#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2uwl s VAL 17 N 0.00 5.24 0.00 1.39 1.01 0.48 -3.98 120.40 124.54 2uwl s VAL 17 Ca 0.00 0.58 0.00 0.00 0.00 0.00 0.00 61.98 62.56 2uwl s VAL 17 Cb 0.00 -3.67 0.00 0.00 0.00 0.00 0.00 36.38 32.71 2uwl s VAL 17 CO 0.00 0.28 0.00 0.61 0.00 0.00 0.00 175.10 175.99 2uwl n GLY 18 N 3.99 -0.35 7.00 4.51 0.00 -1.26 -2.13 105.19 116.95 2uwl n GLY 18 Ca -0.10 -1.06 0.00 0.00 0.00 0.00 0.00 46.02 44.86 2uwl n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2uwl n GLY 19 N 0.00 0.42 3.27 -0.02 0.00 -1.26 -4.91 105.19 102.69 2uwl n GLY 19 Ca 0.00 -0.90 -0.12 0.00 0.00 0.00 0.00 46.02 45.00 2uwl n GLY 19 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2uwl s GLN 20 N 0.00 1.31 0.50 1.61 0.00 -0.19 -4.99 119.66 117.89 2uwl s GLN 20 Ca 0.00 -1.60 -0.22 0.00 -0.00 0.00 0.00 55.36 53.53 2uwl s GLN 20 Cb 0.00 0.31 -0.06 0.00 0.00 0.00 0.00 33.01 33.26 2uwl s GLN 20 CO 0.00 -0.45 1.26 -1.21 0.00 0.00 0.00 175.29 174.89 2uwl s GLU 21 N -4.07 3.48 -0.05 9.60 2.02 -1.26 -0.44 118.70 127.98 2uwl s GLU 21 Ca 0.36 2.01 -0.30 0.00 0.02 0.00 0.00 54.97 57.06 2uwl s GLU 21 Cb 0.05 -2.35 -0.05 0.00 0.10 0.00 0.00 34.13 31.88 2uwl s GLU 21 CO 0.13 -0.85 1.48 0.00 0.02 0.00 0.00 175.26 176.04 2uwl s LYS 23 N 3.20 1.59 -0.03 0.00 -0.14 -1.26 -4.88 119.74 118.21 2uwl s LYS 23 Ca 0.66 -0.41 -0.35 0.00 -1.36 0.00 0.00 55.97 54.50 2uwl s LYS 23 Cb -0.31 -2.07 -0.13 0.00 -1.68 0.00 0.00 37.83 33.64 2uwl s LYS 23 CO 0.26 -1.69 1.73 -3.47 -0.76 0.00 0.00 175.35 171.41 2uwl n ASP 24 N -3.22 3.02 0.00 2.83 2.03 -1.26 -1.44 116.55 118.50 2uwl n ASP 24 Ca 0.12 1.03 0.00 0.00 0.52 0.00 0.00 54.79 56.46 2uwl n ASP 24 Cb 0.60 -1.33 0.00 0.00 -0.72 0.00 0.00 41.12 39.67 2uwl n ASP 24 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2uwl n GLY 25 N 3.92 0.95 0.16 0.27 0.00 -1.26 -4.93 105.19 104.31 2uwl n GLY 25 Ca 0.21 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.30 2uwl n GLY 25 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2uwl h GLU 26 N 2.52 0.00 -1.47 1.61 5.08 -1.60 -3.37 114.58 117.35 2uwl h GLU 26 Ca 0.00 0.00 -0.47 0.00 -1.00 0.00 0.00 59.36 57.89 2uwl h GLU 26 Cb 0.00 0.00 -0.41 0.00 0.50 0.00 0.00 28.75 28.84 2uwl h GLU 26 CO 0.00 0.23 -1.01 0.00 -1.00 0.00 0.00 179.01 177.23 2uwl n PRO 28 N -0.14 0.14 0.00 0.00 -0.04 -1.26 -2.10 135.00 131.61 2uwl n PRO 28 Ca 0.23 0.32 0.14 0.00 -0.04 0.00 0.00 63.50 64.15 2uwl n PRO 28 Cb 0.70 -1.75 0.55 0.00 -0.04 0.00 0.00 33.50 32.96 2uwl n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 2uwl n TRP 29 N -2.01 0.00 -2.21 0.54 2.14 -1.04 -1.40 117.44 113.46 2uwl n TRP 29 Ca 0.03 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.19 2uwl n TRP 29 Cb 0.25 -0.02 -0.03 0.00 -0.81 0.00 0.00 31.31 30.71 2uwl n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 2uwl s GLN 30 N -2.06 4.37 0.26 -2.67 2.00 -0.89 -0.30 119.66 120.37 2uwl s GLN 30 Ca 0.37 2.05 0.11 0.00 -2.00 0.00 0.00 55.36 55.90 2uwl s GLN 30 Cb 0.21 -3.21 -0.05 0.00 0.80 0.00 0.00 33.01 30.76 2uwl s GLN 30 CO 0.36 -0.30 -0.20 0.00 -0.50 0.00 0.00 175.29 174.65 2uwl s ALA 31 N 0.39 2.63 -0.08 1.58 0.00 -0.03 -4.44 121.76 121.80 2uwl s ALA 31 Ca 0.59 -1.82 0.00 0.00 0.00 0.00 0.00 51.96 50.73 2uwl s ALA 31 Cb -0.36 -0.25 0.02 0.00 0.00 0.00 0.00 23.12 22.53 2uwl s ALA 31 CO 0.36 0.28 -0.06 -1.17 0.00 0.00 0.00 175.76 175.16 2uwl s LEU 32 N -3.37 1.18 -0.05 0.00 2.96 -0.30 -1.03 118.68 118.07 2uwl s LEU 32 Ca 0.28 -0.23 -0.24 0.00 -0.22 0.00 0.00 54.13 53.72 2uwl s LEU 32 Cb -0.05 -0.69 -0.04 0.00 0.50 0.00 0.00 46.19 45.92 2uwl s LEU 32 CO 0.13 -0.09 0.72 -0.76 -1.32 0.00 0.00 176.35 175.03 2uwl s LEU 33 N 1.41 4.33 -0.06 -0.68 1.43 0.23 -0.65 118.68 124.69 2uwl s LEU 33 Ca -0.02 1.24 0.05 0.00 -1.03 0.00 0.00 54.13 54.37 2uwl s LEU 33 Cb -0.13 -3.12 -0.01 0.00 0.03 0.00 0.00 46.19 42.95 2uwl s LEU 33 CO -0.04 -0.11 -0.22 0.27 0.23 0.00 0.00 176.35 176.48 2uwl s ILE 34 N 0.73 1.80 0.31 -0.59 -4.36 -0.59 -1.56 121.20 116.94 2uwl s ILE 34 Ca 0.38 -0.92 -0.05 0.00 -0.26 0.00 0.00 60.65 59.80 2uwl s ILE 34 Cb -0.18 -1.54 0.07 0.00 1.25 0.00 0.00 42.46 42.06 2uwl s ILE 34 CO 0.19 0.51 0.43 -0.46 0.24 0.00 0.00 174.94 175.84 2uwl n ASN 35 N 3.10 0.04 0.28 4.36 0.23 -0.37 -1.80 115.26 121.11 2uwl n ASN 35 Ca -0.18 -1.16 0.14 0.00 -0.53 0.00 0.00 54.58 52.84 2uwl n ASN 35 Cb 0.52 -0.33 0.82 0.00 -2.08 0.00 0.00 39.78 38.72 2uwl n ASN 35 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 2uwl h GLU 36 N 0.00 0.00 -0.22 -3.83 5.08 -1.90 -0.03 114.58 113.67 2uwl h GLU 36 Ca -0.14 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.22 2uwl h GLU 36 Cb 0.38 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.63 2uwl h GLU 36 CO 0.10 0.06 0.00 0.39 -1.00 0.00 0.00 179.01 178.55 2uwl n GLU 37 N -3.81 1.51 -2.36 2.33 1.02 -1.26 -4.91 120.64 113.16 2uwl n GLU 37 Ca -0.02 -0.78 -0.18 0.00 -0.02 0.00 0.00 57.16 56.15 2uwl n GLU 37 Cb 0.15 -1.17 -0.01 0.00 -0.02 0.00 0.00 31.44 30.38 2uwl n GLU 37 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2uwl n ASN 38 N 0.14 -5.25 -4.69 1.62 3.02 -0.03 -5.00 115.26 105.06 2uwl n ASN 38 Ca 0.07 0.07 -0.35 0.00 -0.03 0.00 0.00 54.58 54.35 2uwl n ASN 38 Cb 0.19 -4.41 -0.09 0.00 -0.61 0.00 0.00 39.78 34.86 2uwl n ASN 38 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2uwl s GLU 39 N -4.95 3.87 0.17 3.52 2.02 -1.26 -4.85 118.70 117.22 2uwl s GLU 39 Ca 0.00 -0.29 -0.31 0.00 0.02 0.00 0.00 54.97 54.39 2uwl s GLU 39 Cb 0.00 -3.22 -0.09 0.00 0.10 0.00 0.00 34.13 30.92 2uwl s GLU 39 CO 0.00 0.38 1.48 0.20 0.02 0.00 0.00 175.26 177.34 2uwl s GLY 40 N 0.08 1.87 0.00 -1.39 0.00 -1.26 -1.23 107.32 105.39 2uwl s GLY 40 Ca 0.07 1.27 0.00 0.00 0.00 0.00 0.00 44.72 46.06 2uwl s GLY 40 CO 0.00 2.45 0.14 1.97 0.00 0.00 0.00 173.10 177.66 2uwl n PHE 41 N 3.58 0.00 -3.51 1.90 1.16 -0.60 -4.94 117.46 115.04 2uwl n PHE 41 Ca 0.11 0.00 -0.11 0.00 -1.87 0.00 0.00 57.45 55.59 2uwl n PHE 41 Cb 0.40 0.00 -0.03 0.00 -1.61 0.00 0.00 39.48 38.24 2uwl n PHE 41 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2uwl s GLY 43 N -2.03 1.74 0.29 0.00 0.00 0.92 -0.60 107.32 107.64 2uwl s GLY 43 Ca 0.01 -2.07 -0.18 0.00 0.00 0.00 0.00 44.72 42.48 2uwl s GLY 43 CO -0.05 -1.60 0.69 -0.32 0.00 0.00 0.00 173.10 171.83 2uwl s GLY 44 N -4.67 0.12 -0.11 0.20 0.00 -0.19 -3.59 107.32 99.08 2uwl s GLY 44 Ca 0.62 -0.50 0.04 0.00 0.00 0.00 0.00 44.72 44.88 2uwl s GLY 44 CO 0.40 -0.23 -0.23 -1.59 0.00 0.00 0.00 173.10 171.45 2uwl s THR 45 N -3.66 2.11 -0.05 0.90 2.01 0.13 -0.85 115.64 116.22 2uwl s THR 45 Ca 0.14 -1.00 -0.30 0.00 0.31 0.00 0.00 61.69 60.85 2uwl s THR 45 Cb -0.05 -1.81 -0.05 0.00 0.01 0.00 0.00 72.50 70.60 2uwl s THR 45 CO 0.08 0.56 1.50 -0.63 -0.69 0.00 0.00 174.62 175.44 2uwl s ILE 46 N 0.43 3.73 -0.15 1.82 1.01 0.59 -0.40 121.20 128.24 2uwl s ILE 46 Ca -0.16 0.98 0.18 0.00 0.00 0.00 0.00 60.65 61.65 2uwl s ILE 46 Cb -0.17 -3.63 -0.25 0.00 0.01 0.00 0.00 42.46 38.41 2uwl s ILE 46 CO 0.07 -0.06 0.16 0.18 0.00 0.00 0.00 174.94 175.29 2uwl n LEU 47 N 6.40 0.00 0.00 2.97 4.77 0.07 -1.97 117.00 129.24 2uwl n LEU 47 Ca 0.15 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 56.12 2uwl n LEU 47 Cb 0.43 0.35 0.01 0.00 -2.33 0.00 0.00 43.42 41.89 2uwl n LEU 47 CO 0.60 0.35 0.64 -1.54 -1.33 0.00 0.00 177.39 176.10 2uwl n SER 48 N -2.58 -1.14 0.24 -1.43 3.41 -1.12 -4.73 113.62 106.27 2uwl n SER 48 Ca -0.24 -1.52 0.08 0.00 -0.26 0.00 0.00 58.87 56.93 2uwl n SER 48 Cb 0.97 1.83 0.58 0.00 -0.26 0.00 0.00 64.21 67.32 2uwl n SER 48 