0.00 175.22 173.50 2uwo s LYS 65 N -3.88 1.83 -0.12 1.99 1.02 -0.72 -4.43 119.74 115.44 2uwo s LYS 65 Ca 0.07 -2.06 0.03 0.00 0.02 0.00 0.00 55.97 54.03 2uwo s LYS 65 Cb 0.04 -1.10 -0.00 0.00 -0.52 0.00 0.00 37.83 36.25 2uwo s LYS 65 CO -0.09 -0.22 -0.21 0.08 -0.92 0.00 0.00 175.35 174.00 2uwo s VAL 66 N -3.09 2.33 -0.12 3.17 1.01 0.87 -1.12 120.40 123.45 2uwo s VAL 66 Ca 0.31 -0.91 -0.05 0.00 0.00 0.00 0.00 61.98 61.33 2uwo s VAL 66 Cb 0.07 -1.93 -0.04 0.00 0.00 0.00 0.00 36.38 34.49 2uwo s VAL 66 CO 0.15 0.55 0.05 -0.60 0.00 0.00 0.00 175.10 175.24 2uwo s ARG 67 N 0.47 3.40 0.14 2.72 3.52 0.36 0.30 118.95 129.86 2uwo s ARG 67 Ca -0.14 -0.33 0.06 0.00 -0.13 0.00 0.00 55.73 55.19 2uwo s ARG 67 Cb -0.17 -3.01 -0.04 0.00 -1.56 0.00 0.00 34.95 30.17 2uwo s ARG 67 CO 0.06 0.58 -0.13 0.14 -0.81 0.00 0.00 175.30 175.13 2uwo s VAL 68 N -0.50 1.37 0.00 7.11 -7.23 -0.50 -1.04 120.40 119.61 2uwo s VAL 68 Ca 0.10 -1.87 0.00 0.00 -1.81 0.00 0.00 61.98 58.40 2uwo s VAL 68 Cb -0.12 -1.68 0.00 0.00 0.56 0.00 0.00 36.38 35.14 2uwo s VAL 68 CO 0.02 -0.51 0.00 0.61 -0.31 0.00 0.00 175.10 174.91 2uwo n GLY 69 N 0.23 1.15 3.77 2.32 0.00 -1.25 -1.75 105.19 109.65 2uwo n GLY 69 Ca -0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.52 2uwo n GLY 69 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2uwo s ASP 70 N -3.09 6.57 -0.00 1.61 2.15 -1.26 -4.15 116.67 118.50 2uwo s ASP 70 Ca 0.00 0.67 0.02 0.00 0.43 0.00 0.00 52.55 53.67 2uwo s ASP 70 Cb 0.00 -2.21 -0.03 0.00 -0.30 0.00 0.00 42.92 40.38 2uwo s ASP 70 CO 0.00 0.16 0.05 0.54 -0.17 0.00 0.00 175.17 175.75 2uwo n ARG 71 N 3.02 0.55 -3.75 4.34 1.74 -1.26 -4.87 116.66 116.44 2uwo n ARG 71 Ca -0.12 -0.02 -0.28 0.00 -0.77 0.00 0.00 57.85 56.66 2uwo n ARG 71 Cb 0.52 -1.01 -0.16 0.00 -1.02 0.00 0.00 32.46 30.79 2uwo n ARG 71 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 2uwo s ASN 72 N -2.14 3.17 0.00 0.55 3.84 -1.26 -0.54 114.94 118.57 2uwo s ASN 72 Ca -0.01 -0.98 0.09 0.00 0.21 0.00 0.00 52.86 52.17 2uwo s ASN 72 Cb 0.01 -0.68 0.40 0.00 -0.55 0.00 0.00 41.25 40.43 2uwo s ASN 72 CO 0.08 -0.32 1.29 0.35 -2.79 0.00 0.00 177.10 175.71 2uwo n THR 73 N 4.99 1.33 0.58 -5.21 -2.24 0.76 -2.14 114.28 112.36 2uwo n THR 73 Ca -0.08 0.33 0.11 0.00 -2.27 0.00 0.00 64.05 62.14 2uwo n THR 73 Cb 0.46 -1.17 0.27 0.00 -2.10 0.00 0.00 70.33 67.78 2uwo n THR 73 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2uwo n GLU 74 N -1.49 2.24 -3.80 -0.78 1.02 -1.26 -4.92 120.64 111.66 2uwo n GLU 74 Ca 0.02 -1.88 -0.13 0.00 -0.02 0.00 0.00 57.16 55.15 2uwo n GLU 74 Cb 0.11 -1.47 -0.14 0.00 -0.02 0.00 0.00 31.44 29.93 2uwo n GLU 74 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 2uwo s GLN 75 N -1.55 0.11 -0.09 3.49 -0.21 -0.91 -5.26 119.66 115.25 2uwo s GLN 75 Ca 0.36 0.25 -0.13 0.00 0.02 0.00 0.00 55.36 55.86 2uwo s GLN 75 Cb 0.21 -0.04 -0.05 0.00 1.00 0.00 0.00 33.01 34.12 2uwo s GLN 75 CO 0.29 -0.08 0.32 -1.21 -2.12 0.00 0.00 175.29 172.48 2uwo s GLU 76 N 0.55 3.97 0.00 2.91 0.41 -1.26 -4.78 118.70 120.50 2uwo s GLU 76 Ca -0.04 0.19 0.00 0.00 -0.41 0.00 0.00 54.97 54.71 2uwo s GLU 76 Cb -0.06 -3.30 0.00 0.00 -1.78 0.00 0.00 34.13 28.99 2uwo s GLU 76 CO -0.02 0.51 0.00 0.41 -0.49 0.00 0.00 175.26 175.67 2uwo n GLY 79 N 2.51 0.00 3.73 -1.39 0.00 -1.26 -5.14 105.19 103.65 2uwo n GLY 79 Ca -0.14 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.52 2uwo n GLY 79 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2uwo s GLU 80 N 0.00 2.45 -0.19 1.61 8.01 -1.26 -4.60 118.70 124.72 2uwo s GLU 80 Ca 0.00 1.91 -0.14 0.00 0.01 0.00 0.00 54.97 56.74 2uwo s GLU 80 Cb 0.00 -1.85 0.05 0.00 -4.31 0.00 0.00 34.13 28.02 2uwo s GLU 80 CO 0.00 -1.63 0.48 0.00 0.01 0.00 0.00 175.26 174.12 2uwo s ALA 81 N -1.66 -1.21 -0.19 5.21 0.00 -0.72 -4.99 121.76 118.20 2uwo s ALA 81 Ca 0.78 1.52 -0.08 0.00 0.00 0.00 0.00 51.96 54.19 2uwo s ALA 81 Cb -0.33 -0.90 -0.04 0.00 0.00 0.00 0.00 23.12 21.85 2uwo s ALA 81 CO 0.41 -0.25 0.07 0.08 0.00 0.00 0.00 175.76 176.06 2uwo s VAL 82 N 0.76 4.81 -0.08 0.00 1.01 -1.26 -1.41 120.40 124.23 2uwo s VAL 82 Ca -0.04 -0.02 0.04 0.00 0.00 0.00 0.00 61.98 61.96 2uwo s VAL 82 Cb -0.05 -3.18 0.00 0.00 0.00 0.00 0.00 36.38 33.15 2uwo s VAL 82 CO -0.06 0.45 -0.21 -1.00 0.00 0.00 0.00 175.10 174.28 2uwo s HIS 83 N 0.46 2.22 0.42 5.22 3.76 0.15 -4.97 115.29 122.55 2uwo s HIS 83 Ca 0.04 -0.84 -0.14 0.00 -0.15 0.00 0.00 55.06 53.97 2uwo s HIS 83 Cb -0.12 -1.50 -0.08 0.00 1.11 0.00 0.00 32.58 31.99 2uwo s HIS 83 CO 0.00 -0.34 0.83 -1.21 -0.85 0.00 0.00 174.74 173.18 2uwo s GLU 84 N 0.31 3.89 -0.13 1.40 2.02 -1.26 -0.09 118.70 124.84 2uwo s GLU 84 Ca -0.14 0.68 -0.16 0.00 0.02 0.00 0.00 54.97 55.36 2uwo s GLU 84 Cb -0.16 -2.32 -0.04 0.00 0.10 0.00 0.00 34.13 31.71 2uwo s GLU 84 CO 0.06 -0.07 0.40 0.08 0.02 0.00 0.00 175.26 175.76 2uwo s VAL 85 N -2.36 5.24 -0.19 2.63 1.01 -1.26 -1.56 120.40 123.91 2uwo s VAL 85 Ca 0.54 0.78 -0.19 0.00 0.00 0.00 0.00 61.98 63.12 2uwo s VAL 85 Cb -0.10 -3.74 -0.16 0.00 0.00 0.00 0.00 36.38 32.38 2uwo s VAL 85 CO 0.28 0.36 0.19 -0.08 0.00 0.00 0.00 175.10 175.84 2uwo h GLU 86 N 6.68 0.00 -4.98 2.72 4.81 -1.04 -3.44 114.58 119.33 2uwo h GLU 86 Ca -0.41 0.00 -0.51 0.00 -0.13 0.00 0.00 59.36 58.31 2uwo h GLU 86 Cb 1.17 0.00 -0.31 0.00 0.63 0.00 0.00 28.75 30.24 2uwo h GLU 86 CO 0.75 0.78 -0.82 0.08 -0.73 0.00 0.00 179.01 179.08 2uwo s VAL 87 N -2.30 1.16 -0.21 0.32 1.01 -0.89 -4.99 120.40 114.50 2uwo s VAL 87 Ca -0.24 -0.56 -0.05 0.00 0.00 0.00 0.00 61.98 61.12 2uwo s VAL 87 Cb 0.04 -1.01 -0.02 0.00 0.00 0.00 0.00 36.38 35.39 2uwo s VAL 87 CO 0.51 0.34 0.00 -0.69 0.00 0.00 0.00 175.10 175.27 2uwo s VAL 88 N 0.14 3.91 -0.37 2.92 1.01 -1.26 -0.69 120.40 126.06 2uwo s VAL 88 Ca -0.04 -0.32 0.01 0.00 0.00 0.00 0.00 61.98 61.62 2uwo s VAL 88 Cb -0.11 -2.78 0.10 0.00 0.00 0.00 0.00 36.38 33.60 2uwo s VAL 88 CO 0.02 0.41 0.12 -0.63 0.00 0.00 0.00 175.10 175.02 2uwo s ILE 89 N 1.20 2.77 -0.05 2.22 1.01 0.61 -4.99 121.20 123.96 2uwo s ILE 89 