#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ska s ASP 9 N 0.00 6.94 0.00 0.00 2.15 -1.26 -1.68 116.67 122.82 1ska s ASP 9 Ca 0.00 1.17 -0.01 0.00 0.43 0.00 0.00 52.55 54.14 1ska s ASP 9 Cb 0.00 -2.48 -0.04 0.00 -0.30 0.00 0.00 42.92 40.11 1ska s ASP 9 CO 0.00 -0.56 0.12 0.42 -0.17 0.00 0.00 175.17 174.97 1ska s THR 10 N 2.92 4.96 0.16 1.71 -4.23 0.04 -4.96 115.64 116.23 1ska s THR 10 Ca 0.38 -0.35 -0.18 0.00 -1.18 0.00 0.00 61.69 60.36 1ska s THR 10 Cb -0.15 -3.29 0.06 0.00 1.34 0.00 0.00 72.50 70.46 1ska s THR 10 CO 0.07 0.32 1.67 0.58 -0.54 0.00 0.00 174.62 176.73 1ska h VAL 11 N 3.02 0.62 0.06 2.29 2.07 -1.90 0.15 116.25 122.55 1ska h VAL 11 Ca -0.49 0.00 -0.24 0.00 0.82 0.00 0.00 66.70 66.79 1ska h VAL 11 Cb 1.18 0.62 -0.00 0.00 -1.52 0.00 0.00 31.29 31.56 1ska h VAL 11 CO 0.65 0.00 -1.06 0.44 0.02 0.00 0.00 177.57 177.62 1ska h ASP 12 N -0.03 0.36 -0.01 0.57 3.45 -1.96 -3.38 116.42 115.43 1ska h ASP 12 Ca 0.17 -0.34 0.00 0.00 0.43 0.00 0.00 57.03 57.29 1ska h ASP 12 Cb 0.28 -0.11 0.00 0.00 -0.56 0.00 0.00 39.33 38.94 1ska h ASP 12 CO -0.37 1.20 0.00 0.18 -1.57 0.00 0.00 179.24 178.68 1ska n LEU 13 N -3.60 1.30 0.00 1.55 4.77 -1.22 -4.82 117.00 114.99 1ska n LEU 13 Ca -0.06 -1.01 0.00 0.00 -0.03 0.00 0.00 56.01 54.91 1ska n LEU 13 Cb 0.92 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.01 1ska n LEU 13 CO 0.51 0.29 0.00 0.61 -1.33 0.00 0.00 177.39 177.47 1ska n GLY 14 N 0.19 1.25 3.62 -0.72 0.00 0.04 -0.83 105.19 108.72 1ska n GLY 14 Ca 0.02 -0.67 -0.40 0.00 0.00 0.00 0.00 46.02 44.97 1ska n GLY 14 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1ska s TYR 15 N 0.00 3.27 -0.13 1.61 5.04 0.29 -0.78 117.35 126.65 1ska s TYR 15 Ca 0.00 0.58 0.17 0.00 -2.44 0.00 0.00 57.07 55.38 1ska s TYR 15 Cb 0.00 -2.67 0.43 0.00 0.35 0.00 0.00 41.96 40.07 1ska s TYR 15 CO 0.00 -0.25 1.20 1.04 -1.34 0.00 0.00 175.55 176.20 1ska n GLN 16 N 5.41 1.03 -3.53 4.97 1.13 -0.68 -4.70 117.38 121.01 1ska n GLN 16 Ca -0.06 -2.82 -0.37 0.00 -1.94 0.00 0.00 57.00 51.81 1ska n GLN 16 Cb 0.50 -0.99 -0.06 0.00 0.11 0.00 0.00 30.24 29.80 1ska n GLN 16 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1ska n SER 18 N 2.65 -0.95 0.24 0.00 7.64 -1.26 -4.54 113.62 117.41 1ska n SER 18 Ca -0.13 -1.24 0.07 0.00 1.01 0.00 0.00 58.87 58.58 1ska n SER 18 Cb 0.52 -1.89 0.57 0.00 -1.01 0.00 0.00 64.21 62.41 1ska n SER 18 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1ska