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 175.04 175.93 2uwl h GLU 49 N 0.00 0.00 -0.00 4.33 4.11 -1.98 -3.07 114.58 117.96 2uwl h GLU 49 Ca -0.18 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.25 2uwl h GLU 49 Cb 0.85 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.10 2uwl h GLU 49 CO 0.25 0.18 -0.78 1.19 0.07 0.00 0.00 179.01 179.92 2uwl n PHE 50 N -4.01 0.00 -4.44 2.06 3.72 -1.26 -0.05 117.46 113.47 2uwl n PHE 50 Ca -0.02 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.17 2uwl n PHE 50 Cb 0.26 0.00 -0.15 0.00 -0.94 0.00 0.00 39.48 38.65 2uwl n PHE 50 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 176.76 177.42 2uwl s TYR 51 N -2.66 1.01 -0.06 1.38 2.02 -1.16 -0.74 117.35 117.15 2uwl s TYR 51 Ca 0.10 -0.25 0.04 0.00 -0.37 0.00 0.00 57.07 56.59 2uwl s TYR 51 Cb 0.15 -0.71 -0.02 0.00 -0.40 0.00 0.00 41.96 40.98 2uwl s TYR 51 CO 0.71 -0.09 -0.18 0.42 -1.57 0.00 0.00 175.55 174.84 2uwl s ILE 52 N 0.10 2.68 -0.12 2.71 -1.09 -0.44 -0.75 121.20 124.29 2uwl s ILE 52 Ca -0.02 -0.85 -0.14 0.00 -2.23 0.00 0.00 60.65 57.41 2uwl s ILE 52 Cb -0.08 -2.03 -0.05 0.00 -1.58 0.00 0.00 42.46 38.73 2uwl s ILE 52 CO 0.00 0.58 0.33 -0.22 -1.23 0.00 0.00 174.94 174.40 2uwl s LEU 53 N -0.46 4.31 0.00 2.97 2.96 0.47 -0.45 118.68 128.47 2uwl s LEU 53 Ca 0.05 0.64 -0.00 0.00 -0.22 0.00 0.00 54.13 54.60 2uwl s LEU 53 Cb -0.12 -2.44 0.00 0.00 0.50 0.00 0.00 46.19 44.14 2uwl s LEU 53 CO 0.01 0.16 0.28 1.07 -1.32 0.00 0.00 176.35 176.55 2uwl n THR 54 N 3.10 0.00 -3.31 3.68 5.66 0.53 -0.69 114.28 123.25 2uwl n THR 54 Ca -0.12 -1.18 -0.38 0.00 -3.05 0.00 0.00 64.05 59.31 2uwl n THR 54 Cb 0.52 0.70 -0.06 0.00 -1.55 0.00 0.00 70.33 69.94 2uwl n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2uwl s ALA 55 N -2.42 3.60 0.32 1.79 0.00 -1.26 -0.92 121.76 122.87 2uwl s ALA 55 Ca 0.19 -0.01 0.00 0.00 0.00 0.00 0.00 51.96 52.14 2uwl s ALA 55 Cb -0.00 -2.60 0.53 0.00 0.00 0.00 0.00 23.12 21.05 2uwl s ALA 55 CO 0.14 0.39 1.96 0.00 0.00 0.00 0.00 175.76 178.24 2uwl h ALA 56 N 4.70 1.44 0.00 0.00 0.00 -1.71 -2.46 119.26 121.24 2uwl h ALA 56 Ca -0.49 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.32 2uwl h ALA 56 Cb 1.21 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 2uwl h ALA 56 CO 0.64 0.48 -0.04 1.12 0.00 0.00 0.00 179.25 181.45 2uwl h HIS 57 N 0.91 0.00 0.00 0.00 2.07 -1.92 -1.81 115.15 114.40 2uwl h HIS 57 Ca 0.24 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.74 2uwl h HIS 57 Cb -0.02 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 29.96 2uwl h HIS 57 CO 0.00 0.04 -0.09 0.00 -3.07 0.00 0.00 177.93 174.81 2uwl n LEU 59 N -3.29 0.00 -0.65 0.00 4.77 -0.68 -2.23 117.00 114.92 2uwl n LEU 59 Ca -0.00 0.09 0.06 0.00 -0.03 0.00 0.00 56.01 56.13 2uwl n LEU 59 Cb 0.31 -0.09 0.15 0.00 -2.33 0.00 0.00 43.42 41.46 2uwl n LEU 59 CO 0.29 -0.02 0.61 -1.22 -1.33 0.00 0.00 177.39 175.71 2uwl n TYR 60 N -1.09 0.42 0.09 -1.77 4.02 -1.10 -4.52 117.16 113.20 2uwl n TYR 60 Ca 0.15 -0.42 0.09 0.00 -0.01 0.00 0.00 57.90 57.72 2uwl n TYR 60 Cb 0.11 -0.02 0.19 0.00 -0.02 0.00 0.00 39.34 39.60 2uwl n TYR 60 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 2uwl n GLN 61 N 0.60 2.36 -3.57 -0.72 6.02 -0.95 -4.94 117.38 116.17 2uwl n GLN 61 Ca 0.12 -2.13 -0.14 0.00 -0.01 0.00 0.00 57.00 54.83 2uwl n GLN 61 Cb 0.42 -1.42 -0.06 0.00 1.02 0.00 0.00 30.24 30.20 2uwl n GLN 61 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2uwl s ALA 61 N -1.20 -1.84 0.09 -1.58 0.00 -1.26 -5.05 121.76 110.91 2uwl s ALA 61 Ca 0.33 1.60 -0.04 0.00 0.00 0.00 0.00 51.96 53.85 2uwl s ALA 61 Cb 0.19 -0.61 -0.25 0.00 0.00 0.00 0.00 23.12 22.45 2uwl s ALA 61 CO 0.25 -0.33 1.17 0.87 0.00 0.00 0.00 175.76 177.73 2uwl h LYS 62 N 3.43 0.30 -2.91 0.00 1.57 -1.92 -3.46 116.57 113.57 2uwl h LYS 62 Ca -0.25 -0.46 -0.16 0.00 -1.87 0.00 0.00 60.65 57.91 2uwl h LYS 62 Cb 1.15 0.17 -0.27 0.00 0.08 0.00 0.00 32.23 33.36 2uwl h LYS 62 CO 0.27 1.20 -0.40 0.50 -0.57 0.00 0.00 179.45 180.45 2uwl s ARG 63 N -2.77 0.30 0.11 3.15 3.52 -1.26 -5.17 118.95 116.84 2uwl s ARG 63 Ca -0.04 0.57 -0.10 0.00 -0.13 0.00 0.00 55.73 56.03 2uwl s ARG 63 Cb 0.07 -0.01 0.00 0.00 -1.56 0.00 0.00 34.95 33.46 2uwl s ARG 63 CO 0.88 -0.12 0.24 -0.59 -0.81 0.00 0.00 175.30 174.89 2uwl s PHE 64 N 0.96 0.17 0.44 5.12 -0.71 -1.26 -3.93 117.98 118.77 2uwl s PHE 64 Ca -0.07 -0.57 0.03 0.00 -1.04 0.00 0.00 56.93 55.28 2uwl s PHE 64 Cb -0.07 -0.02 -0.02 0.00 -1.21 0.00 0.00 43.02 41.69 2uwl s PHE 64 CO -0.07 -0.60 0.08 0.15 -1.34 0.00 0.00 175.22 173.44 2uwl s LYS 65 N -3.88 2.03 -0.14 1.99 1.02 -0.75 -4.52 119.74 115.48 2uwl s LYS 65 Ca 0.07 -2.26 0.02 0.00 0.02 0.00 0.00 55.97 53.83 2uwl s LYS 65 Cb 0.04 -0.94 0.01 0.00 -0.52 0.00 0.00 37.83 36.42 2uwl s LYS 65 CO -0.09 -0.43 -0.20 0.08 -0.92 0.00 0.00 175.35 173.79 2uwl s VAL 66 N -3.09 1.97 -0.13 3.17 1.01 0.45 -1.54 120.40 122.24 2uwl s VAL 66 Ca 0.18 -0.92 -0.07 0.00 0.00 0.00 0.00 61.98 61.17 2uwl s VAL 66 Cb 0.02 -1.76 -0.04 0.00 0.00 0.00 0.00 36.38 34.60 2uwl s VAL 66 CO 0.11 0.53 0.12 -0.60 0.00 0.00 0.00 175.10 175.26 2uwl s ARG 67 N 0.96 3.48 0.13 2.72 3.52 0.17 0.74 118.95 130.68 2uwl s ARG 67 Ca -0.04 -0.17 0.05 0.00 -0.13 0.00 0.00 55.73 55.44 2uwl s ARG 67 Cb -0.15 -3.17 -0.04 0.00 -1.56 0.00 0.00 34.95 30.03 2uwl s ARG 67 CO -0.05 0.71 -0.12 0.14 -0.81 0.00 0.00 175.30 175.18 2uwl s VAL 68 N -0.84 1.21 0.00 7.11 -7.23 -0.44 -1.15 120.40 119.06 2uwl s VAL 68 Ca 0.14 -1.83 0.00 0.00 -1.81 0.00 0.00 61.98 58.48 2uwl s VAL 68 Cb -0.12 -1.61 0.00 0.00 0.56 0.00 0.00 36.38 35.21 2uwl s VAL 68 CO 0.03 -0.56 0.00 0.61 -0.31 0.00 0.00 175.10 174.87 2uwl n GLY 69 N 0.26 0.81 3.70 2.32 0.00 -1.25 -1.57 105.19 109.46 2uwl n GLY 69 Ca -0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.50 2uwl n GLY 69 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2uwl s ASP 70 N -2.88 6.62 -0.02 1.61 2.15 -1.26 -4.16 116.67 118.72 2uwl s ASP 70 Ca 0.00 0.74 0.06 0.00 0.43 0.00 0.00 52.55 53.78 2uwl s ASP 70 Cb 0.00 -2.28 -0.09 0.00 -0.30 0.00 0.00 42.92 40.25 2uwl s ASP 70 CO 0.00 -0.06 0.10 0.54 -0.17 0.00 0.00 175.17 175.58 2uwl n ARG 71 N 4.09 1.10 -3.64 4.34 1.74 -1.26 -4.81 116.66 118.22 2uwl n ARG 71 Ca -0.07 -0.04 -0.27 0.00 -0.77 0.00 0.00 57.85 56.70 2uwl n ARG 71 Cb 0.51 -1.15 -0.16 0.00 -1.02 0.00 0.00 32.46 30.64 2uwl n ARG 71 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 2uwl s ASN 72 N -3.05 2.80 0.00 0.55 2.47 -1.26 -0.20 114.94 116.25 2uwl s ASN 72 Ca -0.03 -0.84 0.22 0.00 0.42 0.00 0.00 52.86 52.63 2uwl s ASN 72 Cb 0.03 -0.40 1.12 0.00 -1.45 0.00 0.00 41.25 40.55 2uwl s ASN 72 CO 0.26 -0.35 1.69 0.35 -3.72 0.00 0.00 177.10 175.32 2uwl n THR 73 N 5.18 0.29 0.44 -5.21 -2.24 -0.12 -2.72 114.28 109.90 2uwl n THR 73 Ca -0.07 0.07 0.12 0.00 -2.27 0.00 0.00 64.05 61.90 2uwl n THR 73 Cb 0.47 -0.72 0.11 0.00 -2.10 0.00 0.00 70.33 68.09 2uwl n THR 73 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2uwl h GLU 74 N 0.00 0.00 -5.22 -0.78 5.08 -1.95 -3.47 114.58 108.23 2uwl h GLU 74 Ca 0.00 0.00 -0.38 0.00 -1.00 0.00 0.00 59.36 57.98 2uwl h GLU 74 Cb 0.17 0.00 -0.19 0.00 0.50 0.00 0.00 28.75 29.23 2uwl h GLU 74 CO 0.00 0.00 -0.76 -0.65 -1.00 0.00 0.00 179.01 176.60 2uwl s GLN 75 N -3.22 0.88 -0.64 2.33 -0.21 -1.10 -5.11 119.66 112.59 2uwl s GLN 75 Ca 0.04 -1.10 -0.17 0.00 0.02 0.00 0.00 55.36 54.15 2uwl s GLN 75 Cb 0.12 -0.74 0.13 0.00 1.00 0.00 0.00 33.01 33.52 2uwl s GLN 75 CO 0.74 0.14 0.69 -1.21 -2.12 0.00 0.00 175.29 173.53 2uwl s GLU 76 N -2.36 3.16 0.10 2.91 2.02 -1.26 -4.79 118.70 118.48 2uwl s GLU 76 Ca 0.04 -1.65 