Ca 0.03 -2.19 -0.09 0.00 0.00 0.00 0.00 60.65 58.41 2uwo s ILE 89 Cb -0.15 -2.95 -0.05 0.00 0.01 0.00 0.00 42.46 39.33 2uwo s ILE 89 CO 0.01 -0.63 0.24 -0.75 0.00 0.00 0.00 174.94 173.81 2uwo s LYS 90 N 1.02 3.59 0.03 2.79 2.20 -1.26 -0.29 119.74 127.82 2uwo s LYS 90 Ca 0.09 0.00 -0.30 0.00 -0.36 0.00 0.00 55.97 55.40 2uwo s LYS 90 Cb -0.21 -3.16 -0.07 0.00 -1.51 0.00 0.00 37.83 32.88 2uwo s LYS 90 CO -0.06 0.72 1.59 -1.58 -0.36 0.00 0.00 175.35 175.66 2uwo s HIS 91 N -1.13 2.46 -0.39 4.03 5.65 -0.88 -4.87 115.29 120.17 2uwo s HIS 91 Ca 0.21 0.43 0.20 0.00 0.25 0.00 0.00 55.06 56.15 2uwo s HIS 91 Cb -0.13 -3.88 0.98 0.00 -1.18 0.00 0.00 32.58 28.37 2uwo s HIS 91 CO 0.10 -3.50 1.60 0.27 -0.65 0.00 0.00 174.74 172.57 2uwo n ASN 92 N 5.78 0.52 -1.15 9.88 0.23 -1.26 -2.01 115.26 127.25 2uwo n ASN 92 Ca 0.15 0.70 0.12 0.00 -0.53 0.00 0.00 54.58 55.02 2uwo n ASN 92 Cb 0.42 -0.78 0.25 0.00 -2.08 0.00 0.00 39.78 37.58 2uwo n ASN 92 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 2uwo n ARG 93 N -2.15 2.48 -1.74 -3.83 1.74 -1.26 -4.97 116.66 106.94 2uwo n ARG 93 Ca -0.00 -2.26 -0.42 0.00 -0.77 0.00 0.00 57.85 54.40 2uwo n ARG 93 Cb 0.09 -1.51 -0.02 0.00 -1.02 0.00 0.00 32.46 30.00 2uwo n ARG 93 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2uwo n PHE 94 N 1.43 2.78 -4.19 -1.55 7.35 -0.85 -4.63 117.46 117.81 2uwo n PHE 94 Ca 0.20 0.27 -0.28 0.00 -0.76 0.00 0.00 57.45 56.88 2uwo n PHE 94 Cb 0.59 -2.58 -0.17 0.00 0.35 0.00 0.00 39.48 37.67 2uwo n PHE 94 CO 0.00 0.00 0.00 0.99 -0.76 0.00 0.00 176.76 176.99 2uwo s THR 95 N -0.01 1.37 0.64 -2.13 2.01 -1.06 -5.00 115.64 111.45 2uwo s THR 95 Ca 0.64 -0.53 0.42 0.00 0.31 0.00 0.00 61.69 62.53 2uwo s THR 95 Cb -0.51 -1.29 0.43 0.00 0.01 0.00 0.00 72.50 71.14 2uwo s THR 95 CO 0.49 0.42 2.35 0.11 -0.69 0.00 0.00 174.62 177.29 2uwo h LYS 96 N 7.78 0.00 0.03 4.92 1.57 -1.94 0.15 116.57 129.08 2uwo h LYS 96 Ca -0.33 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.23 2uwo h LYS 96 Cb 1.15 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.45 2uwo h LYS 96 CO 0.48 0.00 -0.99 0.93 -0.57 0.00 0.00 179.45 179.30 2uwo h GLU 97 N 0.00 0.12 0.00 3.15 5.08 -1.97 -3.37 114.58 117.59 2uwo h GLU 97 Ca -0.00 -0.17 0.00 0.00 -1.00 0.00 0.00 59.36 58.19 2uwo h GLU 97 Cb 0.02 0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.33 2uwo h GLU 97 CO 0.00 1.01 0.00 0.25 -1.00 0.00 0.00 179.01 179.27 2uwo n THR 98 N -3.52 0.00 -1.76 1.13 -2.24 -1.16 -5.01 114.28 101.72 2uwo n THR 98 Ca -0.03 -0.41 -0.19 0.00 -2.27 0.00 0.00 64.05 61.15 2uwo n THR 98 Cb 0.89 1.04 -0.06 0.00 -2.10 0.00 0.00 70.33 70.10 2uwo n THR 98 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 2uwo n TYR 99 N -0.66 -0.24 -2.30 4.78 4.02 0.03 -4.97 117.16 117.83 2uwo n TYR 99 Ca 0.00 0.00 -0.36 0.00 -0.01 0.00 0.00 57.90 57.53 2uwo n TYR 99 Cb 0.01 -3.34 -0.01 0.00 -0.02 0.00 0.00 39.34 35.98 2uwo n TYR 99 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 2uwo s ASP 100 N -2.63 5.95 -1.41 7.72 2.15 -1.25 -3.01 116.67 124.19 2uwo s ASP 100 Ca 0.00 2.18 -0.09 0.00 0.43 0.00 0.00 52.55 55.07 2uwo s ASP 100 Cb 0.00 -2.59 0.04 0.00 -0.30 0.00 0.00 42.92 40.07 2uwo s ASP 100 CO 0.00 -1.06 1.04 0.49 -0.17 0.00 0.00 175.17 175.47 2uwo n PHE 101 N -0.99 -2.50 -2.58 -5.34 3.01 -1.26 -2.57 117.46 105.23 2uwo n PHE 101 Ca 0.10 0.95 -0.43 0.00 1.01 0.00 0.00 57.45 59.08 2uwo n PHE 101 Cb 0.50 -4.55 -0.00 0.00 -0.01 0.00 0.00 39.48 35.42 2uwo n PHE 101 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 2uwo s ASP 102 N -3.50 6.82 -0.18 4.37 2.15 -1.16 -4.14 116.67 121.04 2uwo s ASP 102 Ca 0.52 -2.40 -0.18 0.00 0.43 0.00 0.00 52.55 50.91 2uwo s ASP 102 Cb -0.24 -2.58 0.05 0.00 -0.30 0.00 0.00 42.92 39.85 2uwo s ASP 102 CO 0.78 -1.19 0.50 -0.51 -0.17 0.00 0.00 175.17 174.58 2uwo s ILE 103 N 4.27 0.00 -0.01 4.11 2.07 -1.26 -4.00 121.20 126.37 2uwo s ILE 103 Ca 0.54 -0.02 -0.14 0.00 -1.41 0.00 0.00 60.65 59.62 2uwo s ILE 103 Cb 0.04 -0.71 0.02 0.00 0.13 0.00 0.00 42.46 41.94 2uwo s ILE 103 CO 0.07 -0.01 0.28 0.00 -1.91 0.00 0.00 174.94 173.37 2uwo s ALA 104 N 0.13 -0.72 -0.06 1.50 0.00 -0.24 -2.06 121.76 120.30 2uwo s ALA 104 Ca -0.01 0.27 0.06 0.00 0.00 0.00 0.00 51.96 52.28 2uwo s ALA 104 Cb -0.03 0.06 -0.01 0.00 0.00 0.00 0.00 23.12 23.14 2uwo s ALA 104 CO 0.01 -0.25 -0.24 0.08 0.00 0.00 0.00 175.76 175.36 2uwo s VAL 105 N -1.29 2.14 -0.14 0.00 1.01 0.60 -1.33 120.40 121.38 2uwo s VAL 105 Ca -0.13 -1.03 -0.03 0.00 0.00 0.00 0.00 61.98 60.79 2uwo s VAL 105 Cb -0.05 -1.79 -0.02 0.00 0.00 0.00 0.00 36.38 34.52 2uwo s VAL 105 CO 0.04 0.57 -0.07 -0.76 0.00 0.00 0.00 175.10 174.88 2uwo s LEU 106 N -0.12 3.10 -0.23 3.92 1.43 0.26 -0.28 118.68 126.76 2uwo s LEU 106 Ca -0.05 -0.18 -0.11 0.00 -1.03 0.00 0.00 54.13 52.76 2uwo s LEU 106 Cb -0.14 -1.73 -0.05 0.00 0.03 0.00 0.00 46.19 44.30 2uwo s LEU 106 CO 0.04 0.18 0.17 -0.60 0.23 0.00 0.00 176.35 176.37 2uwo s ARG 107 N 0.31 4.11 0.47 1.70 3.52 0.13 -1.47 118.95 127.72 2uwo s ARG 107 Ca -0.06 -0.22 -0.08 0.00 -0.13 0.00 0.00 55.73 55.24 2uwo s ARG 107 Cb -0.15 -3.51 -0.05 0.00 -1.56 0.00 0.00 34.95 29.69 2uwo s ARG 107 CO 0.04 0.12 0.82 -0.51 -0.81 0.00 0.00 175.30 174.95 2uwo s LEU 108 N 0.89 3.66 0.19 -0.88 1.43 0.10 -0.53 118.68 123.55 2uwo s LEU 108 Ca 0.09 1.09 -0.02 0.00 -1.03 0.00 0.00 54.13 54.25 2uwo s LEU 108 Cb -0.13 -4.03 0.12 0.00 0.03 0.00 0.00 46.19 42.19 2uwo s LEU 108 CO 0.03 -0.54 1.51 0.11 0.23 0.00 0.00 176.35 177.69 2uwo h LYS 109 N 0.59 0.52 -5.67 1.70 1.57 -1.58 -3.41 116.57 110.29 2uwo h LYS 109 Ca -0.47 -0.33 -0.54 0.00 -1.87 0.00 0.00 60.65 57.44 2uwo h LYS 109 Cb 1.20 0.04 -0.28 0.00 0.08 0.00 0.00 32.23 33.26 2uwo h LYS 109 CO 0.63 0.94 -0.83 0.95 -0.57 0.00 0.00 179.45 180.56 2uwo s THR 110 N -3.96 1.38 0.53 -0.16 -4.23 -1.26 -5.02 115.64 102.91 2uwo s THR 110 Ca -0.07 -0.82 -0.20 0.00 -1.18 0.00 0.00 61.69 59.42 2uwo s THR 110 Cb 0.11 -1.16 -0.06 0.00 1.34 0.00 0.00 72.50 72.73 2uwo s THR 110 CO 0.84 0.33 1.12 -2.16 -0.54 