h PRO 19 N -2.05 0.00 -0.14 1.43 0.13 -1.92 0.75 132.00 130.20 1ska h PRO 19 Ca -0.67 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 64.50 1ska h PRO 19 Cb 1.40 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.52 1ska h PRO 19 CO 0.63 0.12 0.18 0.00 -0.23 0.00 0.00 178.00 178.70 1ska h ALA 20 N 1.88 1.69 0.00 -0.56 0.00 -1.97 -2.29 119.26 118.01 1ska h ALA 20 Ca -0.00 -0.00 -0.27 0.00 0.00 0.00 0.00 54.91 54.63 1ska h ALA 20 Cb 0.22 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 1ska h ALA 20 CO 0.02 -0.25 -1.91 2.41 0.00 0.00 0.00 179.25 179.51 1ska n THR 21 N -3.70 0.90 0.28 0.00 -1.04 -0.17 -4.67 114.28 105.88 1ska n THR 21 Ca 0.01 -0.25 0.18 0.00 -2.04 0.00 0.00 64.05 61.95 1ska n THR 21 Cb 0.29 -1.61 0.76 0.00 -1.82 0.00 0.00 70.33 67.95 1ska n THR 21 CO 0.00 0.00 0.00 0.77 -0.64 0.00 0.00 175.07 175.20 1ska h SER 22 N -0.49 0.00 -0.16 8.00 4.64 -0.97 -1.35 113.55 123.23 1ska h SER 22 Ca -0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 1ska h SER 22 Cb 1.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.48 1ska h SER 22 CO -0.22 0.01 0.00 1.41 -0.87 0.00 0.00 176.83 177.17 1ska n HIS 23 N -3.12 0.21 -1.96 4.77 8.25 -0.86 -4.20 115.22 118.30 1ska n HIS 23 Ca -0.00 -0.10 -0.03 0.00 -0.26 0.00 0.00 57.72 57.32 1ska n HIS 23 Cb 0.27 0.00 0.11 0.00 1.12 0.00 0.00 29.99 31.50 1ska n HIS 23 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1ska n LEU 24 N -0.03 3.01 -0.95 2.41 4.77 -0.51 -4.65 117.00 121.05 1ska n LEU 24 Ca 0.09 -3.80 0.08 0.00 -0.03 0.00 0.00 56.01 52.35 1ska n LEU 24 Cb 0.18 -0.31 0.24 0.00 -2.33 0.00 0.00 43.42 41.20 1ska n LEU 24 CO 0.07 1.45 0.70 0.79 -1.33 0.00 0.00 177.39 179.07 1ska n TRP 25 N -0.72 0.90 -0.63 -1.77 8.01 -1.26 -3.61 117.44 118.36 1ska n TRP 25 Ca 0.23 -0.69 0.00 0.00 -1.31 0.00 0.00 57.50 55.74 1ska n TRP 25 Cb 0.85 -0.20 0.00 0.00 -2.01 0.00 0.00 31.31 29.94 1ska n TRP 25 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1ska n GLY 26 N 0.19 3.32 0.00 6.99 0.00 -1.26 -0.98 105.19 113.44 1ska n GLY 26 Ca 0.19 -0.12 0.10 0.00 0.00 0.00 0.00 46.02 46.19 1ska n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ska n GLN 27 N 14.00 0.47 -0.22 1.61 0.00 -1.26 -1.39 117.38 130.59 1ska n GLN 27 Ca 0.00 0.05 0.11 0.00 0.00 0.00 0.00 57.00 57.16 1ska n GLN 27 Cb 0.00 -1.50 0.26 0.00 0.00 0.00 0.00 30.24 29.00 1ska n GLN 27 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 