0.27 0.00 0.02 0.00 0.00 54.97 53.65 2uwl s GLU 76 Cb -0.06 -4.35 0.91 0.00 0.10 0.00 0.00 34.13 30.73 2uwl s GLU 76 CO 0.02 -1.46 1.76 0.39 0.02 0.00 0.00 175.26 175.99 2uwl n GLU 77 N 5.66 0.14 0.00 1.61 1.02 -1.26 -4.94 120.64 122.87 2uwl n GLU 77 Ca -0.05 0.10 0.00 0.00 -0.02 0.00 0.00 57.16 57.20 2uwl n GLU 77 Cb 0.43 -1.65 0.00 0.00 -0.02 0.00 0.00 31.44 30.20 2uwl n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2uwl n GLY 78 N 1.40 2.19 0.06 0.62 0.00 -1.26 -4.89 105.19 103.30 2uwl n GLY 78 Ca 0.06 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.20 2uwl n GLY 78 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2uwl n GLY 79 N -2.00 -1.40 3.77 -0.02 0.00 -1.26 -4.96 105.19 99.32 2uwl n GLY 79 Ca 0.00 -0.26 -0.37 0.00 0.00 0.00 0.00 46.02 45.40 2uwl n GLY 79 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2uwl s GLU 80 N -3.14 3.64 -0.16 1.61 8.01 -1.26 -4.51 118.70 122.89 2uwl s GLU 80 Ca 0.07 1.76 -0.11 0.00 0.01 0.00 0.00 54.97 56.70 2uwl s GLU 80 Cb 0.14 -2.31 0.05 0.00 -4.31 0.00 0.00 34.13 27.71 2uwl s GLU 80 CO 0.71 -0.65 0.40 0.00 0.01 0.00 0.00 175.26 175.73 2uwl s ALA 81 N -1.59 -1.01 -0.16 5.21 0.00 -0.61 -4.99 121.76 118.61 2uwl s ALA 81 Ca 0.66 1.37 -0.08 0.00 0.00 0.00 0.00 51.96 53.91 2uwl s ALA 81 Cb -0.28 -0.83 -0.04 0.00 0.00 0.00 0.00 23.12 21.97 2uwl s ALA 81 CO 0.33 -0.24 0.13 0.08 0.00 0.00 0.00 175.76 176.06 2uwl s VAL 82 N 1.00 5.37 -0.03 0.00 1.01 -1.26 -1.33 120.40 125.17 2uwl s VAL 82 Ca -0.06 0.17 0.05 0.00 0.00 0.00 0.00 61.98 62.14 2uwl s VAL 82 Cb -0.07 -3.40 -0.01 0.00 0.00 0.00 0.00 36.38 32.90 2uwl s VAL 82 CO -0.08 0.52 -0.19 -1.00 0.00 0.00 0.00 175.10 174.34 2uwl s HIS 83 N -0.22 1.84 0.32 5.22 3.76 0.23 -4.95 115.29 121.48 2uwl s HIS 83 Ca 0.11 -0.46 -0.24 0.00 -0.15 0.00 0.00 55.06 54.31 2uwl s HIS 83 Cb -0.11 -1.21 -0.10 0.00 1.11 0.00 0.00 32.58 32.26 2uwl s HIS 83 CO 0.01 -0.12 0.91 -1.21 -0.85 0.00 0.00 174.74 173.48 2uwl s GLU 84 N -0.19 4.49 -0.03 1.40 2.02 -1.26 -0.41 118.70 124.71 2uwl s GLU 84 Ca 0.01 1.23 -0.23 0.00 0.02 0.00 0.00 54.97 56.00 2uwl s GLU 84 Cb -0.10 -2.73 -0.04 0.00 0.10 0.00 0.00 34.13 31.36 2uwl s GLU 84 CO 0.01 0.25 0.69 0.08 0.02 0.00 0.00 175.26 176.32 2uwl s VAL 85 N -1.68 4.96 -0.19 2.63 1.01 -1.26 -0.72 120.40 125.14 2uwl s VAL 85 Ca 0.51 1.44 -0.06 0.00 0.00 0.00 0.00 61.98 63.86 2uwl s VAL 85 Cb -0.17 -4.03 -0.21 0.00 0.00 0.00 0.00 36.38 31.97 2uwl s VAL 85 CO 0.22 0.31 0.07 1.21 0.00 0.00 0.00 175.10 176.91 2uwl n GLU 86 N 3.37 0.68 -3.96 2.72 2.13 0.14 -4.71 120.64 121.01 2uwl n GLU 86 Ca -0.03 0.26 -0.15 0.00 0.66 0.00 0.00 57.16 57.91 2uwl n GLU 86 Cb 0.51 -1.63 -0.15 0.00 0.27 0.00 0.00 31.44 30.44 2uwl n GLU 86 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 2uwl s VAL 87 N -2.52 0.17 -0.24 6.31 1.01 -0.84 -5.00 120.40 119.29 2uwl s VAL 87 Ca -0.29 -0.01 -0.06 0.00 0.00 0.00 0.00 61.98 61.61 2uwl s VAL 87 Cb 0.08 -0.20 -0.02 0.00 0.00 0.00 0.00 36.38 36.24 2uwl s VAL 87 CO 0.66 0.09 0.04 -0.69 0.00 0.00 0.00 175.10 175.20 2uwl s VAL 88 N 0.41 3.97 -0.38 2.92 1.01 -1.26 -0.83 120.40 126.23 2uwl s VAL 88 Ca -0.04 -0.33 -0.03 0.00 0.00 0.00 0.00 61.98 61.58 2uwl s VAL 88 Cb -0.06 -2.86 0.09 0.00 0.00 0.00 0.00 36.38 33.54 2uwl s VAL 88 CO -0.01 0.34 0.16 -0.63 0.00 0.00 0.00 175.10 174.96 2uwl s ILE 89 N 1.56 3.29 -0.08 2.22 1.01 0.55 -5.02 121.20 124.73 2uwl s ILE 89 Ca 0.06 -1.84 -0.05 0.00 0.00 0.00 0.00 60.65 58.81 2uwl s ILE 89 Cb -0.15 -3.15 -0.04 0.00 0.01 0.00 0.00 42.46 39.13 2uwl s ILE 89 CO 0.01 -0.54 0.15 -0.75 0.00 0.00 0.00 174.94 173.81 2uwl s LYS 90 N 1.19 3.42 0.17 2.79 2.20 -1.26 -0.15 119.74 128.10 2uwl s LYS 90 Ca 0.05 -0.21 -0.31 0.00 -0.36 0.00 0.00 55.97 55.14 2uwl s LYS 90 Cb -0.22 -3.14 -0.10 0.00 -1.51 0.00 0.00 37.83 32.86 2uwl s LYS 90 CO -0.03 0.74 1.55 -1.58 -0.36 0.00 0.00 175.35 175.67 2uwl s HIS 91 N -1.12 3.06 -1.22 4.03 5.65 -0.78 -4.85 115.29 120.06 2uwl s HIS 91 Ca 0.19 0.68 0.15 0.00 0.25 0.00 0.00 55.06 56.33 2uwl s HIS 91 Cb -0.12 -3.91 0.72 0.00 -1.18 0.00 0.00 32.58 28.09 2uwl s HIS 91 CO 0.09 -3.32 1.47 0.27 -0.65 0.00 0.00 174.74 172.60 2uwl n ASN 92 N 3.79 0.00 -0.86 9.88 6.94 -1.26 -2.24 115.26 131.51 2uwl n ASN 92 Ca 0.13 0.28 0.09 0.00 -0.02 0.00 0.00 54.58 55.06 2uwl n ASN 92 Cb 0.39 -0.39 0.14 0.00 -2.36 0.00 0.00 39.78 37.56 2uwl n ASN 92 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 2uwl n ARG 93 N -1.39 2.03 -1.67 -3.83 1.74 -1.26 -4.99 116.66 107.29 2uwl n ARG 93 Ca 0.06 -1.91 -0.45 0.00 -0.77 0.00 0.00 57.85 54.78 2uwl n ARG 93 Cb 0.15 -1.39 -0.03 0.00 -1.02 0.00 0.00 32.46 30.18 2uwl n ARG 93 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2uwl n PHE 94 N 1.08 2.18 -4.15 -1.55 7.35 -0.95 -4.65 117.46 116.77 2uwl n PHE 94 Ca 0.14 0.41 -0.19 0.00 -0.76 0.00 0.00 57.45 57.05 2uwl n PHE 94 Cb 0.49 -2.47 -0.16 0.00 0.35 0.00 0.00 39.48 37.69 2uwl n PHE 94 CO 0.00 0.00 0.00 -0.08 -0.76 0.00 0.00 176.76 175.92 2uwl s THR 95 N 0.08 0.49 0.02 -2.13 -1.32 -1.09 -5.03 115.64 106.65 2uwl s THR 95 Ca 0.70 -0.12 0.32 0.00 -1.21 0.00 0.00 61.69 61.37 2uwl s THR 95 Cb -0.66 -0.50 0.35 0.00 -1.51 0.00 0.00 72.50 70.18 2uwl s THR 95 CO 0.48 0.20 1.95 0.11 -2.21 0.00 0.00 174.62 175.15 2uwl h LYS 96 N 6.98 0.00 -0.05 7.08 1.57 -1.95 0.20 116.57 130.41 2uwl h LYS 96 Ca -0.38 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.23 2uwl h LYS 96 Cb 1.16 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.46 2uwl h LYS 96 CO 0.48 0.00 -0.73 0.93 -0.57 0.00 0.00 179.45 179.56 2uwl h GLU 97 N 0.00 0.27 0.00 3.15 4.39 -1.97 -3.36 114.58 117.06 2uwl h GLU 97 Ca 0.00 -0.23 0.00 0.00 0.34 0.00 0.00 59.36 59.47 2uwl h GLU 97 Cb 0.33 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.04 2uwl h GLU 97 CO 0.00 0.89 -0.20 0.25 -1.16 0.00 0.00 179.01 178.79 2uwl n THR 98 N -3.79 0.00 -1.97 1.13 -2.24 -1.14 -5.01 114.28 101.26 2uwl n THR 98 Ca -0.03 -0.24 -0.19 0.00 -2.27 0.00 0.00 64.05 61.31 2uwl n THR 98 Cb 0.71 0.80 -0.05 0.00 -2.10 0.00 0.00 70.33 69.69 2uwl n THR 98 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 2uwl n TYR 99 N -0.78 -0.46 -2.21 4.78 4.02 0.69 -4.97 117.16 118.22 2uwl n TYR 99 Ca 0.00 0.00 -0.37 0.00 -0.01 0.00 0.00 57.90 57.52 2uwl n TYR 99 Cb 0.00 -3.53 -0.00 0.00 -0.02 0.00 0.00 39.34 35.79 2uwl n TYR 99 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 2uwl s ASP 100 N -2.46 6.09 -1.36 7.72 2.15 -1.24 -3.10 116.67 124.47 2uwl s ASP 100 Ca 0.00 2.36 -0.07 0.00 0.43 0.00 0.00 52.55 55.27 2uwl s ASP 100 Cb 0.00 -2.61 0.02 0.00 -0.30 0.00 0.00 42.92 40.04 2uwl s ASP 100 CO 0.00 -0.98 1.06 0.49 -0.17 0.00 0.00 175.17 175.57 2uwl n PHE 101 N -0.51 -2.53 -2.48 -5.34 3.01 -1.26 -2.68 117.46 105.67 2uwl n PHE 101 Ca 0.07 0.96 -0.43 0.00 1.01 0.00 0.00 57.45 59.06 2uwl n PHE 101 Cb 0.48 -4.75 0.00 0.00 -0.01 0.00 0.00 39.48 35.19 2uwl n PHE 101 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 2uwl n ASP 102 N -3.00 4.82 -3.72 4.37 2.03 -1.18 -4.07 116.55 115.80 2uwl n ASP 102 Ca -0.07 -2.94 -0.13 0.00 0.52 0.00 0.00 54.79 52.17 2uwl n ASP 102 Cb 0.59 -1.66 -0.10 0.00 -0.72 0.00 0.00 41.12 39.23 2uwl n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 2uwl s ILE 103 N 3.03 0.00 -0.04 5.18 2.07 -1.26 -4.06 121.20 126.12 2uwl s ILE 103 Ca 0.49 -0.01 -0.17 0.00 -1.41 0.00 0.00 60.65 59.55 2uwl s ILE 103 Cb 0.05 -0.62 0.03 0.00 0.13 0.00 0.00 42.46 42.05 2uwl s ILE 103 CO 0.02 -0.01 0.37 0.00 -1.91 0.00 0.00 174.94 173.41 2uwl s ALA 104 N 0.17 -0.94 -0.04 1.50 0.00 -0.10 -1.86 121.76 120.49 2uwl s ALA 104 Ca -0.01 