0.00 0.00 174.62 174.20 2uwo s PRO 111 N -0.57 3.42 0.23 3.99 0.04 -1.26 -4.88 135.00 135.97 2uwo s PRO 111 Ca 0.06 1.59 -0.30 0.00 0.04 0.00 0.00 61.00 62.40 2uwo s PRO 111 Cb -0.07 -2.03 -0.09 0.00 0.04 0.00 0.00 34.50 32.35 2uwo s PRO 111 CO -0.00 -0.79 1.02 0.42 0.04 0.00 0.00 177.00 177.69 2uwo s ILE 112 N -1.78 3.90 -0.31 0.56 1.01 0.58 -5.01 121.20 120.16 2uwo s ILE 112 Ca 0.72 1.83 -0.16 0.00 0.00 0.00 0.00 60.65 63.03 2uwo s ILE 112 Cb -0.23 -4.17 -0.02 0.00 0.01 0.00 0.00 42.46 38.05 2uwo s ILE 112 CO 0.26 0.40 0.44 -0.89 0.00 0.00 0.00 174.94 175.15 2uwo s THR 113 N -0.90 5.10 0.39 2.92 2.01 -1.26 -4.75 115.64 119.16 2uwo s THR 113 Ca 0.44 0.43 -0.24 0.00 0.31 0.00 0.00 61.69 62.63 2uwo s THR 113 Cb -0.28 -3.83 -0.09 0.00 0.01 0.00 0.00 72.50 68.31 2uwo s THR 113 CO 0.35 -0.03 1.06 -0.36 -0.69 0.00 0.00 174.62 174.95 2uwo s PHE 114 N 2.20 3.26 0.02 4.92 0.08 -1.26 -4.91 117.98 122.29 2uwo s PHE 114 Ca 0.16 1.64 -0.07 0.00 0.12 0.00 0.00 56.93 58.78 2uwo s PHE 114 Cb -0.16 -3.16 0.02 0.00 -0.57 0.00 0.00 43.02 39.15 2uwo s PHE 114 CO 0.11 -0.70 0.32 2.89 -0.10 0.00 0.00 175.22 177.75 2uwo n ARG 115 N 0.01 0.10 -1.74 0.44 1.85 -0.22 -5.00 116.66 112.10 2uwo n ARG 115 Ca 0.05 -0.29 -0.42 0.00 -1.00 0.00 0.00 57.85 56.19 2uwo n ARG 115 Cb 0.49 0.43 -0.02 0.00 -1.05 0.00 0.00 32.46 32.31 2uwo n ARG 115 CO 0.00 0.00 0.00 -0.12 -0.01 0.00 0.00 177.63 177.50 2uwo n MET 116 N -0.23 2.75 -0.96 2.89 0.00 -1.26 -0.88 117.12 119.43 2uwo n MET 116 Ca 0.00 0.98 0.00 0.00 -0.00 0.00 0.00 57.70 58.69 2uwo n MET 116 Cb 0.16 -2.79 0.00 0.00 0.00 0.00 0.00 33.22 30.58 2uwo n MET 116 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 2uwo n ASN 117 N 2.86 -2.92 -3.57 6.12 3.02 -1.26 -4.96 115.26 114.54 2uwo n ASN 117 Ca 0.11 0.00 -0.27 0.00 -0.03 0.00 0.00 54.58 54.39 2uwo n ASN 117 Cb 0.36 -1.29 -0.16 0.00 -0.61 0.00 0.00 39.78 38.08 2uwo n ASN 117 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2uwo s VAL 118 N -2.04 -0.08 -0.04 2.41 1.01 -0.05 -3.85 120.40 117.76 2uwo s VAL 118 Ca 0.00 -0.45 -0.30 0.00 0.00 0.00 0.00 61.98 61.23 2uwo s VAL 118 Cb 0.00 -0.77 0.08 0.00 0.00 0.00 0.00 36.38 35.68 2uwo s VAL 118 CO 0.00 -0.50 0.71 0.00 0.00 0.00 0.00 175.10 175.31 2uwo s ALA 119 N 2.12 -1.77 0.55 5.51 0.00 -0.52 -1.06 121.76 126.59 2uwo s ALA 119 Ca 0.06 1.24 -0.14 0.00 0.00 0.00 0.00 51.96 53.11 2uwo s ALA 119 Cb -0.16 0.04 -0.06 0.00 0.00 0.00 0.00 23.12 22.93 2uwo s ALA 119 CO -0.23 -0.42 0.99 -1.25 0.00 0.00 0.00 175.76 174.85 2uwo s PRO 120 N -1.56 3.82 0.33 0.00 0.04 -1.26 -2.50 135.00 133.87 2uwo s PRO 120 Ca -0.08 0.86 -0.09 0.00 0.04 0.00 0.00 61.00 61.73 2uwo s PRO 120 Cb -0.00 -2.13 -0.06 0.00 0.04 0.00 0.00 34.50 32.35 2uwo s PRO 120 CO 0.06 -0.36 0.66 0.00 0.04 0.00 0.00 177.00 177.39 2uwo s ALA 121 N -2.81 3.47 0.28 8.56 0.00 -0.52 -4.85 121.76 125.89 2uwo s ALA 121 Ca 0.57 -0.31 -0.22 0.00 0.00 0.00 0.00 51.96 51.99 2uwo s ALA 121 Cb -0.10 -2.53 -0.09 0.00 0.00 0.00 0.00 23.12 20.40 2uwo s ALA 121 CO 0.39 0.19 0.83 0.00 0.00 0.00 0.00 175.76 177.17 2uwo s LEU 123 N -2.09 4.23 0.64 0.00 1.43 -1.26 -0.70 118.68 120.93 2uwo s LEU 123 Ca 0.47 0.62 -0.05 0.00 -1.03 0.00 0.00 54.13 54.15 2uwo s LEU 123 Cb -0.17 -2.53 0.04 0.00 0.03 0.00 0.00 46.19 43.56 2uwo s LEU 123 CO 0.22 0.02 0.93 -2.16 0.23 0.00 0.00 176.35 175.59 2uwo s PRO 124 N 0.75 2.43 0.36 1.29 0.04 -1.26 -4.99 135.00 133.61 2uwo s PRO 124 Ca 0.21 -0.32 -0.23 0.00 0.04 0.00 0.00 61.00 60.70 2uwo s PRO 124 Cb -0.14 -2.26 -0.10 0.00 0.04 0.00 0.00 34.50 32.03 2uwo s PRO 124 CO 0.07 -1.00 0.92 -1.21 0.04 0.00 0.00 177.00 175.82 2uwo s GLU 124 N -5.08 4.38 0.09 4.56 2.02 -1.26 -4.96 118.70 118.46 2uwo s GLU 124 Ca 0.58 1.17 -0.33 0.00 0.02 0.00 0.00 54.97 56.40 2uwo s GLU 124 Cb -0.11 -2.55 -0.15 0.00 0.10 0.00 0.00 34.13 31.42 2uwo s GLU 124 CO 0.43 0.16 1.59 -0.09 0.02 0.00 0.00 175.26 177.38 2uwo h ARG 125 N 2.65 -0.86 -0.89 1.61 2.43 -1.97 -1.41 114.38 115.93 2uwo h ARG 125 Ca -0.48 0.06 0.04 0.00 -0.81 0.00 0.00 59.98 58.79 2uwo h ARG 125 Cb 1.19 0.20 -0.05 0.00 -0.42 0.00 0.00 29.97 30.88 2uwo h ARG 125 CO 0.63 -0.57 0.57 -0.44 -1.51 0.00 0.00 179.97 178.65 2uwo h ASP 126 N -0.89 0.95 -0.33 -3.80 3.32 -1.96 -1.63 116.42 112.08 2uwo h ASP 126 Ca -0.05 -0.00 -0.15 0.00 0.02 0.00 0.00 57.03 56.84 2uwo h ASP 126 Cb 0.78 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.11 2uwo h ASP 126 CO -0.03 0.65 -0.37 -0.25 -1.72 0.00 0.00 179.24 177.52 2uwo h TRP 127 N 1.11 1.04 -0.57 4.55 7.01 -1.96 -0.85 115.95 126.27 2uwo h TRP 127 Ca 0.36 -0.30 -0.01 0.00 2.11 0.00 0.00 58.89 61.05 2uwo h TRP 127 Cb 0.02 -0.22 -0.03 0.00 -2.10 0.00 0.00 29.16 26.83 2uwo h TRP 127 CO -0.02 1.11 0.33 0.00 -2.79 0.00 0.00 178.44 177.07 2uwo h ALA 128 N 0.85 0.73 -0.48 2.65 0.00 -0.97 0.49 119.26 122.53 2uwo h ALA 128 Ca 0.06 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 2uwo h ALA 128 Cb 0.95 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 2uwo h ALA 128 CO 0.09 0.23 0.13 0.93 0.00 0.00 0.00 179.25 180.63 2uwo h GLU 129 N 0.77 0.76 0.02 0.00 5.08 -1.02 0.80 114.58 120.97 2uwo h GLU 129 Ca 0.20 -0.17 -0.22 0.00 -1.00 0.00 0.00 59.36 58.17 2uwo h GLU 129 Cb 0.01 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.13 2uwo h GLU 129 CO -0.04 0.73 -1.06 0.66 -1.00 0.00 0.00 179.01 178.30 2uwo h SER 130 N 0.64 0.07 0.00 1.42 4.64 -0.86 -3.36 113.55 116.10 2uwo h SER 130 Ca 0.15 -0.07 -0.13 0.00 -0.47 0.00 0.00 61.79 61.27 2uwo h SER 130 Cb 0.30 -0.02 -0.02 0.00 -0.31 0.00 0.00 62.40 62.35 2uwo h SER 130 CO -0.00 1.06 -1.48 0.41 -0.87 0.00 0.00 176.83 175.95 2uwo n THR 131 N -3.37 0.48 -0.09 2.95 -1.04 0.17 -4.49 114.28 108.89 2uwo n THR 131 Ca -0.02 -0.23 -0.21 0.00 -2.04 0.00 0.00 64.05 61.55 2uwo n THR 131 Cb 0.96 -0.81 -0.12 0.00 -1.82 0.00 0.00 70.33 68.54 2uwo n THR 131 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 2uwo h LEU 131 N 0.00 0.05 -0.32 -4.42 3.38 -1.00 -3.34 115.31 109.66 2uwo h LEU 131 Ca -0.19 -0.60 0.00 