1ska n TYR 28 N -1.14 0.58 -2.49 2.61 4.01 -0.15 -2.97 117.16 117.60 1ska n TYR 28 Ca 0.13 -0.29 -0.41 0.00 -0.16 0.00 0.00 57.90 57.16 1ska n TYR 28 Cb 0.11 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.11 1ska n TYR 28 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 1ska s SER 29 N -1.36 7.19 0.42 7.72 0.01 -0.48 -4.78 113.70 122.41 1ska s SER 29 Ca 0.40 2.03 -0.26 0.00 1.31 0.00 0.00 55.95 59.42 1ska s SER 29 Cb 0.22 -2.59 -0.09 0.00 0.21 0.00 0.00 66.02 63.77 1ska s SER 29 CO 0.31 -0.33 1.42 -2.84 0.41 0.00 0.00 173.24 172.21 1ska s PRO 30 N 0.33 3.87 0.11 12.44 0.02 -1.26 -0.55 135.00 149.96 1ska s PRO 30 Ca 0.53 2.42 -0.35 0.00 0.02 0.00 0.00 61.00 63.63 1ska s PRO 30 Cb -0.29 -2.78 -0.18 0.00 0.02 0.00 0.00 34.50 31.28 1ska s PRO 30 CO 0.32 -0.67 0.98 0.34 -0.33 0.00 0.00 177.00 177.65 1ska n PHE 31 N 0.08 0.63 -4.21 6.54 7.35 -0.07 -4.62 117.46 123.15 1ska n PHE 31 Ca 0.03 0.89 -0.17 0.00 -0.76 0.00 0.00 57.45 57.45 1ska n PHE 31 Cb 0.41 -2.13 -0.15 0.00 0.35 0.00 0.00 39.48 37.96 1ska n PHE 31 CO 0.00 0.00 0.00 -0.59 -0.76 0.00 0.00 176.76 175.41 1ska s PHE 32 N -0.28 0.57 0.25 -5.13 -0.12 -1.26 -0.55 117.98 111.46 1ska s PHE 32 Ca 0.78 -0.11 -0.30 0.00 -0.05 0.00 0.00 56.93 57.25 1ska s PHE 32 Cb -1.03 -0.38 -0.10 0.00 -0.63 0.00 0.00 43.02 40.88 1ska s PHE 32 CO 0.55 -0.02 1.36 0.45 -0.05 0.00 0.00 175.22 177.51 1ska s SER 33 N -0.06 6.77 -0.26 1.98 0.15 -0.01 -4.90 113.70 117.36 1ska s SER 33 Ca 0.01 2.58 0.11 0.00 0.70 0.00 0.00 55.95 59.36 1ska s SER 33 Cb -0.03 -2.62 0.52 0.00 -1.71 0.00 0.00 66.02 62.17 1ska s SER 33 CO -0.00 -0.60 1.48 0.18 1.20 0.00 0.00 173.24 175.49 1ska n LEU 34 N 2.07 4.19 -4.63 3.45 4.77 0.30 -5.01 117.00 122.15 1ska n LEU 34 Ca 0.05 -3.51 -0.49 0.00 -0.03 0.00 0.00 56.01 52.03 1ska n LEU 34 Cb 0.41 -0.62 -0.05 0.00 -2.33 0.00 0.00 43.42 40.84 1ska n LEU 34 CO 0.59 1.05 1.04 1.21 -1.33 0.00 0.00 177.39 179.95 1ska n GLU 35 N -0.93 1.66 -0.93 3.23 4.07 -1.24 -1.34 120.64 125.16 1ska n GLU 35 Ca 0.31 0.60 0.00 0.00 -0.06 0.00 0.00 57.16 58.01 1ska n GLU 35 Cb 1.03 -2.30 0.00 0.00 -0.06 0.00 0.00 31.44 30.11 1ska n GLU 35 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 1ska n ASP 36 N 2.92 -3.83 -4.60 4.31 8.00 -1.26 -4.97 116.55 117.13 1ska n ASP 36 Ca 0.17 0.00 -0.42 0.00 0.71 0.00 0.00 54.79 55.26 1ska n ASP 36 Cb 0.24 -2.22 -0.06 0.00 -0.02 0.00 0.00 41.12 39.06 1ska n ASP 36 