0.57 0.06 0.00 0.00 0.00 0.00 51.96 52.59 2uwl s ALA 104 Cb -0.03 -0.05 -0.02 0.00 0.00 0.00 0.00 23.12 23.03 2uwl s ALA 104 CO 0.01 -0.26 -0.24 0.08 0.00 0.00 0.00 175.76 175.35 2uwl s VAL 105 N -1.07 2.19 -0.18 0.00 1.01 0.79 -0.35 120.40 122.79 2uwl s VAL 105 Ca -0.11 -1.04 -0.06 0.00 0.00 0.00 0.00 61.98 60.78 2uwl s VAL 105 Cb -0.04 -1.79 -0.03 0.00 0.00 0.00 0.00 36.38 34.52 2uwl s VAL 105 CO 0.04 0.58 0.01 -0.76 0.00 0.00 0.00 175.10 174.97 2uwl s LEU 106 N -0.40 3.45 -0.20 3.92 1.43 0.40 -0.33 118.68 126.95 2uwl s LEU 106 Ca 0.03 -0.09 -0.13 0.00 -1.03 0.00 0.00 54.13 52.92 2uwl s LEU 106 Cb -0.12 -1.86 -0.05 0.00 0.03 0.00 0.00 46.19 44.19 2uwl s LEU 106 CO 0.01 0.12 0.26 -0.60 0.23 0.00 0.00 176.35 176.38 2uwl s ARG 107 N 0.64 4.17 0.35 1.70 3.52 -0.01 -1.32 118.95 128.00 2uwl s ARG 107 Ca 0.00 -0.03 -0.16 0.00 -0.13 0.00 0.00 55.73 55.42 2uwl s ARG 107 Cb -0.14 -3.48 -0.09 0.00 -1.56 0.00 0.00 34.95 29.68 2uwl s ARG 107 CO 0.02 0.13 0.78 -0.51 -0.81 0.00 0.00 175.30 174.90 2uwl s LEU 108 N 0.83 4.02 0.25 -0.88 1.43 0.09 0.24 118.68 124.66 2uwl s LEU 108 Ca 0.13 1.34 -0.02 0.00 -1.03 0.00 0.00 54.13 54.56 2uwl s LEU 108 Cb -0.13 -4.16 0.31 0.00 0.03 0.00 0.00 46.19 42.24 2uwl s LEU 108 CO 0.04 -0.25 1.72 0.11 0.23 0.00 0.00 176.35 178.20 2uwl h LYS 109 N 2.13 0.72 -6.06 1.70 1.57 -1.20 -3.42 116.57 112.01 2uwl h LYS 109 Ca -0.48 -0.23 -0.54 0.00 -1.87 0.00 0.00 60.65 57.52 2uwl h LYS 109 Cb 1.18 -0.06 -0.22 0.00 0.08 0.00 0.00 32.23 33.20 2uwl h LYS 109 CO 0.64 0.81 -0.82 0.95 -0.57 0.00 0.00 179.45 180.46 2uwl s THR 110 N -4.79 1.64 0.38 -0.16 -4.23 -1.26 -5.02 115.64 102.20 2uwl s THR 110 Ca -0.09 -1.46 -0.25 0.00 -1.18 0.00 0.00 61.69 58.72 2uwl s THR 110 Cb 0.14 -1.48 -0.09 0.00 1.34 0.00 0.00 72.50 72.41 2uwl s THR 110 CO 0.81 -0.03 1.05 -2.16 -0.54 0.00 0.00 174.62 173.75 2uwl s PRO 111 N -1.77 4.23 0.22 3.99 0.04 -1.26 -4.85 135.00 135.60 2uwl s PRO 111 Ca 0.06 1.52 -0.30 0.00 0.04 0.00 0.00 61.00 62.32 2uwl s PRO 111 Cb -0.10 -2.61 -0.09 0.00 0.04 0.00 0.00 34.50 31.75 2uwl s PRO 111 CO 0.04 -0.08 1.21 0.42 0.04 0.00 0.00 177.00 178.62 2uwl s ILE 112 N -1.62 3.43 -0.45 0.56 1.01 0.92 -5.00 121.20 120.06 2uwl s ILE 112 Ca 0.56 1.26 -0.22 0.00 0.00 0.00 0.00 60.65 62.25 2uwl s ILE 112 Cb -0.23 -3.80 0.03 0.00 0.01 0.00 0.00 42.46 38.47 2uwl s ILE 112 CO 0.28 0.22 0.71 -0.89 0.00 0.00 0.00 174.94 175.27 2uwl s THR 113 N -0.31 4.74 0.44 2.92 2.01 -1.26 -4.77 115.64 119.41 2uwl s THR 113 Ca 0.52 0.18 -0.24 0.00 0.31 0.00 0.00 61.69 62.46 2uwl s THR 113 Cb -0.34 -4.27 -0.08 0.00 0.01 0.00 0.00 72.50 67.82 2uwl s THR 113 CO 0.39 -0.68 1.17 -0.36 -0.69 0.00 0.00 174.62 174.44 2uwl s PHE 114 N 3.03 2.94 0.03 4.92 0.08 -1.26 -4.90 117.98 122.82 2uwl s PHE 114 Ca 0.25 1.54 -0.07 0.00 0.12 0.00 0.00 56.93 58.77 2uwl s PHE 114 Cb -0.14 -3.38 0.02 0.00 -0.57 0.00 0.00 43.02 38.96 2uwl s PHE 114 CO 0.20 -1.44 0.31 2.89 -0.10 0.00 0.00 175.22 177.08 2uwl n ARG 115 N -0.32 0.14 -1.65 0.44 1.85 -0.20 -4.99 116.66 111.93 2uwl n ARG 115 Ca 0.06 -0.36 -0.51 0.00 -1.00 0.00 0.00 57.85 56.05 2uwl n ARG 115 Cb 0.48 0.51 -0.05 0.00 -1.05 0.00 0.00 32.46 32.34 2uwl n ARG 115 CO 0.00 0.00 0.00 -0.12 -0.01 0.00 0.00 177.63 177.50 2uwl n MET 116 N -0.22 1.58 -0.99 2.89 0.00 -1.26 -0.78 117.12 118.34 2uwl n MET 116 Ca -0.00 0.57 0.00 0.00 -0.00 0.00 0.00 57.70 58.27 2uwl n MET 116 Cb 0.16 -2.29 0.00 0.00 0.00 0.00 0.00 33.22 31.10 2uwl n MET 116 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 2uwl n ASN 117 N 3.84 -4.20 -3.51 6.12 3.02 -1.26 -4.92 115.26 114.36 2uwl n ASN 117 Ca 0.20 0.00 -0.26 0.00 -0.03 0.00 0.00 54.58 54.49 2uwl n ASN 117 Cb 0.22 -1.79 -0.14 0.00 -0.61 0.00 0.00 39.78 37.47 2uwl n ASN 117 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2uwl s VAL 118 N -1.59 -0.16 0.03 2.41 1.01 0.04 -3.92 120.40 118.23 2uwl s VAL 118 Ca 0.00 -0.67 -0.23 0.00 0.00 0.00 0.00 61.98 61.08 2uwl s VAL 118 Cb 0.00 -0.97 0.05 0.00 0.00 0.00 0.00 36.38 35.47 2uwl s VAL 118 CO 0.00 -0.64 0.53 0.00 0.00 0.00 0.00 175.10 174.99 2uwl s ALA 119 N 2.17 -1.36 0.56 5.51 0.00 -0.50 -1.04 121.76 127.11 2uwl s ALA 119 Ca 0.09 0.67 -0.14 0.00 0.00 0.00 0.00 51.96 52.58 2uwl s ALA 119 Cb -0.15 0.33 -0.06 0.00 0.00 0.00 0.00 23.12 23.23 2uwl s ALA 119 CO -0.35 -0.48 1.00 -1.25 0.00 0.00 0.00 175.76 174.69 2uwl s PRO 120 N -2.25 3.80 0.34 0.00 0.04 -1.26 -2.48 135.00 133.18 2uwl s PRO 120 Ca -0.06 0.87 -0.10 0.00 0.04 0.00 0.00 61.00 61.74 2uwl s PRO 120 Cb -0.01 -2.11 -0.07 0.00 0.04 0.00 0.00 34.50 32.35 2uwl s PRO 120 CO -0.00 -0.40 0.69 0.00 0.04 0.00 0.00 177.00 177.33 2uwl s ALA 121 N -2.87 3.43 0.27 8.56 0.00 -0.83 -4.85 121.76 125.46 2uwl s ALA 121 Ca 0.57 -0.22 -0.24 0.00 0.00 0.00 0.00 51.96 52.07 2uwl s ALA 121 Cb -0.10 -2.60 -0.09 0.00 0.00 0.00 0.00 23.12 20.32 2uwl s ALA 121 CO 0.41 0.20 0.86 0.00 0.00 0.00 0.00 175.76 177.22 2uwl s LEU 123 N -1.87 4.18 0.72 0.00 1.43 -1.26 -0.57 118.68 121.31 2uwl s LEU 123 Ca 0.46 0.64 -0.07 0.00 -1.03 0.00 0.00 54.13 54.13 2uwl s LEU 123 Cb -0.19 -2.62 0.07 0.00 0.03 0.00 0.00 46.19 43.48 2uwl s LEU 123 CO 0.24 -0.09 1.03 -2.16 0.23 0.00 0.00 176.35 175.60 2uwl s PRO 124 N 1.25 2.07 0.36 1.29 0.04 -1.26 -4.99 135.00 133.76 2uwl s PRO 124 Ca 0.22 -0.32 -0.24 0.00 0.04 0.00 0.00 61.00 60.70 2uwl s PRO 124 Cb -0.15 -2.16 -0.10 0.00 0.04 0.00 0.00 34.50 32.13 2uwl s PRO 124 CO 0.09 -1.32 0.95 -1.21 0.04 0.00 0.00 177.00 175.54 2uwl s GLU 124 N -5.28 4.46 0.08 4.56 2.02 -1.26 -4.98 118.70 118.30 2uwl s GLU 124 Ca 0.61 1.26 -0.36 0.00 0.02 0.00 0.00 54.97 56.51 2uwl s GLU 124 Cb -0.10 -2.59 -0.18 0.00 0.10 0.00 0.00 34.13 31.37 2uwl s GLU 124 CO 0.45 0.17 1.57 -0.09 0.02 0.00 0.00 175.26 177.38 2uwl h ARG 125 N 2.74 -1.01 -0.39 1.61 2.43 -1.98 -0.62 114.38 117.16 2uwl h ARG 125 Ca -0.48 0.07 -0.01 0.00 -0.81 0.00 0.00 59.98 58.75 2uwl h ARG 125 Cb 1.19 0.23 -0.02 0.00 -0.42 0.00 0.00 29.97 30.95 2uwl h ARG 125 CO 0.64 -0.68 0.20 -0.44 -1.51 0.00 0.00 179.97 178.18 2uwl h ASP 126 N -1.05 0.51 -0.72 -3.80 3.32 -1.96 -1.39 116.42 111.33 2uwl h ASP 126 Ca -0.07 -0.11 0.02 0.00 0.02 0.00 0.00 57.03 56.88 2uwl h ASP 126 Cb 0.89 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 40.27 2uwl h ASP 126 CO -0.01 0.47 0.47 -0.25 -1.72 0.00 0.00 179.24 178.20 2uwl h TRP 127 N 0.50 0.88 -0.66 4.55 7.01 -1.98 -0.83 115.95 125.41 2uwl h TRP 127 Ca 0.14 0.02 -0.03 0.00 2.11 0.00 0.00 58.89 61.13 2uwl h TRP 127 Cb 0.09 -0.29 -0.03 0.00 -2.10 0.00 0.00 29.16 26.83 2uwl h TRP 127 CO -0.02 0.53 0.29 0.00 -2.79 0.00 0.00 178.44 176.46 2uwl h ALA 128 N 1.28 0.86 -0.56 2.65 0.00 -0.60 0.25 119.26 123.14 2uwl h ALA 128 Ca 0.27 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.95 2uwl h ALA 128 Cb -0.06 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.44 2uwl h ALA 128 CO -0.08 0.45 0.04 0.93 0.00 0.00 0.00 179.25 180.60 2uwl h GLU 129 N 0.93 0.92 0.00 0.00 5.08 -1.07 0.23 114.58 120.67 2uwl h GLU 129 Ca 0.22 -0.25 -0.13 0.00 -1.00 0.00 0.00 59.36 58.21 2uwl h GLU 129 Cb 0.17 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.29 2uwl h GLU 129 CO -0.02 0.88 -1.22 0.66 -1.00 0.00 0.00 179.01 178.31 2uwl h SER 130 N 0.86 0.00 0.00 1.42 4.64 -0.87 -3.37 113.55 116.23 2uwl h SER 130 Ca 0.17 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.40 2uwl h SER 130 Cb 0.45 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.52 2uwl h SER 130 CO 0.02 0.47 -1.31 0.41 -0.87 0.00 0.00 176.83 175.55 2uwl n THR 131 N -2.90 0.31 -0.07 2.95 -1.04 0.85 -4.45 114.28 109.93 2uwl n THR 131 Ca -0.07 -0.11 -0.14 0.00 -2.04 0.00 0.00 64.05 61.70 2uwl n THR 131 Cb 0.78 -0.96 -0.13 0.00 -1.82 0.00 0.00 70.33 68.20 2uwl n THR 131 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 2uwl h LEU 131 N -0.06 -0.00 0.00 -4.42 3.38 -1.12 -3.31 115.31 109.77 2uwl h LEU 131 Ca -0.13 -0.98 0.00 0.00 0.09 0.00 0.00 57.88 56.87 2uwl h LEU 131 Cb 1.