0.00 0.09 0.00 0.00 57.88 57.18 2uwo h LEU 131 Cb 1.35 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.08 2uwo h LEU 131 CO -0.01 1.47 0.00 0.23 0.09 0.00 0.00 178.44 180.22 2uwo n MET 131 N -4.37 0.07 0.00 1.13 2.81 0.06 -1.61 117.12 115.21 2uwo n MET 131 Ca -0.30 0.37 0.13 0.00 -1.81 0.00 0.00 57.70 56.09 2uwo n MET 131 Cb 0.70 -1.64 0.29 0.00 -0.71 0.00 0.00 33.22 31.85 2uwo n MET 131 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 2uwo n THR 132 N -1.78 0.00 -1.32 2.03 -2.24 -1.26 -4.94 114.28 104.77 2uwo n THR 132 Ca 0.02 -0.36 -0.30 0.00 -2.27 0.00 0.00 64.05 61.15 2uwo n THR 132 Cb 0.15 1.01 0.13 0.00 -2.10 0.00 0.00 70.33 69.52 2uwo n THR 132 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2uwo s GLN 133 N -2.06 1.35 0.16 -0.78 -1.52 -0.64 -4.96 119.66 111.21 2uwo s GLN 133 Ca 0.31 0.68 -0.08 0.00 -1.95 0.00 0.00 55.36 54.32 2uwo s GLN 133 Cb 0.20 -1.83 0.01 0.00 -0.22 0.00 0.00 33.01 31.17 2uwo s GLN 133 CO 0.34 -2.14 1.48 0.87 -0.25 0.00 0.00 175.29 175.59 2uwo h LYS 134 N -1.47 0.81 -4.26 2.91 1.57 -1.92 -3.43 116.57 110.78 2uwo h LYS 134 Ca -0.50 -0.46 -0.16 0.00 -1.87 0.00 0.00 60.65 57.66 2uwo h LYS 134 Cb 1.29 0.03 -0.14 0.00 0.08 0.00 0.00 32.23 33.49 2uwo h LYS 134 CO 0.57 1.10 -0.56 0.95 -0.57 0.00 0.00 179.45 180.94 2uwo s THR 135 N -4.24 0.10 0.30 -0.16 -4.23 -1.26 -1.24 115.64 104.91 2uwo s THR 135 Ca -0.10 -1.75 0.03 0.00 -1.18 0.00 0.00 61.69 58.69 2uwo s THR 135 Cb 0.11 -1.96 -0.01 0.00 1.34 0.00 0.00 72.50 71.98 2uwo s THR 135 CO 0.87 -0.44 0.11 0.61 -0.54 0.00 0.00 174.62 175.23 2uwo n GLY 136 N -0.12 3.46 2.98 3.99 0.00 -0.32 -4.69 105.19 110.48 2uwo n GLY 136 Ca -0.06 -2.05 -0.23 0.00 0.00 0.00 0.00 46.02 43.68 2uwo n GLY 136 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2uwo s ILE 137 N -2.68 0.89 0.04 -0.61 1.01 0.80 -0.67 121.20 119.98 2uwo s ILE 137 Ca 0.16 -0.34 0.04 0.00 0.00 0.00 0.00 60.65 60.51 2uwo s ILE 137 Cb 0.01 -0.84 -0.04 0.00 0.01 0.00 0.00 42.46 41.60 2uwo s ILE 137 CO 0.11 0.30 -0.07 0.54 0.00 0.00 0.00 174.94 175.82 2uwo s VAL 138 N 0.70 3.61 0.06 2.92 0.11 -0.41 -0.88 120.40 126.51 2uwo s VAL 138 Ca -0.13 -0.92 -0.06 0.00 -2.93 0.00 0.00 61.98 57.94 2uwo s VAL 138 Cb -0.15 -2.62 -0.01 0.00 -1.53 0.00 0.00 36.38 32.07 2uwo s VAL 138 CO 0.02 0.29 0.10 -0.94 -3.33 0.00 0.00 175.10 171.25 2uwo s SER 139 N -1.71 0.23 0.00 3.54 1.04 -1.10 -1.07 113.70 114.62 2uwo s SER 139 Ca 0.19 -0.68 0.00 0.00 0.48 0.00 0.00 55.95 55.94 2uwo s SER 139 Cb -0.11 0.26 0.00 0.00 0.10 0.00 0.00 66.02 66.27 2uwo s SER 139 CO 0.10 -0.61 0.00 0.61 0.98 0.00 0.00 173.24 174.32 2uwo n GLY 140 N 0.31 -0.48 1.48 7.32 0.00 -0.03 -4.30 105.19 109.48 2uwo n GLY 140 Ca -0.16 -1.12 0.02 0.00 0.00 0.00 0.00 46.02 44.76 2uwo n GLY 140 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2uwo n PHE 141 N -0.50 1.68 -1.23 1.61 3.72 -1.26 -1.72 117.46 119.75 2uwo n PHE 141 Ca 0.00 -1.04 -0.22 0.00 -0.05 0.00 0.00 57.45 56.14 2uwo n PHE 141 Cb 0.00 -0.50 0.18 0.00 -0.94 0.00 0.00 39.48 38.22 2uwo n PHE 141 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2uwo n GLY 142 N -0.25 -2.18 3.67 1.37 0.00 -1.26 -0.99 105.19 105.55 2uwo n GLY 142 Ca 0.30 -1.57 -0.38 0.00 0.00 0.00 0.00 46.02 44.37 2uwo n GLY 142 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2uwo n ARG 143 N -3.67 1.23 0.00 1.61 1.74 -0.17 -2.65 116.66 114.75 2uwo n ARG 143 Ca 0.12 0.46 0.12 0.00 -0.77 0.00 0.00 57.85 57.78 2uwo n ARG 143 Cb 0.44 -2.33 0.06 0.00 -1.02 0.00 0.00 32.46 29.61 2uwo n ARG 143 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 2uwo n THR 144 N -1.39 0.00 -3.80 0.55 -2.24 -1.26 -0.66 114.28 105.47 2uwo n THR 144 Ca 0.12 -0.41 -0.11 0.00 -2.27 0.00 0.00 64.05 61.38 2uwo n THR 144 Cb 0.46 1.41 -0.08 0.00 -2.10 0.00 0.00 70.33 70.01 2uwo n THR 144 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2uwo s HIS 145 N -2.19 -0.05 0.28 4.78 3.76 -1.26 -4.33 115.29 116.28 2uwo s HIS 145 Ca 0.24 -0.06 0.01 0.00 -0.15 0.00 0.00 55.06 55.10 2uwo s HIS 145 Cb 0.19 0.04 0.64 0.00 1.11 0.00 0.00 32.58 34.56 2uwo s HIS 145 CO 0.41 -0.43 1.72 1.49 -0.85 0.00 0.00 174.74 177.07 2uwo h GLU 147 N 3.55 0.46 -4.88 1.40 4.81 -1.90 -3.30 114.58 114.71 2uwo h GLU 147 Ca -0.31 -0.03 -0.66 0.00 -0.13 0.00 0.00 59.36 58.23 2uwo h GLU 147 Cb 1.19 -0.10 -0.24 0.00 0.63 0.00 0.00 28.75 30.23 2uwo h GLU 147 CO 0.45 0.30 -0.62 0.15 -0.73 0.00 0.00 179.01 178.56 2uwo s LYS 148 N -5.93 3.42 0.00 1.92 1.02 -1.26 -4.92 119.74 113.99 2uwo s LYS 148 Ca -0.12 -0.64 0.00 0.00 0.02 0.00 0.00 55.97 55.24 2uwo s LYS 148 Cb 0.24 -3.35 0.00 0.00 -0.52 0.00 0.00 37.83 34.19 2uwo s LYS 148 CO 0.78 -0.30 0.00 0.41 -0.92 0.00 0.00 175.35 175.32 2uwo n GLY 149 N 4.91 -0.91 3.86 -3.33 0.00 -1.25 -4.97 105.19 103.50 2uwo n GLY 149 Ca -0.15 -1.10 -0.31 0.00 0.00 0.00 0.00 46.02 44.46 2uwo n GLY 149 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2uwo s ARG 150 N -2.00 3.88 0.67 1.61 3.52 -1.26 -4.89 118.95 120.48 2uwo s ARG 150 Ca 0.00 0.60 -0.17 0.00 -0.13 0.00 0.00 55.73 56.03 2uwo s ARG 150 Cb 0.00 -2.37 -0.00 0.00 -1.56 0.00 0.00 34.95 31.02 2uwo s ARG 150 CO 0.00 -0.00 1.19 1.04 -0.81 0.00 0.00 175.30 176.71 2uwo n GLN 151 N -1.03 0.87 -2.72 5.12 1.13 -1.26 -4.12 117.38 115.37 2uwo n GLN 151 Ca 0.03 0.35 -0.37 0.00 -1.94 0.00 0.00 57.00 55.08 2uwo n GLN 151 Cb 0.54 -2.42 -0.06 0.00 0.11 0.00 0.00 30.24 28.41 2uwo n GLN 151 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 2uwo s SER 152 N -1.50 7.21 0.00 1.08 0.15 -0.16 -4.90 113.70 115.58 2uwo s SER 152 Ca 0.79 1.89 0.25 0.00 0.70 0.00 0.00 55.95 59.59 2uwo s SER 152 Cb -0.37 -2.58 0.57 0.00 -1.71 0.00 0.00 66.02 61.93 2uwo s SER 152 CO 0.44 -0.17 1.46 0.35 1.20 0.00 0.00 173.24 176.52 2uwo n THR 153 N 0.43 0.00 -5.09 6.45 -2.24 -1.26 -4.80 114.28 107.77 2uwo n THR 153 Ca 0.03 -0.01 -0.32 0.00 -2.27 0.00 0.00 64.05 61.48 2uwo n THR 153 Cb 0.50 0.21 -0.15 0.00 -2.10 0.00 0.00 70.33 68.79 2uwo n THR 153 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2uwo