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1ska s GLU 37 N -1.13 3.87 -1.46 -1.24 0.41 -0.45 -3.73 118.70 114.98 1ska s GLU 37 Ca 0.00 0.36 -0.11 0.00 -0.41 0.00 0.00 54.97 54.81 1ska s GLU 37 Cb 0.00 -3.75 0.07 0.00 -1.78 0.00 0.00 34.13 28.68 1ska s GLU 37 CO 0.00 -0.66 0.75 -0.11 -0.49 0.00 0.00 175.26 174.74 1ska n LEU 38 N 6.08 -2.17 -3.74 1.80 7.94 -1.26 -4.92 117.00 120.73 1ska n LEU 38 Ca 0.01 -0.58 -0.09 0.00 -1.11 0.00 0.00 56.01 54.24 1ska n LEU 38 Cb 0.48 -2.44 -0.03 0.00 0.53 0.00 0.00 43.42 41.97 1ska n LEU 38 CO 0.49 0.32 0.36 -0.55 -1.11 0.00 0.00 177.39 176.90 1ska s SER 39 N -3.01 -0.31 0.81 1.96 0.15 -1.24 -4.99 113.70 107.08 1ska s SER 39 Ca 0.53 -0.47 -0.10 0.00 0.70 0.00 0.00 55.95 56.60 1ska s SER 39 Cb -0.27 0.64 0.11 0.00 -1.71 0.00 0.00 66.02 64.80 1ska s SER 39 CO 0.65 -1.16 1.15 0.68 1.20 0.00 0.00 173.24 175.77 1ska s VAL 40 N -3.88 2.10 0.44 4.45 -7.23 -1.26 -4.45 120.40 110.56 1ska s VAL 40 Ca 0.09 -0.14 -0.24 0.00 -1.81 0.00 0.00 61.98 59.89 1ska s VAL 40 Cb -0.03 -2.96 -0.10 0.00 0.56 0.00 0.00 36.38 33.86 1ska s VAL 40 CO -0.00 0.00 1.00 -0.24 -0.31 0.00 0.00 175.10 175.55 1ska n SER 41 N -3.28 1.20 -0.40 4.85 2.88 -1.26 -4.03 113.62 113.58 1ska n SER 41 Ca 0.11 1.01 0.09 0.00 -1.33 0.00 0.00 58.87 58.75 1ska n SER 41 Cb 0.60 -1.36 0.37 0.00 -0.75 0.00 0.00 64.21 63.08 1ska n SER 41 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1ska n SER 42 N 0.38 1.20 -4.74 -3.46 3.41 -1.26 -4.91 113.62 104.24 1ska n SER 42 Ca 0.10 -1.69 -0.33 0.00 -0.26 0.00 0.00 58.87 56.68 1ska n SER 42 Cb 0.40 -0.09 0.08 0.00 -0.26 0.00 0.00 64.21 64.34 1ska n SER 42 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1ska s LYS 43 N -1.82 2.34 -0.10 4.33 1.02 -1.26 -4.95 119.74 119.31 1ska s LYS 43 Ca 0.28 1.56 -0.30 0.00 0.02 0.00 0.00 55.97 57.53 1ska s LYS 43 Cb 0.15 -1.88 -0.04 0.00 -0.52 0.00 0.00 37.83 35.54 1ska s LYS 43 CO 0.22 -1.64 1.45 -1.17 -0.92 0.00 0.00 175.35 173.29 1ska s LEU 44 N -5.19 4.26 0.45 3.17 2.96 -1.26 -4.96 118.68 118.11 1ska s LEU 44 Ca 0.70 1.98 -0.25 0.00 -0.22 0.00 0.00 54.13 56.34 1ska s LEU 44 Cb -0.24 -3.54 -0.09 0.00 0.50 0.00 0.00 46.19 42.82 1ska s LEU 44 CO 0.45 -0.83 1.33 -2.65 -1.32 0.00 0.00 176.35 173.33 1ska n PRO 45 N 6.67 2.00 -1.74 0.98 -0.02 -1.26 -4.90 135.00 136.74 1ska n PRO 45 Ca 0.15 0.72 -0.42 0.00 -2.02 0.00 0.00 63.50 61.93 1ska n PRO 45 Cb 0.44 -2.48 -0.01 0.00 -0.02 0.00 0.00 33.50 31.43 