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.92 2uwl h LEU 131 CO -0.04 0.99 0.00 0.23 0.09 0.00 0.00 178.44 179.71 2uwl n MET 131 N -4.62 0.49 -0.12 1.13 2.81 0.65 -1.34 117.12 116.12 2uwl n MET 131 Ca -0.10 0.04 0.11 0.00 -1.81 0.00 0.00 57.70 55.94 2uwl n MET 131 Cb 0.47 -1.50 0.16 0.00 -0.71 0.00 0.00 33.22 31.64 2uwl n MET 131 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 2uwl n THR 132 N -1.18 0.35 -1.20 2.03 -2.24 -1.26 -4.96 114.28 105.82 2uwl n THR 132 Ca 0.14 -0.67 -0.30 0.00 -2.27 0.00 0.00 64.05 60.95 2uwl n THR 132 Cb 0.15 1.13 0.14 0.00 -2.10 0.00 0.00 70.33 69.64 2uwl n THR 132 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2uwl s GLN 133 N -1.54 1.32 0.12 -0.78 -1.52 -0.45 -4.96 119.66 111.84 2uwl s GLN 133 Ca 0.33 0.86 -0.17 0.00 -1.95 0.00 0.00 55.36 54.42 2uwl s GLN 133 Cb 0.20 -1.81 -0.03 0.00 -0.22 0.00 0.00 33.01 31.14 2uwl s GLN 133 CO 0.29 -2.21 1.66 0.87 -0.25 0.00 0.00 175.29 175.65 2uwl h LYS 134 N -1.53 0.49 -4.66 2.91 1.57 -1.93 -3.43 116.57 109.99 2uwl h LYS 134 Ca -0.49 -0.09 -0.24 0.00 -1.87 0.00 0.00 60.65 57.96 2uwl h LYS 134 Cb 1.28 -0.08 -0.15 0.00 0.08 0.00 0.00 32.23 33.36 2uwl h LYS 134 CO 0.54 0.50 -0.67 0.95 -0.57 0.00 0.00 179.45 180.19 2uwl s THR 135 N -5.53 0.58 0.26 -0.16 -4.23 -1.26 -1.93 115.64 103.37 2uwl s THR 135 Ca -0.13 -1.95 0.01 0.00 -1.18 0.00 0.00 61.69 58.44 2uwl s THR 135 Cb 0.09 -1.92 -0.00 0.00 1.34 0.00 0.00 72.50 72.01 2uwl s THR 135 CO 0.74 -0.65 0.03 0.61 -0.54 0.00 0.00 174.62 174.81 2uwl n GLY 136 N -0.13 3.75 3.00 3.99 0.00 0.02 -4.72 105.19 111.10 2uwl n GLY 136 Ca -0.09 -2.19 -0.23 0.00 0.00 0.00 0.00 46.02 43.51 2uwl n GLY 136 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2uwl s ILE 137 N -2.18 0.94 0.09 -0.61 1.01 0.97 -0.09 121.20 121.34 2uwl s ILE 137 Ca 0.05 -0.39 0.09 0.00 0.00 0.00 0.00 60.65 60.41 2uwl s ILE 137 Cb 0.00 -0.87 -0.04 0.00 0.01 0.00 0.00 42.46 41.57 2uwl s ILE 137 CO 0.03 0.31 -0.23 0.54 0.00 0.00 0.00 174.94 175.59 2uwl s VAL 138 N 0.59 2.49 0.03 2.92 0.11 -0.04 -0.89 120.40 125.61 2uwl s VAL 138 Ca -0.11 -1.52 -0.06 0.00 -2.93 0.00 0.00 61.98 57.36 2uwl s VAL 138 Cb -0.14 -2.08 -0.01 0.00 -1.53 0.00 0.00 36.38 32.62 2uwl s VAL 138 CO 0.02 0.19 0.11 -0.94 -3.33 0.00 0.00 175.10 171.15 2uwl s SER 139 N -1.82 0.14 0.00 3.54 1.04 -1.17 -1.07 113.70 114.36 2uwl s SER 139 Ca 0.15 -0.46 0.00 0.00 0.48 0.00 0.00 55.95 56.12 2uwl s SER 139 Cb -0.10 0.22 0.00 0.00 0.10 0.00 0.00 66.02 66.24 2uwl s SER 139 CO 0.06 -0.48 0.00 0.61 0.98 0.00 0.00 173.24 174.41 2uwl n GLY 140 N 0.92 -1.90 1.06 7.32 0.00 0.20 -4.35 105.19 108.45 2uwl n GLY 140 Ca -0.20 -1.14 0.09 0.00 0.00 0.00 0.00 46.02 44.76 2uwl n GLY 140 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2uwl n PHE 141 N -0.06 0.83 -0.78 1.61 3.72 -1.26 -1.61 117.46 119.91 2uwl n PHE 141 Ca 0.00 -0.54 -0.09 0.00 -0.05 0.00 0.00 57.45 56.77 2uwl n PHE 141 Cb 0.00 -0.06 0.07 0.00 -0.94 0.00 0.00 39.48 38.55 2uwl n PHE 141 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2uwl n GLY 142 N 0.98 -2.30 3.75 1.37 0.00 -1.26 -1.48 105.19 106.25 2uwl n GLY 142 Ca 0.19 -1.50 -0.38 0.00 0.00 0.00 0.00 46.02 44.32 2uwl n GLY 142 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2uwl s ARG 143 N -3.77 3.20 0.00 1.61 0.52 -0.49 -2.03 118.95 118.00 2uwl s ARG 143 Ca 0.22 2.24 0.27 0.00 -0.52 0.00 0.00 55.73 57.93 2uwl s ARG 143 Cb -0.02 -2.29 0.74 0.00 0.52 0.00 0.00 34.95 33.90 2uwl s ARG 143 CO 0.16 -1.14 1.57 0.25 0.02 0.00 0.00 175.30 176.16 2uwl n THR 144 N -0.94 0.00 -3.53 0.02 -2.24 -1.24 -1.51 114.28 104.84 2uwl n THR 144 Ca 0.10 -0.29 -0.17 0.00 -2.27 0.00 0.00 64.05 61.42 2uwl n THR 144 Cb 0.45 0.75 -0.06 0.00 -2.10 0.00 0.00 70.33 69.37 2uwl n THR 144 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2uwl s HIS 145 N -2.11 -0.59 0.29 4.78 3.76 -1.26 -4.42 115.29 115.73 2uwl s HIS 145 Ca 0.32 0.93 0.02 0.00 -0.15 0.00 0.00 55.06 56.18 2uwl s HIS 145 Cb 0.20 0.40 0.71 0.00 1.11 0.00 0.00 32.58 35.00 2uwl s HIS 145 CO 0.37 -0.62 1.66 1.49 -0.85 0.00 0.00 174.74 176.79 2uwl h GLU 147 N 2.93 0.26 -0.02 1.40 4.81 -1.89 -1.98 114.58 120.09 2uwl h GLU 147 Ca -0.28 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.93 2uwl h GLU 147 Cb 1.17 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.49 2uwl h GLU 147 CO 0.39 0.17 -0.19 1.63 -0.73 0.00 0.00 179.01 180.28 2uwl n LYS 148 N -5.17 1.56 -0.17 1.92 5.02 -1.26 -4.94 118.16 115.13 2uwl n LYS 148 Ca 0.21 -1.16 0.00 0.00 -2.02 0.00 0.00 58.31 55.34 2uwl n LYS 148 Cb 0.67 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 34.20 2uwl n LYS 148 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2uwl n GLY 149 N 1.33 -0.21 3.97 0.72 0.00 -0.74 -5.11 105.19 105.15 2uwl n GLY 149 Ca 0.13 -1.77 -0.21 0.00 0.00 0.00 0.00 46.02 44.17 2uwl n GLY 149 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2uwl s ARG 150 N -1.39 3.07 0.65 1.61 1.70 -1.26 -4.91 118.95 118.42 2uwl s ARG 150 Ca 0.00 -0.72 -0.18 0.00 -0.47 0.00 0.00 55.73 54.37 2uwl s ARG 150 Cb 0.00 -2.67 -0.01 0.00 -0.57 0.00 0.00 34.95 31.71 2uwl s ARG 150 CO 0.00 -0.14 1.25 -0.65 -1.08 0.00 0.00 175.30 174.68 2uwl s GLN 151 N -4.40 2.57 0.27 3.89 -0.21 -1.26 -3.60 119.66 116.92 2uwl s GLN 151 Ca 0.47 1.94 -0.30 0.00 0.02 0.00 0.00 55.36 57.50 2uwl s GLN 151 Cb -0.10 -1.86 -0.09 0.00 1.00 0.00 0.00 33.01 31.95 2uwl s GLN 151 CO 0.35 -1.55 1.07 0.45 -2.12 0.00 0.00 175.29 173.49 2uwl s SER 152 N -1.58 7.35 0.00 5.90 0.15 -0.55 -4.88 113.70 120.09 2uwl s SER 152 Ca 0.80 2.20 0.27 0.00 0.70 0.00 0.00 55.95 59.92 2uwl s SER 152 Cb -0.34 -2.62 0.87 0.00 -1.71 0.00 0.00 66.02 62.22 2uwl s SER 152 CO 0.39 -0.08 1.65 0.35 1.20 0.00 0.00 173.24 176.75 2uwl n THR 153 N 1.25 0.00 -4.56 6.45 -2.24 -1.26 -4.76 114.28 109.16 2uwl n THR 153 Ca -0.01 -0.05 -0.34 0.00 -2.27 0.00 0.00 64.05 61.38 2uwl n THR 153 Cb 0.45 0.08 -0.12 0.00 -2.10 0.00 0.00 70.33 68.65 2uwl n THR 153 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2uwl s ARG 154 N -2.73 3.07 0.12 -0.78 1.81 -1.26 -0.94 118.95 118.24 2uwl s ARG 154 Ca 0.20 -0.54 -0.31 0.00 -1.72 0.00 0.00 55.73 53.35 2uwl s ARG 154 Cb 0.19 -2.70 -0.09 0.00 -0.45 0.00 0.00 34.95 31.90 2uwl s ARG 154 CO 0.57 0.52 1.61 -1.17 -0.68 0.00 0.00 175.30 176.15 2uwl s LEU 155 N -0.40 4.37 0.22 2.53 2.96 0.72 -4.67 118.68 124.41 2uwl s LEU 155 Ca 0.06 2.56 0.11 0.00 -0.22 0.00 0.00 54.13 56.63 2uwl s LEU 155 Cb -0.12 -3.58 -0.05 0.00 0.50 0.00 0.00 46.19 42.94 2uwl s LEU 155 CO 0.02 -0.86 -0.17 -0.54 -1.32 0.00 0.00 176.35 173.49 2uwl s LYS 156 N 1.87 1.78 0.13 1.98 1.02 -0.63 -0.55 119.74 125.34 2uwl s LYS 156 Ca 0.72 -1.51 0.03 0.00 0.02 0.00 0.00 55.97 55.23 2uwl s LYS 156 Cb -0.42 -1.94 -0.04 0.00 -0.52 0.00 0.00 37.83 34.91 2uwl s LYS 156 CO 0.32 0.39 -0.09 0.00 -0.92 0.00 0.00 175.35 175.05 2uwl s MET 157 N -3.04 0.97 -0.18 1.68 0.23 0.41 -0.63 119.30 118.75 2uwl s MET 157 Ca 0.25 -1.40 -0.09 0.00 -1.03 0.00 0.00 55.69 53.42 2uwl s MET 157 Cb -0.07 -0.47 0.06 0.00 -1.53 0.00 0.00 34.83 32.82 2uwl s MET 157 CO 0.14 0.04 0.43 -1.17 -2.03 0.00 0.00 175.02 172.43 2uwl s LEU 158 N -3.09 -0.22 -0.01 0.18 2.96 -0.23 -1.02 118.68 117.25 2uwl s LEU 158 Ca 0.14 0.94 -0.30 0.00 -0.22 