s ARG 154 N -2.97 2.22 0.11 -0.78 1.81 -1.26 -0.17 118.95 117.91 2uwo s ARG 154 Ca 0.12 -0.87 -0.31 0.00 -1.72 0.00 0.00 55.73 52.95 2uwo s ARG 154 Cb 0.18 -2.16 -0.08 0.00 -0.45 0.00 0.00 34.95 32.43 2uwo s ARG 154 CO 0.68 0.58 1.42 -1.17 -0.68 0.00 0.00 175.30 176.13 2uwo s LEU 155 N -0.76 4.37 0.25 2.53 2.96 0.30 -4.68 118.68 123.66 2uwo s LEU 155 Ca 0.11 2.35 0.12 0.00 -0.22 0.00 0.00 54.13 56.49 2uwo s LEU 155 Cb -0.10 -3.58 -0.05 0.00 0.50 0.00 0.00 46.19 42.95 2uwo s LEU 155 CO 0.00 -0.69 -0.20 -0.54 -1.32 0.00 0.00 176.35 173.60 2uwo s LYS 156 N 1.24 1.66 0.13 1.98 1.02 -0.70 -0.50 119.74 124.56 2uwo s LYS 156 Ca 0.66 -1.68 0.01 0.00 0.02 0.00 0.00 55.97 54.97 2uwo s LYS 156 Cb -0.37 -1.81 -0.04 0.00 -0.52 0.00 0.00 37.83 35.08 2uwo s LYS 156 CO 0.30 0.35 -0.01 0.00 -0.92 0.00 0.00 175.35 175.07 2uwo s MET 157 N -3.26 0.94 -0.21 1.68 0.23 0.81 -0.86 119.30 118.63 2uwo s MET 157 Ca 0.27 -1.42 -0.15 0.00 -1.03 0.00 0.00 55.69 53.36 2uwo s MET 157 Cb -0.06 -0.11 0.06 0.00 -1.53 0.00 0.00 34.83 33.19 2uwo s MET 157 CO 0.14 -0.11 0.53 -1.17 -2.03 0.00 0.00 175.02 172.37 2uwo s LEU 158 N -3.09 -0.32 -0.03 0.18 2.96 -0.24 -0.72 118.68 117.43 2uwo s LEU 158 Ca 0.18 1.13 -0.30 0.00 -0.22 0.00 0.00 54.13 54.93 2uwo s LEU 158 Cb 0.06 1.81 -0.02 0.00 0.50 0.00 0.00 46.19 48.54 2uwo s LEU 158 CO -0.01 -0.20 0.99 -0.70 -1.32 0.00 0.00 176.35 175.11 2uwo s GLU 159 N 1.06 4.51 -0.13 1.98 2.12 -1.26 -1.29 118.70 125.69 2uwo s GLU 159 Ca -0.06 1.42 -0.00 0.00 0.36 0.00 0.00 54.97 56.68 2uwo s GLU 159 Cb -0.06 -3.49 0.02 0.00 0.26 0.00 0.00 34.13 30.87 2uwo s GLU 159 CO -0.10 -0.14 -0.10 0.14 -0.54 0.00 0.00 175.26 174.52 2uwo s VAL 160 N 1.34 1.24 0.40 3.70 -7.23 0.16 -4.98 120.40 115.03 2uwo s VAL 160 Ca 0.51 -0.44 -0.27 0.00 -1.81 0.00 0.00 61.98 59.97 2uwo s VAL 160 Cb -0.20 -1.22 -0.10 0.00 0.56 0.00 0.00 36.38 35.42 2uwo s VAL 160 CO 0.25 0.39 1.45 -2.84 -0.31 0.00 0.00 175.10 174.04 2uwo s PRO 161 N 1.62 3.98 0.35 4.82 0.02 -1.26 -1.18 135.00 143.36 2uwo s PRO 161 Ca 0.05 2.49 -0.27 0.00 0.02 0.00 0.00 61.00 63.28 2uwo s PRO 161 Cb -0.13 -2.87 -0.09 0.00 0.02 0.00 0.00 34.50 31.43 2uwo s PRO 161 CO -0.09 -0.60 1.22 0.71 -0.33 0.00 0.00 177.00 177.90 2uwo s TYR 162 N -1.15 3.13 -0.09 6.54 2.02 -0.37 -0.55 117.35 126.88 2uwo s TYR 162 Ca 0.55 1.52 -0.01 0.00 -0.37 0.00 0.00 57.07 58.76 2uwo s TYR 162 Cb -0.45 -3.50 -0.03 0.00 -0.40 0.00 0.00 41.96 37.58 2uwo s TYR 162 CO 0.60 -1.44 -0.02 0.08 -1.57 0.00 0.00 175.55 173.20 2uwo s VAL 163 N -1.26 4.16 0.20 0.71 1.01 -0.58 -4.86 120.40 119.79 2uwo s VAL 163 Ca 0.52 -0.30 -0.32 0.00 0.00 0.00 0.00 61.98 61.88 2uwo s VAL 163 Cb -0.35 -2.75 -0.14 0.00 0.00 0.00 0.00 36.38 33.14 2uwo s VAL 163 CO 0.45 0.59 1.32 -0.67 0.00 0.00 0.00 175.10 176.79 2uwo n ASP 164 N 2.28 2.15 -0.28 3.32 2.03 -1.26 -4.64 116.55 120.16 2uwo n ASP 164 Ca -0.18 1.14 -0.04 0.00 0.52 0.00 0.00 54.79 56.23 2uwo n ASP 164 Cb 0.53 -1.33 0.07 0.00 -0.72 0.00 0.00 41.12 39.68 2uwo n ASP 164 CO 0.00 0.00 0.00 -0.09 -1.92 0.00 0.00 177.20 175.19 2uwo h ARG 165 N 3.99 0.98 -0.29 -0.67 2.43 -1.97 -1.67 114.38 117.17 2uwo h ARG 165 Ca -0.44 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 58.64 2uwo h ARG 165 Cb 1.30 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 30.62 2uwo h ARG 165 CO 0.74 0.65 0.06 -0.97 -1.51 0.00 0.00 179.97 178.94 2uwo h ASN 166 N 1.01 0.45 -0.78 -3.80 -1.24 -2.00 -2.57 115.58 106.65 2uwo h ASN 166 Ca 0.29 -0.24 0.07 0.00 0.71 0.00 0.00 56.30 57.13 2uwo h ASN 166 Cb -0.08 -0.12 -0.06 0.00 0.73 0.00 0.00 38.32 38.79 2uwo h ASN 166 CO -0.08 0.58 0.45 0.28 -1.29 0.00 0.00 177.43 177.37 2uwo h SER 167 N 0.31 0.67 0.71 1.15 0.02 -1.86 -1.58 113.55 112.97 2uwo h SER 167 Ca 0.09 0.03 -0.15 0.00 -0.84 0.00 0.00 61.79 60.92 2uwo h SER 167 Cb 0.30 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.72 2uwo h SER 167 CO 0.00 0.41 -0.73 0.00 -1.14 0.00 0.00 176.83 175.38 2uwo h LYS 169 N 0.01 0.88 -0.68 0.00 1.57 -1.03 -2.13 116.57 115.19 2uwo h LYS 169 Ca -0.01 -0.18 -0.01 0.00 -1.87 0.00 0.00 60.65 58.59 2uwo h LYS 169 Cb 1.28 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 33.43 2uwo h LYS 169 CO 0.10 0.78 0.39 -0.07 -0.57 0.00 0.00 179.45 180.08 2uwo h LEU 170 N 0.80 0.81 -0.24 2.94 3.38 -1.10 -2.52 115.31 119.38 2uwo h LEU 170 Ca 0.19 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2uwo h LEU 170 Cb 0.26 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.80 2uwo h LEU 170 CO -0.01 0.63 0.00 0.77 0.09 0.00 0.00 178.44 179.93 2uwo h SER 171 N 0.93 0.00 -3.23 -0.43 4.64 -1.09 -3.46 113.55 110.91 2uwo h SER 171 Ca 0.24 0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 60.97 2uwo h SER 171 Cb -0.02 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.00 2uwo h SER 171 CO -0.04 0.00 -0.19 -0.55 -0.87 0.00 0.00 176.83 175.17 2uwo s SER 172 N -5.22 6.67 0.42 4.97 0.15 -0.83 -4.85 113.70 115.02 2uwo s SER 172 Ca 0.08 0.80 0.23 0.00 0.70 0.00 0.00 55.95 57.76 2uwo s SER 172 Cb 0.09 -2.26 0.33 0.00 -1.71 0.00 0.00 66.02 62.47 2uwo s SER 172 CO 0.59 0.11 1.58 0.28 1.20 0.00 0.00 173.24 177.01 2uwo h SER 173 N 6.12 0.00 -3.12 5.45 0.02 -1.90 -3.45 113.55 116.68 2uwo h SER 173 Ca -0.44 -0.00 -0.64 0.00 -0.84 0.00 0.00 61.79 59.87 2uwo h SER 173 Cb 1.19 0.00 -0.16 0.00 0.14 0.00 0.00 62.40 63.57 2uwo h SER 173 CO 0.72 0.00 -0.77 -0.36 -1.14 0.00 0.00 176.83 175.28 2uwo s PHE 174 N -3.22 2.49 0.25 3.45 0.40 -1.26 -5.10 117.98 114.99 2uwo s PHE 174 Ca 0.07 -0.28 -0.31 0.00 -0.60 0.00 0.00 56.93 55.81 2uwo s PHE 174 Cb 0.05 -1.23 -0.11 0.00 0.51 0.00 0.00 43.02 42.24 2uwo s PHE 174 CO 0.68 0.50 1.59 -1.50 0.70 0.00 0.00 175.22 177.18 2uwo s ILE 175 N -1.66 2.27 -0.44 0.64 2.07 -1.26 -4.99 121.20 117.83 2uwo s ILE 175 Ca 0.23 0.21 -0.10 0.00 -1.41 0.00 0.00 60.65 59.58 2uwo s ILE 175 Cb -0.09 -3.14 0.09 0.00 0.13 0.00 0.00 42.46 39.46 2uwo s ILE 175 CO 0.13 0.03 0.31 -0.63 -1.91 0.00 0.00 174.94 172.86 2uwo s ILE 176 N 0.43 4.42 0.86 2.00 -1.09 -1.26 -5.04 121.20 121.52 2uwo s ILE 176 Ca 0.66 -1.42 -0.12 0.00 -2.23 0.00 0.00 60.65 57.54 2uwo s ILE 176 Cb -0.46 -3.74 0.14 0.00 -1.58 0.00 0.00 42.46 36.82 2uwo s ILE 176 CO 0.41 -0.58 1.21 0.42 -1.23 0.00 0.00 174.94 175.17 2uwo s THR 177 N 1.45 2.05 -1.15 2.92 -4.23 -1.26 -4.95 115.64 110.47 2uwo s THR 177 Ca 0.04 -0.10 0.15 0.00 -1.18 0.00 0.00 61.69 60.60 2uwo s THR 177 Cb -0.24 -2.95 0.17 0.00 1.34 0.00 0.00 72.50 70.82 2uwo s THR 177 CO 0.02 0.00 1.46 0.00 -0.54 0.00 0.00 174.62 175.56 2uwo n GLN 178 N -3.44 0.08 -0.14 3.99 6.02 -1.26 -1.80 117.38 120.83 2uwo n GLN 178 Ca 0.12 0.21 0.10 0.00 -0.01 0.00 0.00 57.00 57.42 2uwo n GLN 178 Cb 0.60 -1.50 0.29 0.00 1.02 0.00 0.00 30.24 30.65 2uwo n GLN 178 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2uwo n ASN 179 N -1.42 2.16 -4.27 1.08 3.02 -1.26 -4.89 115.26 109.68 2uwo n ASN 179 Ca 0.05 -1.84 -0.16 0.00 -0.03 0.00 0.00 54.58 52.60 2uwo n ASN 179 Cb 0.16 -0.18 -0.10 0.00 -0.61 0.00 0.00 39.78 39.04 2uwo n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 2uwo s MET 180 N -1.64 1.10 0.14 3.52 -1.94 -0.74 -0.80 119.30 118.93 2uwo s MET 180 Ca 0.32 -1.42 -0.05 0.00 -1.71 0.00 0.00 55.69 52.84 2uwo s MET 180 Cb 0.18 -0.80 -0.02 0.00 2.01 0.00 0.00 34.83 36.19 2uwo s MET 180 CO 0.25 0.12 0.16 -0.59 -0.01 0.00 0.00 175.02 174.96 2uwo s PHE 181 N -2.91 0.58 0.05 -0.03 -0.12 -0.07 -4.76 117.98 110.72 2uwo s PHE 181 Ca 0.15 -0.97 0.06 0.00 -0.05 0.00 0.00 56.93 56.13 2uwo s PHE 181 Cb -0.00 -0.26 -0.03 0.00 -0.63 0.00 0.00 43.02 42.09 2uwo s PHE 181 CO 0.03 -0.60 -0.13 0.00 -0.05 0.00 0.00 175.22 174.46 2uwo s ALA 183 N -1.01 -1.02 0.00 0.00 0.00 -0.54 -1.53 121.76 117.66 2uwo s ALA 183 Ca 0.17 0.64 0.00 0.00 0.00 0.00 0.00 51.96 52.77 2uwo s ALA 183 Cb -0.11 -0.04 0.00 0.00 0.00 0.00 0.00 23.12 22.97 2uwo s ALA 183 CO 0.08 -0.27 0.00 0.41 0.00 0.00 0.00 175.76 175.97 2uwo n GLY 184 N 1.41 0.61 3.21 0.00 0.00 0.29 -1.48 105.19 109.23 2uwo n GLY 184 Ca -0.20 -1.74 -0.22 0.00 0.00 0.00 0.00 46.02 43.85 2uwo n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2uwo s TYR 185 N -2.83 1.53 0.01 1.61 2.02 -1.26 -4.02 117.35 114.41 2uwo s TYR 185 Ca 0.00 -0.38 -0.25 0.00 -0.37 0.00 0.00 57.07 56.07 2uwo s TYR 185 Cb 0.00 -0.89 -0.17 0.00 -0.40 0.00 0.00 41.96 40.50 2uwo s TYR 185 CO 0.00 0.09 1.26 0.22 -1.57 0.00 0.00 175.55 175.55 2uwo h ASP 185 N 4.69 -0.28 0.00 2.29 3.58 -1.92 -3.43 116.42 121.35 2uwo h ASP 185 Ca -0.41 -0.21 0.00 0.00 0.42 0.00 0.00 57.03 56.83 2uwo h ASP 185 Cb 1.17 0.07 0.00 0.00 1.72 0.00 0.00 39.33 42.30 2uwo h ASP 185 CO 0.43 0.08 -1.00 0.35 -2.88 0.00 0.00 179.24 176.23 2uwo n THR 185 N -5.09 0.00 -1.57 2.25 -2.24 -1.26 0.72 114.28 107.10 2uwo n THR 185 Ca -0.09 0.00 -0.48 0.00 -2.27 0.00 0.00 64.05 61.21 2uwo n THR 185 Cb 0.25 -0.68 -0.03 0.00 -2.10 0.00 0.00 70.33 67.76 2uwo n THR 185 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 2uwo n LYS 186 N -2.31 1.14 -1.98 -0.78 4.81 -1.26 -4.70 118.16 113.07 2uwo n LYS 186 Ca 0.00 0.40 -0.41 0.00 -0.87 0.00 0.00 58.31 57.43 2uwo n LYS 186 Cb 0.50 -1.85 -0.00 0.00 0.02 0.00 0.00 35.03 33.70 2uwo n LYS 186 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 2uwo n GLN 187 N 1.48 3.67 -3.78 1.64 1.13 -1.26 -4.74 117.38 115.52 2uwo n GLN 187 Ca 0.14 -3.11 -0.13 0.00 -1.94 0.00 0.00 57.00 51.95 2uwo n GLN 187 Cb 0.26 -2.93 -0.14 0.00 0.11 0.00 0.00 30.24 27.54 2uwo n GLN 187 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 2uwo s GLU 188 N 0.94 0.08 0.04 -1.09 2.02 -1.26 -4.27 118.70 115.15 2uwo s GLU 188 Ca 0.49 0.26 -0.28 0.00 0.02 0.00 0.00 54.97 55.45 2uwo s GLU 188 Cb 0.14 -0.11 0.10 0.00 0.10 0.00 0.00 34.13 34.35 2uwo s GLU 188 CO -0.05 -0.11 1.11 0.34 0.02 0.00 0.00 175.26 176.56 2uwo s ASP 189 N 0.77 -0.14 0.95 -0.19 2.15 -0.89 -4.46 116.67 114.87 2uwo s ASP 189 Ca -0.06 -0.22 -0.14 0.00 0.43 0.00 0.00 52.55 52.56 2uwo s ASP 189 Cb -0.08 0.32 0.16 0.00 -0.30 0.00 0.00 42.92 43.02 2uwo s ASP 189 CO -0.03 -0.58 1.16 0.00 -0.17 0.00 0.00 175.17 175.55 2uwo s ALA 190 N -2.85 1.72 0.32 3.66 0.00 -1.26 0.05 121.76 123.40 2uwo s ALA 190 Ca 0.12 -0.69 -0.11 0.00 0.00 0.00 0.00 51.96 51.28 2uwo s ALA 190 Cb 0.01 -2.97 0.05 0.00 0.00 0.00 0.00 23.12 20.20 2uwo s ALA 190 CO -0.02 -2.46 0.63 0.00 0.00 0.00 0.00 175.76 173.91 2uwo n GLN 192 N -0.44 1.41 0.00 0.00 -0.06 -1.26 -1.19 117.38 115.83 2uwo n GLN 192 Ca -0.07 0.51 0.00 0.00 -2.00 0.00 0.00 57.00 55.44 2uwo n GLN 192 Cb 0.48 -2.19 0.00 0.00 -4.06 0.00 0.00 30.24 24.48 2uwo n GLN 192 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2uwo n GLY 193 N 2.88 3.02 0.16 1.69 0.00 -1.26 -1.00 105.19 110.68 2uwo n GLY 193 Ca 0.19 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.33 2uwo n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2uwo h ASP 194 N 0.00 0.00 -2.56 1.61 3.32 -1.45 -3.29 116.42 114.06 2uwo h ASP 194 Ca 0.00 -0.02 -0.60 0.00 0.02 0.00 0.00 57.03 56.43 2uwo h ASP 194 Cb 0.00 0.00 0.12 0.00 0.22 0.00 0.00 39.33 39.67 2uwo h ASP 194 CO 0.00 0.01 0.01 -1.20 -1.72 0.00 0.00 179.24 176.34 2uwo n SER 195 N -2.74 0.78 0.00 6.45 7.64 -1.26 -1.42 113.62 123.07 2uwo n SER 195 Ca 0.04 1.08 0.00 0.00 1.01 0.00 0.00 58.87 61.00 2uwo n SER 195 Cb 0.50 -1.26 0.00 0.00 -1.01 0.00 0.00 64.21 62.44 2uwo n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2uwo n GLY 196 N 1.34 2.70 3.86 0.23 0.00 0.52 -0.43 105.19 113.42 2uwo n GLY 196 Ca 0.10 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.82 2uwo n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2uwo s GLY 197 N -1.90 1.74 0.31 -0.02 0.00 -0.51 -3.18 107.32 103.74 2uwo s GLY 197 Ca 0.00 -1.13 -0.27 0.00 0.00 0.00 0.00 44.72 43.32 2uwo s GLY 197 CO 0.00 -0.35 0.94 2.56 0.00 0.00 0.00 173.10 176.26 2uwo s PRO 198 N -5.78 4.64 -0.19 2.90 0.05 -1.26 -1.67 135.00 133.69 2uwo s PRO 198 Ca 0.73 1.37 0.01 0.00 0.05 0.00 0.00 61.00 63.16 2uwo s PRO 198 Cb -0.05 -2.90 0.02 0.00 0.05 0.00 0.00 34.50 31.62 2uwo s PRO 198 CO 0.54 0.33 -0.18 -1.58 0.05 0.00 0.00 177.00 176.16 2uwo s HIS 199 N -1.52 2.86 0.24 0.56 2.46 -0.60 -2.72 115.29 116.57 2uwo s HIS 199 Ca 0.48 -1.71 0.10 0.00 0.47 0.00 0.00 55.06 54.41 2uwo s HIS 199 Cb -0.20 -1.93 -0.05 0.00 -0.13 0.00 0.00 32.58 30.27 2uwo s HIS 199 CO 0.26 -0.81 -0.18 0.14 -2.47 0.00 0.00 174.74 171.68 2uwo s VAL 200 N 1.27 2.16 -0.05 0.89 -7.23 -0.06 -0.70 120.40 116.68 2uwo s VAL 200 Ca 0.03 -2.26 0.02 0.00 -1.81 0.00 0.00 61.98 57.96 2uwo s VAL 200 Cb -0.14 -2.15 0.02 0.00 0.56 0.00 0.00 36.38 34.66 2uwo s VAL 200 CO -0.11 -0.43 -0.09 -0.89 -0.31 0.00 0.00 175.10 173.26 2uwo s THR 201 N -2.54 0.88 0.04 5.32 2.01 -0.22 -0.14 115.64 120.99 2uwo s THR 201 Ca 0.25 -0.34 -0.21 0.00 0.31 0.00 0.00 61.69 61.70 2uwo s THR 201 Cb -0.04 -0.83 -0.06 0.00 0.01 0.00 0.00 72.50 71.58 2uwo s THR 201 CO 0.11 0.30 0.63 -0.60 -0.69 0.00 0.00 174.62 174.37 2uwo s ARG 202 N 0.69 4.34 -0.06 4.92 3.52 -1.26 -0.86 118.95 130.25 2uwo s ARG 202 Ca -0.12 0.83 -0.02 0.00 -0.13 0.00 0.00 55.73 56.28 2uwo s ARG 202 Cb -0.15 -3.31 0.03 0.00 -1.56 0.00 0.00 34.95 29.97 2uwo s ARG 202 CO 0.02 0.44 0.06 0.12 -0.81 0.00 0.00 175.30 175.13 2uwo s PHE 203 N -0.49 0.14 -1.36 5.12 5.36 0.07 -4.90 117.98 121.92 2uwo s PHE 203 Ca 0.32 0.15 -0.06 0.00 -0.96 0.00 0.00 56.93 56.38 2uwo s PHE 203 Cb -0.19 -0.54 0.00 0.00 -0.34 0.00 0.00 43.02 41.95 2uwo s PHE 203 CO 0.19 -0.24 0.46 1.63 -1.46 0.00 0.00 175.22 175.81 2uwo n LYS 204 N 5.28 -2.48 -1.89 10.12 5.02 -1.26 -1.80 118.16 131.15 2uwo n LYS 204 Ca -0.04 0.36 -0.18 0.00 -2.02 0.00 0.00 58.31 56.43 2uwo n LYS 204 Cb 0.50 -4.22 -0.05 0.00 -0.02 0.00 0.00 35.03 31.24 2uwo n LYS 204 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2uwo n ASP 205 N -2.86 -5.06 -4.16 4.39 8.00 -1.26 -4.98 116.55 110.61 2uwo n ASP 205 Ca -0.26 0.29 -0.29 0.00 0.71 0.00 0.00 54.79 55.24 2uwo n ASP 205 Cb 0.66 -4.40 -0.17 0.00 -0.02 0.00 0.00 41.12 37.20 2uwo n ASP 205 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2uwo s THR 206 N -2.71 1.67 -0.22 -3.53 2.01 -0.74 -5.13 115.64 106.99 2uwo s THR 206 Ca 0.00 -0.82 -0.09 0.00 0.31 0.00 0.00 61.69 61.09 2uwo s THR 206 Cb 0.00 -1.45 -0.04 0.00 0.01 0.00 0.00 72.50 71.02 2uwo s THR 206 CO 0.00 0.47 0.11 -0.31 -0.69 0.00 0.00 174.62 174.20 2uwo s TYR 207 N 0.22 3.26 -0.07 4.92 1.51 -1.26 -0.75 117.35 125.17 2uwo s TYR 207 Ca -0.10 0.09 0.01 0.00 -1.01 0.00 0.00 57.07 56.05 2uwo s TYR 207 Cb -0.15 -2.19 -0.03 0.00 -0.11 0.00 0.00 41.96 39.48 2uwo s TYR 207 CO 0.05 0.05 -0.09 -0.06 -1.11 0.00 0.00 175.55 174.38 2uwo s PHE 208 N 0.86 2.87 -0.04 2.71 0.08 -0.04 -2.23 117.98 122.21 2uwo s PHE 208 Ca 0.06 -0.10 -0.30 0.00 0.12 0.00 0.00 56.93 56.71 2uwo s PHE 208 Cb -0.13 -1.72 -0.05 0.00 -0.57 0.00 0.00 43.02 40.55 2uwo s PHE 208 CO 0.03 0.22 1.54 0.08 -0.10 0.00 0.00 175.22 176.99 2uwo s VAL 209 N -0.61 3.63 0.00 -0.44 1.01 0.12 -1.05 120.40 123.05 2uwo s VAL 209 Ca 0.09 0.88 0.00 0.00 0.00 0.00 0.00 61.98 62.95 2uwo s VAL 209 Cb -0.11 -3.57 0.00 0.00 0.00 0.00 0.00 36.38 32.70 2uwo s VAL 209 CO 0.02 -0.05 0.00 0.35 0.00 0.00 0.00 175.10 175.42 2uwo n THR 210 N 5.15 0.00 -3.98 3.92 -2.24 0.12 -4.57 114.28 112.68 2uwo n THR 210 Ca 0.16 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.85 2uwo n THR 210 Cb 0.43 0.05 -0.05 0.00 -2.10 0.00 0.00 70.33 68.66 2uwo n THR 210 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2uwo s GLY 211 N -2.29 0.49 -0.12 3.38 0.00 -0.45 -2.28 107.32 106.05 2uwo s GLY 211 Ca 0.00 -0.83 0.03 0.00 0.00 0.00 0.00 44.72 43.91 2uwo s GLY 211 CO 0.00 -0.60 -0.20 -0.42 0.00 0.00 0.00 173.10 171.88 2uwo s ILE 212 N -4.01 1.86 0.04 0.90 1.01 -0.80 -1.55 121.20 118.66 2uwo s ILE 212 Ca 0.21 -0.87 -0.33 0.00 0.00 0.00 0.00 60.65 59.66 2uwo s ILE 212 Cb -0.01 -1.65 -0.12 0.00 0.01 0.00 0.00 42.46 40.69 2uwo s ILE 212 CO 0.08 0.51 1.77 0.52 0.00 0.00 0.00 174.94 177.82 2uwo n VAL 213 N 4.00 0.34 0.02 2.92 0.31 -0.67 -0.87 118.33 124.39 2uwo n VAL 213 Ca -0.20 -0.06 -0.00 0.00 -0.01 0.00 0.00 64.34 64.07 2uwo n VAL 213 Cb 0.52 -1.82 -0.00 0.00 -0.91 0.00 0.00 33.84 31.63 2uwo n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 2uwo n SER 214 N 5.35 0.51 -3.68 4.52 2.88 -0.76 -0.35 113.62 122.09 2uwo n SER 214 Ca 0.20 0.06 -0.08 0.00 -1.33 0.00 0.00 58.87 57.72 2uwo n SER 214 Cb 0.31 -0.16 -0.02 0.00 -0.75 0.00 0.00 64.21 63.60 2uwo n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 2uwo s TRP 215 N -1.45 -0.05 0.00 0.66 1.48 -0.59 -4.89 118.94 114.09 2uwo s TRP 215 Ca -0.00 -0.44 -0.28 0.00 -1.06 0.00 0.00 56.10 54.32 2uwo s TRP 215 Cb 0.00 0.67 0.10 0.00 -1.16 0.00 0.00 33.47 33.08 2uwo s TRP 215 CO 0.00 -1.28 0.85 0.20 -4.06 0.00 0.00 176.95 172.66 2uwo s GLY 216 N -2.96 -0.47 -1.02 3.67 0.00 -1.26 -0.74 107.32 104.52 2uwo s GLY 216 Ca 0.13 1.06 -0.19 0.00 0.00 0.00 0.00 44.72 45.73 2uwo s GLY 216 CO 0.08 0.42 1.30 -0.54 0.00 0.00 0.00 173.10 174.36 2uwo s GLU 217 N -2.89 3.71 1.76 2.90 2.02 -1.26 -4.87 118.70 120.07 2uwo s GLU 217 Ca 0.03 -1.77 0.00 0.00 0.02 0.00 0.00 54.97 53.25 2uwo s GLU 217 Cb -0.01 -5.09 0.00 0.00 0.10 0.00 0.00 34.13 29.13 2uwo s GLU 217 CO -0.07 -1.91 0.00 0.41 0.02 0.00 0.00 175.26 173.71 2uwo n GLY 219 N 5.58 -1.43 3.00 -1.39 0.00 -1.26 -4.66 105.19 105.02 2uwo n GLY 219 Ca 0.30 -1.28 -0.26 0.00 0.00 0.00 0.00 46.02 44.77 2uwo n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2uwo n ALA 221 N 4.24 -0.47 -1.77 0.00 0.00 -1.26 -4.68 120.51 116.56 2uwo n ALA 221 Ca -0.19 0.19 -0.38 0.00 0.00 0.00 0.00 53.44 53.06 2uwo n ALA 221 Cb 0.51 -1.97 -0.04 0.00 0.00 0.00 0.00 19.45 17.95 2uwo n ALA 221 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2uwo s ARG 222 N -4.53 4.31 0.27 0.00 0.52 -1.26 -4.70 118.95 113.56 2uwo s ARG 222 Ca 0.00 1.65 -0.31 0.00 -0.52 0.00 0.00 55.73 56.56 2uwo s ARG 222 Cb 0.00 -2.78 -0.12 0.00 0.52 0.00 0.00 34.95 32.57 2uwo s ARG 222 CO 0.00 -0.04 1.60 1.63 0.02 0.00 0.00 175.30 178.51 2uwo n LYS 223 N 0.38 2.64 -1.21 3.54 5.02 -1.26 -2.24 118.16 125.04 2uwo n