1ska n PRO 45 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1ska n LYS 46 N -0.14 2.51 -0.99 -0.52 4.81 -1.26 -2.06 118.16 120.50 1ska n LYS 46 Ca 0.07 0.89 0.00 0.00 -0.87 0.00 0.00 58.31 58.39 1ska n LYS 46 Cb 0.41 -2.61 0.00 0.00 0.02 0.00 0.00 35.03 32.85 1ska n LYS 46 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1ska n ASP 47 N 1.46 -3.04 -4.32 3.14 8.00 -1.26 -4.89 116.55 115.64 1ska n ASP 47 Ca 0.06 0.00 -0.23 0.00 0.71 0.00 0.00 54.79 55.33 1ska n ASP 47 Cb 0.36 -0.79 -0.12 0.00 -0.02 0.00 0.00 41.12 40.55 1ska n ASP 47 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ska s ARG 49 N -2.31 1.37 0.17 0.00 3.52 -0.20 -4.81 118.95 116.70 1ska s ARG 49 Ca 0.11 -0.44 -0.31 0.00 -0.13 0.00 0.00 55.73 54.97 1ska s ARG 49 Cb -0.08 -1.22 -0.09 0.00 -1.56 0.00 0.00 34.95 32.00 1ska s ARG 49 CO 0.06 0.15 1.37 0.42 -0.81 0.00 0.00 175.30 176.48 1ska s ILE 50 N 0.20 3.16 -0.34 4.11 -1.09 -1.26 -0.99 121.20 124.98 1ska s ILE 50 Ca -0.05 0.90 0.15 0.00 -2.23 0.00 0.00 60.65 59.42 1ska s ILE 50 Cb -0.11 -3.57 -0.20 0.00 -1.58 0.00 0.00 42.46 37.00 1ska s ILE 50 CO 0.01 0.11 0.47 0.35 -1.23 0.00 0.00 174.94 174.65 1ska n THR 51 N 3.15 0.00 -3.63 2.92 -2.24 0.35 -4.89 114.28 109.93 1ska n THR 51 Ca 0.09 -0.26 -0.11 0.00 -2.27 0.00 0.00 64.05 61.50 1ska n THR 51 Cb 0.42 0.55 -0.07 0.00 -2.10 0.00 0.00 70.33 69.13 1ska n THR 51 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1ska s LEU 52 N -3.41 -0.81 -0.04 3.22 0.20 -1.13 -4.74 118.68 111.97 1ska s LEU 52 Ca -0.00 1.44 0.01 0.00 0.69 0.00 0.00 54.13 56.27 1ska s LEU 52 Cb 0.10 2.40 0.02 0.00 -0.43 0.00 0.00 46.19 48.28 1ska s LEU 52 CO 0.62 -0.24 -0.06 0.54 -0.29 0.00 0.00 176.35 176.92 1ska s VAL 53 N 0.89 0.62 -0.20 1.68 0.11 -0.53 -1.34 120.40 121.63 1ska s VAL 53 Ca -0.04 -0.21 -0.08 0.00 -2.93 0.00 0.00 61.98 58.72 1ska s VAL 53 Cb -0.05 -0.61 -0.04 0.00 -1.53 0.00 0.00 36.38 34.15 1ska s VAL 53 CO -0.08 0.23 0.08 -1.58 -3.33 0.00 0.00 175.10 170.42 1ska s GLN 54 N 0.66 3.94 -0.06 1.54 2.00 -0.18 -0.95 119.66 126.61 1ska s GLN 54 Ca -0.10 -0.35 -0.02 0.00 -2.00 0.00 0.00 55.36 52.89 1ska s GLN 54 Cb -0.13 -3.28 -0.04 0.00 0.80 0.00 0.00 33.01 30.37 1ska s GLN 54 CO 0.01 0.17 0.04 0.08 -0.50 0.00 0.00 175.29 175.09 1ska s VAL 55 N 0.67 4.58 -0.13 1.34 1.01 0.76 -0.57 120.40 128.05 1ska s VAL 55 Ca 0.04 -0.26 -0.00 0.00 0.00 0.00 0.00 61.98 61.75 1ska s VAL 55 Cb -0.13 -3.00 0.03 0.00 