0.00 0.00 54.13 54.70 2uwl s LEU 158 Cb 0.03 1.41 -0.05 0.00 0.50 0.00 0.00 46.19 48.08 2uwl s LEU 158 CO -0.01 -0.20 1.35 -1.61 -1.32 0.00 0.00 176.35 174.55 2uwl s GLU 159 N 1.58 4.30 -0.16 1.98 2.02 -1.26 -0.86 118.70 126.29 2uwl s GLU 159 Ca -0.09 1.90 0.00 0.00 0.02 0.00 0.00 54.97 56.81 2uwl s GLU 159 Cb -0.09 -3.55 0.03 0.00 0.10 0.00 0.00 34.13 30.62 2uwl s GLU 159 CO -0.13 -0.53 -0.13 0.14 0.02 0.00 0.00 175.26 174.63 2uwl s VAL 160 N 2.27 1.57 0.44 2.63 -7.23 0.88 -4.97 120.40 115.99 2uwl s VAL 160 Ca 0.62 -0.74 -0.25 0.00 -1.81 0.00 0.00 61.98 59.79 2uwl s VAL 160 Cb -0.30 -1.54 -0.09 0.00 0.56 0.00 0.00 36.38 35.01 2uwl s VAL 160 CO 0.26 0.36 1.37 -2.65 -0.31 0.00 0.00 175.10 174.13 2uwl n PRO 161 N 4.75 2.14 -2.16 4.82 -0.02 -1.26 -0.80 135.00 142.48 2uwl n PRO 161 Ca -0.16 0.76 -0.41 0.00 -2.02 0.00 0.00 63.50 61.67 2uwl n PRO 161 Cb 0.49 -2.53 -0.02 0.00 -0.02 0.00 0.00 33.50 31.41 2uwl n PRO 161 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 2uwl s TYR 162 N -1.19 3.12 -0.16 6.00 2.02 -0.81 -0.96 117.35 125.36 2uwl s TYR 162 Ca 0.61 1.40 -0.03 0.00 -0.37 0.00 0.00 57.07 58.68 2uwl s TYR 162 Cb -0.47 -3.64 -0.02 0.00 -0.40 0.00 0.00 41.96 37.42 2uwl s TYR 162 CO 0.58 -1.77 -0.04 0.08 -1.57 0.00 0.00 175.55 172.83 2uwl s VAL 163 N -0.96 3.80 -0.12 0.71 1.01 -0.83 -4.87 120.40 119.13 2uwl s VAL 163 Ca 0.50 -0.39 -0.40 0.00 0.00 0.00 0.00 61.98 61.69 2uwl s VAL 163 Cb -0.39 -2.67 -0.19 0.00 0.00 0.00 0.00 36.38 33.13 2uwl s VAL 163 CO 0.50 0.49 1.15 -0.67 0.00 0.00 0.00 175.10 176.57 2uwl n ASP 164 N 3.66 0.28 -0.30 3.32 2.03 -1.26 -4.55 116.55 119.73 2uwl n ASP 164 Ca -0.17 1.12 -0.04 0.00 0.52 0.00 0.00 54.79 56.22 2uwl n ASP 164 Cb 0.52 -0.87 0.08 0.00 -0.72 0.00 0.00 41.12 40.13 2uwl n ASP 164 CO 0.00 0.00 0.00 -0.09 -1.92 0.00 0.00 177.20 175.19 2uwl h ARG 165 N 3.36 1.10 0.03 -0.67 2.43 -1.97 -1.48 114.38 117.18 2uwl h ARG 165 Ca -0.47 -0.08 -0.00 0.00 -0.81 0.00 0.00 59.98 58.61 2uwl h ARG 165 Cb 1.36 -0.24 0.00 0.00 -0.42 0.00 0.00 29.97 30.67 2uwl h ARG 165 CO 0.70 0.75 -0.01 -0.97 -1.51 0.00 0.00 179.97 178.93 2uwl h ASN 166 N 1.13 -0.03 -0.90 -3.80 -1.24 -2.00 -1.82 115.58 106.91 2uwl h ASN 166 Ca 0.30 -0.02 0.04 0.00 0.71 0.00 0.00 56.30 57.33 2uwl h ASN 166 Cb -0.09 0.01 -0.05 0.00 0.73 0.00 0.00 38.32 38.91 2uwl h ASN 166 CO -0.06 -0.00 0.58 0.28 -1.29 0.00 0.00 177.43 176.94 2uwl h SER 167 N -0.06 0.97 -0.57 1.15 0.02 -1.86 0.18 113.55 113.37 2uwl h SER 167 Ca -0.00 -0.01 -0.05 0.00 -0.84 0.00 0.00 61.79 60.89 2uwl h SER 167 Cb 0.05 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.35 2uwl h SER 167 CO 0.01 0.66 0.16 0.00 -1.14 0.00 0.00 176.83 176.52 2uwl h LYS 169 N 0.82 1.01 -0.47 0.00 1.57 -0.35 -2.36 116.57 116.79 2uwl h LYS 169 Ca 0.18 -0.38 0.06 0.00 -1.87 0.00 0.00 60.65 58.65 2uwl h LYS 169 Cb 0.31 -0.06 -0.05 0.00 0.08 0.00 0.00 32.23 32.50 2uwl h LYS 169 CO -0.00 1.06 0.16 -0.07 -0.57 0.00 0.00 179.45 180.03 2uwl h LEU 170 N 0.89 0.16 -1.45 2.94 3.38 -0.39 -2.73 115.31 118.09 2uwl h LEU 170 Ca 0.14 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.17 2uwl h LEU 170 Cb 0.68 0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.47 2uwl h LEU 170 CO 0.05 0.12 0.00 0.77 0.09 0.00 0.00 178.44 179.47 2uwl h SER 171 N 0.33 0.00 -2.84 -0.43 4.64 -0.59 -3.46 113.55 111.20 2uwl h SER 171 Ca 0.22 0.00 -0.67 0.00 -0.47 0.00 0.00 61.79 60.87 2uwl h SER 171 Cb 0.23 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 62.23 2uwl h SER 171 CO -0.23 0.00 -0.52 -0.55 -0.87 0.00 0.00 176.83 174.66 2uwl s SER 172 N -5.18 6.08 0.03 4.97 0.15 -0.93 -4.83 113.70 113.98 2uwl s SER 172 Ca 0.01 0.37 0.26 0.00 0.70 0.00 0.00 55.95 57.29 2uwl s SER 172 Cb 0.09 -1.92 0.67 0.00 -1.71 0.00 0.00 66.02 63.16 2uwl s SER 172 CO 0.47 0.39 1.54 -1.20 1.20 0.00 0.00 173.24 175.64 2uwl n SER 173 N 2.08 0.42 -4.32 5.45 7.64 -1.26 -4.84 113.62 118.80 2uwl n SER 173 Ca -0.19 0.02 -0.24 0.00 1.01 0.00 0.00 58.87 59.47 2uwl n SER 173 Cb 0.55 0.02 -0.12 0.00 -1.01 0.00 0.00 64.21 63.64 2uwl n SER 173 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 2uwl s PHE 174 N -3.03 1.87 0.21 1.43 0.40 -1.26 -5.10 117.98 112.50 2uwl s PHE 174 Ca 0.11 -0.43 -0.32 0.00 -0.60 0.00 0.00 56.93 55.69 2uwl s PHE 174 Cb 0.17 -0.99 -0.12 0.00 0.51 0.00 0.00 43.02 42.59 2uwl s PHE 174 CO 0.66 0.27 1.72 -1.50 0.70 0.00 0.00 175.22 177.06 2uwl s ILE 175 N -1.43 2.04 -0.43 0.64 2.07 -1.26 -4.98 121.20 117.85 2uwl s ILE 175 Ca 0.10 0.03 -0.16 0.00 -1.41 0.00 0.00 60.65 59.22 2uwl s ILE 175 Cb -0.09 -3.02 0.03 0.00 0.13 0.00 0.00 42.46 39.52 2uwl s ILE 175 CO 0.05 0.00 0.39 -0.63 -1.91 0.00 0.00 174.94 172.85 2uwl s ILE 176 N 1.15 5.17 0.78 2.00 -1.09 -1.26 -5.04 121.20 122.90 2uwl s ILE 176 Ca 0.74 -0.63 -0.07 0.00 -2.23 0.00 0.00 60.65 58.47 2uwl s ILE 176 Cb -0.50 -4.03 0.13 0.00 -1.58 0.00 0.00 42.46 36.48 2uwl s ILE 176 CO 0.32 -0.44 1.09 0.42 -1.23 0.00 0.00 174.94 175.10 2uwl s THR 177 N 1.90 2.15 -1.48 2.92 -4.23 -1.26 -4.95 115.64 110.69 2uwl s THR 177 Ca 0.08 -0.34 0.21 0.00 -1.18 0.00 0.00 61.69 60.46 2uwl s THR 177 Cb -0.19 -2.81 0.39 0.00 1.34 0.00 0.00 72.50 71.23 2uwl s THR 177 CO 0.11 0.00 1.69 0.00 -0.54 0.00 0.00 174.62 175.87 2uwl n GLN 178 N -3.11 0.34 -0.45 3.99 6.02 -1.26 -1.94 117.38 120.97 2uwl n GLN 178 Ca 0.13 0.08 0.07 0.00 -0.01 0.00 0.00 57.00 57.27 2uwl n GLN 178 Cb 0.60 -1.50 0.26 0.00 1.02 0.00 0.00 30.24 30.62 2uwl n GLN 178 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2uwl n ASN 179 N -1.26 3.57 -4.11 1.08 3.02 -1.26 -4.90 115.26 111.40 2uwl n ASN 179 Ca 0.11 -2.32 -0.11 0.00 -0.03 0.00 0.00 54.58 52.23 2uwl n ASN 179 Cb 0.16 -0.49 -0.11 0.00 -0.61 0.00 0.00 39.78 38.74 2uwl n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 2uwl s MET 180 N -1.75 0.67 0.21 3.52 -1.94 -0.82 -0.83 119.30 118.36 2uwl s MET 180 Ca 0.37 -1.07 -0.01 0.00 -1.71 0.00 0.00 55.69 53.27 2uwl s MET 180 Cb 0.24 -0.19 -0.04 0.00 2.01 0.00 0.00 34.83 36.85 2uwl s MET 180 CO 0.18 -0.00 0.14 -0.59 -0.01 0.00 0.00 175.02 174.74 2uwl s PHE 181 N -2.69 1.18 0.03 -0.03 -0.12 -0.66 -4.77 117.98 110.92 2uwl s PHE 181 Ca 0.02 -1.39 0.08 0.00 -0.05 0.00 0.00 56.93 55.59 2uwl s PHE 181 Cb -0.01 -0.56 -0.03 0.00 -0.63 0.00 0.00 43.02 41.79 2uwl s PHE 181 CO -0.03 -0.65 -0.23 0.00 -0.05 0.00 0.00 175.22 174.26 2uwl s ALA 183 N -0.82 -0.43 0.00 0.00 0.00 -0.18 -1.96 121.76 118.36 2uwl s ALA 183 Ca 0.13 -0.30 0.00 0.00 0.00 0.00 0.00 51.96 51.79 2uwl s ALA 183 Cb -0.10 0.38 0.00 0.00 0.00 0.00 0.00 23.12 23.39 2uwl s ALA 183 CO 0.03 -0.43 0.00 0.41 0.00 0.00 0.00 175.76 175.76 2uwl n GLY 184 N 0.38 0.14 2.94 0.00 0.00 -0.14 -0.64 105.19 107.88 2uwl n GLY 184 Ca -0.17 -1.68 -0.14 0.00 0.00 0.00 0.00 46.02 44.03 2uwl n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2uwl s TYR 185 N -1.18 0.30 0.04 1.61 2.02 -1.26 -4.05 117.35 114.83 2uwl s TYR 185 Ca 0.00 -0.13 -0.27 0.00 -0.37 0.00 0.00 57.07 56.30 2uwl s TYR 185 Cb 0.00 -0.19 -0.15 0.00 -0.40 0.00 0.00 41.96 41.21 2uwl s TYR 185 CO 0.00 -0.03 1.38 0.22 -1.57 0.00 0.00 175.55 175.55 2uwl h ASP 185 N 5.82 -0.84 0.00 2.29 1.82 -1.91 -3.42 116.42 120.18 2uwl h ASP 185 Ca -0.27 0.03 -0.09 0.00 -0.39 0.00 0.00 57.03 56.31 2uwl h ASP 185 Cb 1.20 0.22 -0.02 0.00 0.68 0.00 0.00 39.33 41.41 2uwl h ASP 185 CO 0.49 -0.59 -1.32 0.35 -1.61 0.00 0.00 179.24 176.56 2uwl n THR 185 N -4.74 0.33 -1.56 2.25 -2.24 -1.26 -0.93 114.28 106.12 2uwl n THR 185 Ca -0.12 -0.17 -0.44 0.00 -2.27 0.00 0.00 64.05 61.04 2uwl n THR 185 Cb 0.39 -0.81 -0.01 0.00 -2.10 0.00 0.00 70.33 67.79 