LYS 223 Ca 0.03 0.94 -0.07 0.00 -2.02 0.00 0.00 58.31 57.19 2uwo n LYS 223 Cb 0.48 -2.72 -0.03 0.00 -0.02 0.00 0.00 35.03 32.73 2uwo n LYS 223 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2uwo n GLY 223 N 2.46 0.90 3.19 0.72 0.00 0.22 -4.99 105.19 107.69 2uwo n GLY 223 Ca 0.10 -0.39 -0.17 0.00 0.00 0.00 0.00 46.02 45.55 2uwo n GLY 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2uwo s LYS 224 N -2.30 0.88 0.35 1.61 -0.14 -0.95 -4.81 119.74 114.39 2uwo s LYS 224 Ca 0.00 -1.08 0.06 0.00 -1.36 0.00 0.00 55.97 53.60 2uwo s LYS 224 Cb 0.00 -0.80 -0.07 0.00 -1.68 0.00 0.00 37.83 35.28 2uwo s LYS 224 CO 0.00 0.16 0.00 0.71 -0.76 0.00 0.00 175.35 175.46 2uwo s TYR 225 N -1.74 2.23 0.29 3.18 2.02 -1.26 -4.64 117.35 117.42 2uwo s TYR 225 Ca 0.03 -0.75 -0.22 0.00 -0.37 0.00 0.00 57.07 55.75 2uwo s TYR 225 Cb -0.07 -1.46 -0.09 0.00 -0.40 0.00 0.00 41.96 39.94 2uwo s TYR 225 CO 0.02 0.29 0.84 0.20 -1.57 0.00 0.00 175.55 175.34 2uwo s GLY 226 N -3.58 2.66 -0.14 0.71 0.00 -0.55 -4.55 107.32 101.88 2uwo s GLY 226 Ca 0.34 0.34 -0.00 0.00 0.00 0.00 0.00 44.72 45.40 2uwo s GLY 226 CO 0.16 0.72 -0.13 -0.42 0.00 0.00 0.00 173.10 173.43 2uwo s ILE 227 N -1.65 3.07 0.06 0.90 -1.09 0.08 -1.47 121.20 121.10 2uwo s ILE 227 Ca 0.49 -0.65 0.07 0.00 -2.23 0.00 0.00 60.65 58.33 2uwo s ILE 227 Cb -0.16 -2.30 -0.03 0.00 -1.58 0.00 0.00 42.46 38.39 2uwo s ILE 227 CO 0.21 0.52 -0.19 -0.31 -1.23 0.00 0.00 174.94 173.94 2uwo s TYR 228 N 0.41 1.68 0.20 3.97 1.51 0.27 -1.55 117.35 123.83 2uwo s TYR 228 Ca -0.10 -0.39 -0.31 0.00 -1.01 0.00 0.00 57.07 55.27 2uwo s TYR 228 Cb -0.16 -0.97 -0.09 0.00 -0.11 0.00 0.00 41.96 40.62 2uwo s TYR 228 CO 0.05 0.11 1.44 0.99 -1.11 0.00 0.00 175.55 177.04 2uwo s THR 229 N -0.93 2.84 -0.68 -0.71 2.01 -0.05 -0.89 115.64 117.23 2uwo s THR 229 Ca 0.06 0.66 -0.26 0.00 0.31 0.00 0.00 61.69 62.46 2uwo s THR 229 Cb -0.09 -3.42 0.04 0.00 0.01 0.00 0.00 72.50 69.04 2uwo s THR 229 CO 0.02 0.08 1.14 -0.75 -0.69 0.00 0.00 174.62 174.43 2uwo s LYS 230 N 0.31 3.22 0.41 4.92 2.20 0.02 -1.90 119.74 128.92 2uwo s LYS 230 Ca 0.63 -0.36 0.08 0.00 -0.36 0.00 0.00 55.97 55.96 2uwo s LYS 230 Cb -0.41 -4.16 0.88 0.00 -1.51 0.00 0.00 37.83 32.64 2uwo s LYS 230 CO 0.37 -1.93 2.04 0.28 -0.36 0.00 0.00 175.35 175.76 2uwo h VAL 231 N 6.03 1.07 -0.19 4.02 2.07 -1.78 -1.76 116.25 125.71 2uwo h VAL 231 Ca -0.28 -0.19 0.06 0.00 0.82 0.00 0.00 66.70 67.11 2uwo h VAL 231 Cb 1.06 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.30 2uwo h VAL 231 CO 1.22 0.10 0.16 0.71 0.02 0.00 0.00 177.57 179.78 2uwo h THR 232 N 0.54 0.70 0.00 2.57 1.35 -1.90 0.13 112.91 116.30 2uwo h THR 232 Ca 0.18 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.04 2uwo h THR 232 Cb 0.05 0.88 0.00 0.00 -1.73 0.00 0.00 68.15 67.35 2uwo h THR 232 CO -0.04 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.23 2uwo h ALA 233 N 1.86 1.00 0.00 6.62 0.00 -1.68 -3.25 119.26 123.81 2uwo h ALA 233 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2uwo h ALA 233 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.20 2uwo h ALA 233 CO -0.00 0.00 -0.10 1.19 0.00 0.00 0.00 179.25 180.34 2uwo n PHE 234 N -2.53 0.00 -0.21 0.00 3.72 0.01 -4.85 117.46 113.61 2uwo n PHE 234 Ca 0.02 -0.62 -0.07 0.00 -0.05 0.00 0.00 57.45 56.73 2uwo n PHE 234 Cb 0.28 -0.10 0.03 0.00 -0.94 0.00 0.00 39.48 38.75 2uwo n PHE 234 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 2uwo h LEU 235 N 0.00 0.71 -0.59 4.37 3.38 -1.55 0.32 115.31 121.94 2uwo h LEU 235 Ca 0.00 -0.06 -0.09 0.00 0.09 0.00 0.00 57.88 57.82 2uwo h LEU 235 Cb 0.98 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.53 2uwo h LEU 235 CO 0.00 0.56 0.03 0.11 0.09 0.00 0.00 178.44 179.23 2uwo h LYS 236 N 0.79 1.02 -0.39 1.13 1.57 -1.88 -0.23 116.57 118.58 2uwo h LYS 236 Ca 0.21 -0.31 -0.00 0.00 -1.87 0.00 0.00 60.65 58.68 2uwo h LYS 236 Cb -0.02 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.17 2uwo h LYS 236 CO -0.04 0.99 0.23 2.35 -0.57 0.00 0.00 179.45 182.41 2uwo h TRP 237 N 0.92 0.53 -0.09 -1.35 7.01 -1.73 0.74 115.95 121.97 2uwo h TRP 237 Ca 0.17 -0.01 -0.00 0.00 2.11 0.00 0.00 58.89 61.16 2uwo h TRP 237 Cb 0.51 -0.17 -0.00 0.00 -2.10 0.00 0.00 29.16 27.39 2uwo h TRP 237 CO 0.04 0.39 0.06 0.82 -2.79 0.00 0.00 178.44 176.95 2uwo h ILE 238 N 0.51 1.06 -0.41 2.65 2.04 -0.27 0.69 117.51 123.79 2uwo h ILE 238 Ca 0.14 -0.16 0.05 0.00 1.00 0.00 0.00 64.86 65.89 2uwo h ILE 238 Cb 0.03 1.00 -0.05 0.00 -0.74 0.00 0.00 36.82 37.06 2uwo h ILE 238 CO -0.02 0.06 0.14 -0.78 0.00 0.00 0.00 178.15 177.54 2uwo h ASP 239 N 0.09 0.14 -0.67 1.72 3.58 -0.78 -1.33 116.42 119.16 2uwo h ASP 239 Ca 0.03 0.05 -0.04 0.00 0.42 0.00 0.00 57.03 57.50 2uwo h ASP 239 Cb 0.04 0.04 -0.03 0.00 1.72 0.00 0.00 39.33 41.10 2uwo h ASP 239 CO -0.01 0.11 0.29 0.03 -2.88 0.00 0.00 179.24 176.78 2uwo h ARG 240 N 0.30 1.02 0.00 0.28 3.08 -0.74 -2.44 114.38 115.87 2uwo h ARG 240 Ca 0.19 -0.17 -0.05 0.00 0.07 0.00 0.00 59.98 60.02 2uwo h ARG 240 Cb 0.18 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 2uwo h ARG 240 CO -0.20 0.82 -0.24 0.77 -1.07 0.00 0.00 179.97 180.05 2uwo h SER 241 N 1.00 0.00 0.98 7.04 0.02 -0.04 -2.90 113.55 119.64 2uwo h SER 241 Ca 0.24 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.19 2uwo h SER 241 Cb 0.18 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.72 2uwo h SER 241 CO -0.02 0.24 -0.47 0.23 -1.14 0.00 0.00 176.83 175.67 2uwo n MET 242 N -3.98 0.26 0.09 3.45 2.81 -0.58 -3.76 117.12 115.41 2uwo n MET 242 Ca -0.02 0.11 0.12 0.00 -1.81 0.00 0.00 57.70 56.09 2uwo n MET 242 Cb 0.32 -1.69 0.05 0.00 -0.71 0.00 0.00 33.22 31.19 2uwo n MET 242 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 2uwo h LYS 243 N 0.00 0.00 0.00 0.03 1.57 -1.28 -3.52 116.57 113.38 2uwo h LYS 243 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2uwo h LYS 243 Cb 0.72 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.03 2uwo h LYS 243 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 179.45 179.13