0.00 0.00 0.00 36.38 33.28 1ska s VAL 55 CO 0.02 0.51 -0.08 -0.22 0.00 0.00 0.00 175.10 175.32 1ska s LEU 56 N -1.21 1.41 0.09 3.92 2.96 -0.45 -1.15 118.68 124.24 1ska s LEU 56 Ca 0.17 -0.44 0.06 0.00 -0.22 0.00 0.00 54.13 53.70 1ska s LEU 56 Cb -0.12 -0.93 -0.03 0.00 0.50 0.00 0.00 46.19 45.61 1ska s LEU 56 CO 0.07 -0.12 -0.16 -0.55 -1.32 0.00 0.00 176.35 174.26 1ska s SER 57 N 1.64 1.99 0.49 3.68 0.15 -0.32 -0.59 113.70 120.74 1ska s SER 57 Ca 0.04 -0.69 0.01 0.00 0.70 0.00 0.00 55.95 56.01 1ska s SER 57 Cb -0.13 -0.08 0.01 0.00 -1.71 0.00 0.00 66.02 64.11 1ska s SER 57 CO -0.09 -0.06 0.71 -0.60 1.20 0.00 0.00 173.24 174.41 1ska s ARG 58 N -2.04 2.83 0.88 5.44 3.52 -0.46 -0.93 118.95 128.19 1ska s ARG 58 Ca 0.03 -0.63 -0.11 0.00 -0.13 0.00 0.00 55.73 54.89 1ska s ARG 58 Cb -0.09 -2.53 0.12 0.00 -1.56 0.00 0.00 34.95 30.89 1ska s ARG 58 CO 0.03 -0.46 1.09 -3.38 -0.81 0.00 0.00 175.30 171.77 1ska s HIS 59 N -2.64 2.28 0.27 5.12 -3.43 -1.26 -4.31 115.29 111.31 1ska s HIS 59 Ca 0.52 1.38 -0.04 0.00 -0.80 0.00 0.00 55.06 56.12 1ska s HIS 59 Cb -0.10 -3.14 0.06 0.00 -1.43 0.00 0.00 32.58 27.97 1ska s HIS 59 CO 0.38 -2.35 0.37 0.41 -2.00 0.00 0.00 174.74 171.55 1ska n GLY 60 N -0.94 -1.04 3.61 -1.38 0.00 -1.26 -0.77 105.19 103.40 1ska n GLY 60 Ca 0.08 -1.71 -0.43 0.00 0.00 0.00 0.00 46.02 43.96 1ska n GLY 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ska n ALA 61 N -3.22 0.08 -2.19 4.61 0.00 -1.26 -4.68 120.51 113.85 1ska n ALA 61 Ca -0.06 0.32 -0.11 0.00 0.00 0.00 0.00 53.44 53.58 1ska n ALA 61 Cb 0.16 -2.06 -0.10 0.00 0.00 0.00 0.00 19.45 17.45 1ska n ALA 61 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 1ska s ARG 62 N -1.77 1.11 0.86 0.00 1.70 -1.26 -1.85 118.95 117.74 1ska s ARG 62 Ca 0.60 -1.56 -0.11 0.00 -0.47 0.00 0.00 55.73 54.19 1ska s ARG 62 Cb -0.63 0.22 0.11 0.00 -0.57 0.00 0.00 34.95 34.08 1ska s ARG 62 CO 0.59 -0.33 1.09 0.71 -1.08 0.00 0.00 175.30 176.28 1ska s TYR 63 N -4.09 2.33 0.77 5.89 2.02 -0.16 -4.76 117.35 119.35 1ska s TYR 63 Ca 0.33 1.42 -0.15 0.00 -0.37 0.00 0.00 57.07 58.31 1ska s TYR 63 Cb 0.07 -3.13 0.03 0.00 -0.40 0.00 0.00 41.96 38.54 1ska s TYR 63 CO 0.08 -2.24 0.97 -2.30 -1.57 0.00 0.00 175.55 170.49 1ska n PRO 64 N -3.81 0.32 -0.76 -1.71 -0.02 -1.26 -3.92 135.00 123.84 1ska n PRO 64 Ca 0.08 0.17 -0.31 0.00 -2.02 0.00 0.00 63.50 61.42 1ska n PRO 64 Cb 0.54 -2.24 0.16 0.00 -0.02 0.00 0.00 33.50 31.94 1ska n PRO 