2uwl n THR 185 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 2uwl n LYS 186 N -2.36 1.13 -1.62 -0.78 4.81 -1.26 -4.79 118.16 113.30 2uwl n LYS 186 Ca -0.09 0.40 -0.40 0.00 -0.87 0.00 0.00 58.31 57.35 2uwl n LYS 186 Cb 0.64 -1.74 -0.02 0.00 0.02 0.00 0.00 35.03 33.94 2uwl n LYS 186 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 2uwl n GLN 187 N 0.69 3.67 -3.67 1.64 1.13 -1.26 -4.77 117.38 114.81 2uwl n GLN 187 Ca 0.11 -2.63 -0.11 0.00 -1.94 0.00 0.00 57.00 52.43 2uwl n GLN 187 Cb 0.32 -2.89 -0.11 0.00 0.11 0.00 0.00 30.24 27.67 2uwl n GLN 187 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 2uwl s GLU 188 N 1.64 0.28 0.08 -1.09 2.02 -1.26 -4.00 118.70 116.37 2uwl s GLU 188 Ca 0.59 0.85 -0.27 0.00 0.02 0.00 0.00 54.97 56.17 2uwl s GLU 188 Cb 0.16 0.11 0.08 0.00 0.10 0.00 0.00 34.13 34.59 2uwl s GLU 188 CO -0.07 -0.23 0.96 0.34 0.02 0.00 0.00 175.26 176.28 2uwl s ASP 189 N 2.15 -0.24 1.08 -0.19 -1.08 -0.91 -4.36 116.67 113.12 2uwl s ASP 189 Ca -0.03 -0.23 -0.16 0.00 -0.52 0.00 0.00 52.55 51.61 2uwl s ASP 189 Cb -0.11 0.43 0.23 0.00 -1.46 0.00 0.00 42.92 42.00 2uwl s ASP 189 CO -0.11 -0.75 1.13 0.00 0.52 0.00 0.00 175.17 175.95 2uwl s ALA 190 N -3.16 1.01 0.05 3.66 0.00 -1.26 -0.39 121.76 121.68 2uwl s ALA 190 Ca 0.10 -0.73 -0.02 0.00 0.00 0.00 0.00 51.96 51.30 2uwl s ALA 190 Cb -0.01 -2.97 0.01 0.00 0.00 0.00 0.00 23.12 20.15 2uwl s ALA 190 CO -0.02 -3.07 0.11 0.00 0.00 0.00 0.00 175.76 172.78 2uwl s GLN 192 N -2.01 4.10 0.00 0.00 0.74 -1.26 -1.85 119.66 119.38 2uwl s GLN 192 Ca 0.02 2.60 0.00 0.00 0.05 0.00 0.00 55.36 58.03 2uwl s GLN 192 Cb -0.01 -3.00 0.00 0.00 1.10 0.00 0.00 33.01 31.11 2uwl s GLN 192 CO 0.02 -0.62 0.00 0.41 -0.55 0.00 0.00 175.29 174.55 2uwl n GLY 193 N 1.57 3.30 0.16 2.59 0.00 -1.26 -1.39 105.19 110.15 2uwl n GLY 193 Ca 0.06 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.21 2uwl n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2uwl h ASP 194 N 0.00 0.00 -3.14 1.61 3.32 -1.67 -3.30 116.42 113.24 2uwl h ASP 194 Ca 0.00 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 56.47 2uwl h ASP 194 Cb 0.00 0.00 0.12 0.00 0.22 0.00 0.00 39.33 39.67 2uwl h ASP 194 CO 0.00 0.00 0.28 -1.20 -1.72 0.00 0.00 179.24 176.60 2uwl n SER 195 N -2.58 1.77 0.00 6.45 7.64 -1.26 -1.29 113.62 124.35 2uwl n SER 195 Ca 0.04 1.09 0.00 0.00 1.01 0.00 0.00 58.87 61.01 2uwl n SER 195 Cb 0.43 -1.40 0.00 0.00 -1.01 0.00 0.00 64.21 62.23 2uwl n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2uwl n GLY 196 N 1.04 2.60 3.79 0.23 0.00 0.82 -0.06 105.19 113.61 2uwl n GLY 196 Ca 0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.80 2uwl n GLY 196 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2uwl n GLY 197 N -2.00 -1.96 3.75 -0.02 0.00 -0.42 -3.51 105.19 101.03 2uwl n GLY 197 Ca 0.00 -1.63 -0.41 0.00 0.00 0.00 0.00 46.02 43.98 2uwl n GLY 197 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2uwl s PRO 198 N -5.80 4.53 -0.17 1.61 0.02 -1.26 -1.53 135.00 132.40 2uwl s PRO 198 Ca 0.75 1.88 0.01 0.00 0.02 0.00 0.00 61.00 63.66 2uwl s PRO 198 Cb -0.04 -3.20 0.01 0.00 0.02 0.00 0.00 34.50 31.29 2uwl s PRO 198 CO 0.54 0.01 -0.19 -1.58 -0.33 0.00 0.00 177.00 175.45 2uwl s HIS 199 N -0.57 2.76 0.15 6.54 2.46 -0.69 -3.03 115.29 122.92 2uwl s HIS 199 Ca 0.49 -1.47 0.08 0.00 0.47 0.00 0.00 55.06 54.63 2uwl s HIS 199 Cb -0.33 -1.90 -0.04 0.00 -0.13 0.00 0.00 32.58 30.18 2uwl s HIS 199 CO 0.40 -0.71 -0.17 0.14 -2.47 0.00 0.00 174.74 171.92 2uwl s VAL 200 N 1.14 1.67 -0.08 0.89 -7.23 -0.06 -0.76 120.40 115.97 2uwl s VAL 200 Ca 0.01 -1.85 0.04 0.00 -1.81 0.00 0.00 61.98 58.37 2uwl s VAL 200 Cb -0.14 -1.75 0.00 0.00 0.56 0.00 0.00 36.38 35.05 2uwl s VAL 200 CO -0.08 -0.34 -0.20 -0.89 -0.31 0.00 0.00 175.10 173.28 2uwl s THR 201 N -2.05 1.73 0.00 5.32 2.01 -0.14 -0.02 115.64 122.49 2uwl s THR 201 Ca 0.13 -0.84 -0.23 0.00 0.31 0.00 0.00 61.69 61.07 2uwl s THR 201 Cb -0.06 -1.51 -0.05 0.00 0.01 0.00 0.00 72.50 70.90 2uwl s THR 201 CO 0.05 0.49 0.68 -0.60 -0.69 0.00 0.00 174.62 174.55 2uwl s ARG 202 N 0.33 4.41 -0.08 4.92 3.52 -1.26 -1.21 118.95 129.59 2uwl s ARG 202 Ca -0.14 0.89 -0.02 0.00 -0.13 0.00 0.00 55.73 56.33 2uwl s ARG 202 Cb -0.16 -3.37 0.03 0.00 -1.56 0.00 0.00 34.95 29.89 2uwl s ARG 202 CO 0.06 0.27 0.04 0.12 -0.81 0.00 0.00 175.30 174.98 2uwl s PHE 203 N 0.07 0.39 -1.31 5.12 5.36 0.49 -4.90 117.98 123.20 2uwl s PHE 203 Ca 0.35 -0.06 -0.13 0.00 -0.96 0.00 0.00 56.93 56.13 2uwl s PHE 203 Cb -0.19 -0.67 0.01 0.00 -0.34 0.00 0.00 43.02 41.83 2uwl s PHE 203 CO 0.20 -0.31 0.52 1.63 -1.46 0.00 0.00 175.22 175.80 2uwl n LYS 204 N 5.22 -1.75 -1.52 10.12 5.02 -1.26 -1.60 118.16 132.39 2uwl n LYS 204 Ca -0.05 0.31 -0.18 0.00 -2.02 0.00 0.00 58.31 56.37 2uwl n LYS 204 Cb 0.50 -3.87 -0.08 0.00 -0.02 0.00 0.00 35.03 31.56 2uwl n LYS 204 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2uwl n ASP 205 N -2.71 -5.49 -4.14 4.39 8.00 -1.26 -4.98 116.55 110.36 2uwl n ASP 205 Ca -0.21 0.44 -0.26 0.00 0.71 0.00 0.00 54.79 55.47 2uwl n ASP 205 Cb 0.64 -4.55 -0.16 0.00 -0.02 0.00 0.00 41.12 37.03 2uwl n ASP 205 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2uwl s THR 206 N -2.54 1.45 -0.20 -3.53 2.01 -0.63 -5.13 115.64 107.07 2uwl s THR 206 Ca 0.00 -0.74 -0.07 0.00 0.31 0.00 0.00 61.69 61.20 2uwl s THR 206 Cb 0.00 -1.24 -0.03 0.00 0.01 0.00 0.00 72.50 71.23 2uwl s THR 206 CO 0.00 0.42 0.05 -0.31 -0.69 0.00 0.00 174.62 174.08 2uwl s TYR 207 N -0.02 3.15 -0.09 4.92 1.51 -1.26 -0.38 117.35 125.18 2uwl s TYR 207 Ca -0.03 -0.16 0.02 0.00 -1.01 0.00 0.00 57.07 55.90 2uwl s TYR 207 Cb -0.11 -2.11 -0.02 0.00 -0.11 0.00 0.00 41.96 39.61 2uwl s TYR 207 CO 0.02 -0.05 -0.15 -0.06 -1.11 0.00 0.00 175.55 174.20 2uwl s PHE 208 N 0.79 2.72 0.05 2.71 0.08 -0.35 -2.33 117.98 121.65 2uwl s PHE 208 Ca 0.03 -0.45 -0.30 0.00 0.12 0.00 0.00 56.93 56.32 2uwl s PHE 208 Cb -0.14 -1.72 -0.09 0.00 -0.57 0.00 0.00 43.02 40.50 2uwl s PHE 208 CO 0.02 -0.04 1.84 0.08 -0.10 0.00 0.00 175.22 177.02 2uwl s VAL 209 N -0.17 2.97 0.00 -0.44 1.01 0.26 -0.97 120.40 123.06 2uwl s VAL 209 Ca -0.01 0.19 0.00 0.00 0.00 0.00 0.00 61.98 62.17 2uwl s VAL 209 Cb -0.13 -3.12 0.00 0.00 0.00 0.00 0.00 36.38 33.12 2uwl s VAL 209 CO 0.03 -0.01 0.00 0.35 0.00 0.00 0.00 175.10 175.47 2uwl n THR 210 N 5.20 0.00 -3.82 3.92 -2.24 0.06 -4.52 114.28 112.88 2uwl n THR 210 Ca 0.18 -0.12 -0.09 0.00 -2.27 0.00 0.00 64.05 61.76 2uwl n THR 210 Cb 0.40 0.61 -0.04 0.00 -2.10 0.00 0.00 70.33 69.21 2uwl n THR 210 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2uwl s GLY 211 N -1.71 0.03 -0.08 3.38 0.00 -0.49 -3.01 107.32 105.43 2uwl s GLY 211 Ca 0.00 -0.37 0.02 0.00 0.00 0.00 0.00 44.72 44.37 2uwl s GLY 211 CO 0.00 -0.28 -0.13 -0.42 0.00 0.00 0.00 173.10 172.27 2uwl s ILE 212 N -3.91 1.24 0.09 0.90 1.01 -1.07 -1.70 121.20 117.76 2uwl s ILE 212 Ca 0.12 -0.52 -0.32 0.00 0.00 0.00 0.00 60.65 59.93 2uwl s ILE 212 Cb -0.02 -1.14 -0.11 0.00 0.01 0.00 0.00 42.46 41.20 2uwl s ILE 212 CO 0.02 0.38 1.83 0.52 0.00 0.00 0.00 174.94 177.69 2uwl n VAL 213 N 3.98 0.39 0.03 2.92 0.31 -0.58 -1.00 118.33 124.37 2uwl n VAL 213 Ca -0.21 -0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.05 2uwl n VAL 213 Cb 0.52 -2.05 0.00 0.00 -0.91 0.00 0.00 33.84 31.40 2uwl n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 2uwl n SER 214 N 5.69 0.67 -3.84 4.52 2.88 -0.76 -0.13 113.62 122.65 2uwl n SER 214 Ca 0.19 0.09 -0.08 0.00 -1.33 0.00 0.00 58.87 57.74 2uwl n SER 214 Cb 0.36 -0.20 -0.03 0.00 -0.75 0.00 0.00 64.21 63.59 2uwl n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 