64 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1ska s THR 65 N -1.98 2.21 0.23 3.45 -4.23 -1.26 -0.30 115.64 113.77 1ska s THR 65 Ca 0.71 0.07 -0.07 0.00 -1.18 0.00 0.00 61.69 61.23 1ska s THR 65 Cb -0.32 -2.15 0.18 0.00 1.34 0.00 0.00 72.50 71.55 1ska s THR 65 CO 0.52 -0.09 1.74 0.77 -0.54 0.00 0.00 174.62 177.02 1ska h SER 66 N -1.83 0.26 -0.25 3.99 4.64 -1.93 0.50 113.55 118.93 1ska h SER 66 Ca -0.44 0.09 0.04 0.00 -0.47 0.00 0.00 61.79 61.01 1ska h SER 66 Cb 1.27 0.07 -0.03 0.00 -0.31 0.00 0.00 62.40 63.39 1ska h SER 66 CO 0.43 0.13 0.03 -1.28 -0.87 0.00 0.00 176.83 175.27 1ska h SER 67 N 0.44 -0.02 0.58 4.97 0.87 -2.00 -2.31 113.55 116.08 1ska h SER 67 Ca 0.36 0.04 -0.19 0.00 -1.23 0.00 0.00 61.79 60.77 1ska h SER 67 Cb 0.49 0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 62.50 1ska h SER 67 CO -0.35 0.02 -0.86 0.11 -0.53 0.00 0.00 176.83 175.22 1ska h LYS 68 N 0.12 0.19 -0.46 2.24 1.79 -1.40 -2.66 116.57 116.39 1ska h LYS 68 Ca 0.12 -0.20 -0.05 0.00 -2.18 0.00 0.00 60.65 58.33 1ska h LYS 68 Cb 0.13 0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 30.81 1ska h LYS 68 CO -0.17 0.94 0.09 1.03 -1.08 0.00 0.00 179.45 180.26 1ska h SER 69 N 0.11 0.65 -0.32 0.86 0.87 0.05 0.16 113.55 115.93 1ska h SER 69 Ca -0.04 -0.11 -0.14 0.00 -1.23 0.00 0.00 61.79 60.27 1ska h SER 69 Cb 1.49 -0.17 -0.00 0.00 -0.44 0.00 0.00 62.40 63.27 1ska h SER 69 CO 0.13 0.67 -0.34 0.11 -0.53 0.00 0.00 176.83 176.87 1ska h LYS 70 N 0.68 0.80 -0.40 2.24 1.57 -1.32 -0.33 116.57 119.81 1ska h LYS 70 Ca 0.15 -0.43 -0.03 0.00 -1.87 0.00 0.00 60.65 58.47 1ska h LYS 70 Cb 0.29 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.61 1ska h LYS 70 CO 0.00 1.06 0.13 0.87 -0.57 0.00 0.00 179.45 180.94 1ska h LYS 71 N 0.57 0.62 -0.75 3.15 1.57 -1.03 -0.97 116.57 119.74 1ska h LYS 71 Ca 0.05 -0.13 -0.06 0.00 -1.87 0.00 0.00 60.65 58.64 1ska h LYS 71 Cb 0.93 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 33.11 1ska h LYS 71 CO 0.08 0.62 0.25 1.88 -0.57 0.00 0.00 179.45 181.71 1ska h TYR 72 N 0.50 1.19 -0.21 -1.35 0.05 -0.61 -1.53 116.97 115.00 1ska h TYR 72 Ca 0.13 -0.11 -0.17 0.00 0.05 0.00 0.00 58.73 58.63 1ska h TYR 72 Cb 0.25 -0.35 -0.00 0.00 1.01 0.00 0.00 36.73 37.64 1ska h TYR 72 CO 0.01 0.93 -0.56 -0.22 -1.05 0.00 0.00 178.16 177.27 1ska h LYS 73 N 1.10 0.65 -0.76 4.88 3.64 -0.98 0.39 116.57 125.49 1ska h LYS 73 Ca 0.24 -0.41 -0.06 0.00 -1.27 0.00 0.00 