2uwl s TRP 215 N -1.61 -0.13 0.06 0.66 1.48 -0.37 -4.86 118.94 114.16 2uwl s TRP 215 Ca 0.00 -0.29 -0.27 0.00 -1.06 0.00 0.00 56.10 54.48 2uwl s TRP 215 Cb 0.00 0.60 0.09 0.00 -1.16 0.00 0.00 33.47 33.00 2uwl s TRP 215 CO 0.00 -1.16 0.80 0.20 -4.06 0.00 0.00 176.95 172.73 2uwl s GLY 216 N -2.92 -0.50 -1.01 3.67 0.00 -1.26 -0.33 107.32 104.97 2uwl s GLY 216 Ca 0.12 0.80 -0.20 0.00 0.00 0.00 0.00 44.72 45.45 2uwl s GLY 216 CO 0.05 0.26 1.30 -0.54 0.00 0.00 0.00 173.10 174.18 2uwl s GLU 217 N -3.34 3.67 3.60 2.90 2.02 -1.26 -4.86 118.70 121.43 2uwl s GLU 217 Ca 0.04 -1.66 0.00 0.00 0.02 0.00 0.00 54.97 53.37 2uwl s GLU 217 Cb -0.01 -5.11 0.00 0.00 0.10 0.00 0.00 34.13 29.11 2uwl s GLU 217 CO -0.10 -1.94 0.00 0.41 0.02 0.00 0.00 175.26 173.65 2uwl n GLY 219 N 5.79 0.66 2.87 -1.39 0.00 -1.26 -4.61 105.19 107.25 2uwl n GLY 219 Ca 0.30 -0.76 -0.24 0.00 0.00 0.00 0.00 46.02 45.33 2uwl n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2uwl n ALA 221 N 4.67 -0.30 -1.68 0.00 0.00 -1.26 -4.67 120.51 117.27 2uwl n ALA 221 Ca -0.15 0.27 -0.36 0.00 0.00 0.00 0.00 53.44 53.21 2uwl n ALA 221 Cb 0.50 -1.86 0.05 0.00 0.00 0.00 0.00 19.45 18.14 2uwl n ALA 221 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2uwl s ARG 222 N -3.69 2.80 0.28 0.00 0.52 -1.26 -4.73 118.95 112.86 2uwl s ARG 222 Ca 0.00 1.83 -0.30 0.00 -0.52 0.00 0.00 55.73 56.74 2uwl s ARG 222 Cb 0.00 -1.91 -0.10 0.00 0.52 0.00 0.00 34.95 33.46 2uwl s ARG 222 CO 0.00 -1.34 1.43 0.15 0.02 0.00 0.00 175.30 175.56 2uwl s LYS 223 N -3.45 4.26 -1.34 3.54 1.02 -1.26 -2.01 119.74 120.49 2uwl s LYS 223 Ca 0.77 2.33 0.00 0.00 0.02 0.00 0.00 55.97 59.09 2uwl s LYS 223 Cb -0.31 -3.09 0.00 0.00 -0.52 0.00 0.00 37.83 33.92 2uwl s LYS 223 CO 0.36 -0.41 0.00 0.41 -0.92 0.00 0.00 175.35 174.79 2uwl n GLY 223 N 1.84 1.24 3.31 -3.33 0.00 -0.11 -4.99 105.19 103.15 2uwl n GLY 223 Ca 0.05 -0.07 -0.27 0.00 0.00 0.00 0.00 46.02 45.74 2uwl n GLY 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2uwl s LYS 224 N -3.01 1.39 0.36 1.61 -0.14 -0.85 -4.81 119.74 114.29 2uwl s LYS 224 Ca 0.00 -1.15 0.07 0.00 -1.36 0.00 0.00 55.97 53.54 2uwl s LYS 224 Cb 0.00 -1.66 -0.07 0.00 -1.68 0.00 0.00 37.83 34.42 2uwl s LYS 224 CO 0.00 0.41 -0.03 0.71 -0.76 0.00 0.00 175.35 175.68 2uwl s TYR 225 N -0.98 2.35 0.13 3.18 2.02 -1.26 -4.58 117.35 118.21 2uwl s TYR 225 Ca 0.10 -0.65 -0.23 0.00 -0.37 0.00 0.00 57.07 55.92 2uwl s TYR 225 Cb -0.10 -1.51 -0.07 0.00 -0.40 0.00 0.00 41.96 39.88 2uwl s TYR 225 CO 0.04 0.42 0.70 0.20 -1.57 0.00 0.00 175.55 175.33 2uwl s GLY 226 N -3.62 2.82 -0.17 0.71 0.00 0.19 -4.57 107.32 102.69 2uwl s GLY 226 Ca 0.34 0.23 -0.04 0.00 0.00 0.00 0.00 44.72 45.24 2uwl s GLY 226 CO 0.16 0.70 -0.02 -0.42 0.00 0.00 0.00 173.10 173.53 2uwl s ILE 227 N -1.14 4.05 0.01 0.90 -1.09 0.56 -1.01 121.20 123.46 2uwl s ILE 227 Ca 0.33 -0.30 0.07 0.00 -2.23 0.00 0.00 60.65 58.53 2uwl s ILE 227 Cb -0.22 -2.79 -0.02 0.00 -1.58 0.00 0.00 42.46 37.85 2uwl s ILE 227 CO 0.23 0.48 -0.22 -0.31 -1.23 0.00 0.00 174.94 173.89 2uwl s TYR 228 N 0.46 1.97 0.26 3.97 1.51 -0.18 -1.23 117.35 124.11 2uwl s TYR 228 Ca -0.02 -0.38 -0.30 0.00 -1.01 0.00 0.00 57.07 55.36 2uwl s TYR 228 Cb -0.14 -1.23 -0.11 0.00 -0.11 0.00 0.00 41.96 40.37 2uwl s TYR 228 CO 0.02 0.02 1.54 0.99 -1.11 0.00 0.00 175.55 177.01 2uwl s THR 229 N -0.62 2.34 -0.83 -0.71 2.01 -0.17 -1.65 115.64 116.00 2uwl s THR 229 Ca 0.09 0.28 -0.25 0.00 0.31 0.00 0.00 61.69 62.12 2uwl s THR 229 Cb -0.09 -3.18 0.05 0.00 0.01 0.00 0.00 72.50 69.29 2uwl s THR 229 CO 0.00 0.04 1.29 -0.75 -0.69 0.00 0.00 174.62 174.51 2uwl s LYS 230 N -0.19 3.34 0.41 4.92 2.20 -0.01 -2.59 119.74 127.82 2uwl s LYS 230 Ca 0.63 -0.68 0.07 0.00 -0.36 0.00 0.00 55.97 55.63 2uwl s LYS 230 Cb -0.45 -4.61 0.87 0.00 -1.51 0.00 0.00 37.83 32.12 2uwl s LYS 230 CO 0.44 -2.11 2.06 0.28 -0.36 0.00 0.00 175.35 175.65 2uwl h VAL 231 N 6.26 1.10 0.00 4.02 2.07 -1.86 -1.16 116.25 126.68 2uwl h VAL 231 Ca -0.10 -0.20 -0.01 0.00 0.82 0.00 0.00 66.70 67.21 2uwl h VAL 231 Cb 1.04 0.54 -0.00 0.00 -1.52 0.00 0.00 31.29 31.35 2uwl h VAL 231 CO 1.31 0.10 -0.05 0.71 0.02 0.00 0.00 177.57 179.66 2uwl h THR 232 N 0.53 0.50 0.00 2.57 1.35 -1.90 0.17 112.91 116.13 2uwl h THR 232 Ca 0.14 -0.23 0.00 0.00 -0.55 0.00 0.00 66.41 65.77 2uwl h THR 232 Cb -0.05 1.15 0.00 0.00 -1.73 0.00 0.00 68.15 67.52 2uwl h THR 232 CO -0.03 0.05 0.00 0.00 -0.25 0.00 0.00 175.52 175.29 2uwl n ALA 233 N -2.29 1.71 -0.84 6.62 0.00 -0.44 -3.60 120.51 121.68 2uwl n ALA 233 Ca -0.02 0.08 0.05 0.00 0.00 0.00 0.00 53.44 53.55 2uwl n ALA 233 Cb 0.15 -1.40 0.07 0.00 0.00 0.00 0.00 19.45 18.26 2uwl n ALA 233 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2uwl n PHE 234 N -2.27 0.00 -0.15 0.00 3.72 0.56 -4.79 117.46 114.53 2uwl n PHE 234 Ca 0.02 -0.64 -0.07 0.00 -0.05 0.00 0.00 57.45 56.71 2uwl n PHE 234 Cb 0.25 -0.09 0.09 0.00 -0.94 0.00 0.00 39.48 38.78 2uwl n PHE 234 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 2uwl h LEU 235 N 0.00 0.90 -0.49 4.37 3.38 -1.57 0.23 115.31 122.13 2uwl h LEU 235 Ca 0.00 -0.25 -0.03 0.00 0.09 0.00 0.00 57.88 57.69 2uwl h LEU 235 Cb 0.89 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.38 2uwl h LEU 235 CO 0.00 0.98 0.21 0.11 0.09 0.00 0.00 178.44 179.82 2uwl h LYS 236 N 0.84 0.73 -0.23 1.13 1.57 -1.88 -1.84 116.57 116.90 2uwl h LYS 236 Ca 0.15 -0.13 0.01 0.00 -1.87 0.00 0.00 60.65 58.82 2uwl h LYS 236 Cb 0.54 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.72 2uwl h LYS 236 CO 0.03 0.64 0.12 2.35 -0.57 0.00 0.00 179.45 182.02 2uwl h TRP 237 N 0.65 0.22 -0.37 -1.35 7.01 -1.76 -0.61 115.95 119.75 2uwl h TRP 237 Ca 0.17 0.01 0.03 0.00 2.11 0.00 0.00 58.89 61.20 2uwl h TRP 237 Cb 0.18 -0.07 -0.03 0.00 -2.10 0.00 0.00 29.16 27.14 2uwl h TRP 237 CO 0.00 0.13 0.17 0.82 -2.79 0.00 0.00 178.44 176.77 2uwl h ILE 238 N 0.25 0.96 -0.61 2.65 2.04 -0.53 -0.76 117.51 121.51 2uwl h ILE 238 Ca 0.09 -0.12 -0.00 0.00 1.00 0.00 0.00 64.86 65.83 2uwl h ILE 238 Cb 0.02 0.58 -0.03 0.00 -0.74 0.00 0.00 36.82 36.65 2uwl h ILE 238 CO -0.06 0.06 0.37 -0.78 0.00 0.00 0.00 178.15 177.74 2uwl h ASP 239 N 0.35 0.73 -0.17 1.72 -0.00 -0.74 -1.69 116.42 116.64 2uwl h ASP 239 Ca 0.16 -0.06 -0.00 0.00 -0.00 0.00 0.00 57.03 57.13 2uwl h ASP 239 Cb 0.08 -0.19 -0.01 0.00 -0.00 0.00 0.00 39.33 39.22 2uwl h ASP 239 CO -0.12 0.58 0.10 0.03 -0.00 0.00 0.00 179.24 179.83 2uwl h ARG 240 N 0.82 0.23 -0.43 0.28 3.08 -0.93 -2.52 114.38 114.91 2uwl h ARG 240 Ca 0.22 -0.02 0.08 0.00 0.07 0.00 0.00 59.98 60.33 2uwl h ARG 240 Cb -0.02 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 29.96 2uwl h ARG 240 CO -0.04 0.19 0.30 0.77 -1.07 0.00 0.00 179.97 180.11 2uwl h SER 241 N 0.20 0.20 0.88 7.04 0.02 -0.82 -2.03 113.55 119.05 2uwl h SER 241 Ca 0.06 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 2uwl h SER 241 Cb 0.01 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.51 2uwl h SER 241 CO -0.01 0.13 -0.40 0.23 -1.14 0.00 0.00 176.83 175.64 2uwl n MET 242 N -4.46 0.16 0.03 3.45 2.81 -0.66 -3.71 117.12 114.74 2uwl n MET 242 Ca 0.06 0.07 -0.08 0.00 -1.81 0.00 0.00 57.70 55.95 2uwl n MET 242 Cb 0.34 -1.63 -0.13 0.00 -0.71 0.00 0.00 33.22 31.10 2uwl n MET 242 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 2uwl h LYS 243 N 0.00 0.00 0.00 0.03 1.57 -0.94 -3.51 116.57 113.72 2uwl h LYS 243 Ca 0.00 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2uwl h LYS 243 Cb 0.64 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.95 2uwl h LYS 243 CO 0.00 0.80 0.00 0.25 -0.57 0.00 0.00 179.45 179.93