60.65 59.15 1ska h LYS 73 Cb 0.29 0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.12 1ska h LYS 73 CO -0.01 1.03 0.24 -0.22 -2.27 0.00 0.00 179.45 178.22 1ska h LYS 74 N 0.50 1.17 -0.14 1.90 3.64 -1.02 -1.20 116.57 121.41 1ska h LYS 74 Ca 0.01 -0.25 -0.04 0.00 -1.27 0.00 0.00 60.65 59.10 1ska h LYS 74 Cb 1.12 -0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 32.76 1ska h LYS 74 CO 0.11 0.99 -0.08 1.25 -2.27 0.00 0.00 179.45 179.44 1ska h LEU 75 N 1.12 0.32 -0.60 5.20 5.85 -0.96 -0.73 115.31 125.52 1ska h LEU 75 Ca 0.25 -0.43 -0.03 0.00 0.84 0.00 0.00 57.88 58.51 1ska h LEU 75 Cb 0.30 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.21 1ska h LEU 75 CO -0.01 0.68 0.26 0.58 -0.34 0.00 0.00 178.44 179.61 1ska h VAL 76 N -0.04 1.22 -0.59 1.05 2.07 -0.82 -1.62 116.25 117.51 1ska h VAL 76 Ca 0.03 -0.66 0.06 0.00 0.82 0.00 0.00 66.70 66.94 1ska h VAL 76 Cb 0.57 0.55 -0.05 0.00 -1.52 0.00 0.00 31.29 30.83 1ska h VAL 76 CO 0.02 0.26 0.31 0.74 0.02 0.00 0.00 177.57 178.92 1ska h THR 77 N 0.82 0.95 -0.22 2.57 2.02 -1.24 -1.46 112.91 116.35 1ska h THR 77 Ca 0.20 -0.20 -0.05 0.00 0.77 0.00 0.00 66.41 67.14 1ska h THR 77 Cb 0.16 0.32 -0.01 0.00 -1.74 0.00 0.00 68.15 66.88 1ska h THR 77 CO -0.02 0.11 -0.04 0.00 0.37 0.00 0.00 175.52 175.93 1ska h ALA 78 N 1.32 0.30 -0.63 6.16 0.00 -0.83 0.19 119.26 125.77 1ska h ALA 78 Ca 0.27 -0.25 0.12 0.00 0.00 0.00 0.00 54.91 55.05 1ska h ALA 78 Cb 0.18 -0.08 -0.09 0.00 0.00 0.00 0.00 17.79 17.80 1ska h ALA 78 CO -0.18 0.08 0.14 0.82 0.00 0.00 0.00 179.25 180.11 1ska h ILE 79 N 0.15 0.63 -0.47 0.00 2.04 -1.24 -0.84 117.51 117.78 1ska h ILE 79 Ca 0.06 -0.09 -0.12 0.00 1.00 0.00 0.00 64.86 65.71 1ska h ILE 79 Cb 0.49 0.33 -0.01 0.00 -0.74 0.00 0.00 36.82 36.88 1ska h ILE 79 CO 0.02 0.05 -0.16 1.56 0.00 0.00 0.00 178.15 179.62 1ska h GLN 80 N 0.27 0.94 -0.87 2.37 4.20 -0.88 -0.48 115.11 120.66 1ska h GLN 80 Ca 0.33 -0.38 0.04 0.00 0.06 0.00 0.00 58.65 58.70 1ska h GLN 80 Cb 0.50 -0.04 -0.05 0.00 0.30 0.00 0.00 27.48 28.18 1ska h GLN 80 CO -0.42 1.04 0.56 0.00 -0.67 0.00 0.00 178.83 179.34 1ska h ALA 81 N 0.87 1.16 0.00 3.87 0.00 -0.39 -3.36 119.26 121.41 1ska h ALA 81 Ca 0.11 -0.03 -0.26 0.00 0.00 0.00 0.00 54.91 54.74 1ska h ALA 81 Cb 0.72 -0.29 -0.05 0.00 0.00 0.00 0.00 17.79 18.17 1ska h ALA 81 CO 0.06 0.38 -2.20 0.09 0.00 0.00 0.00 179.25 177.58 1ska n ASN 82 N -4.55 0.09 -4.76 0.00 4.13 -0.34 -5.01 115.26 104.81 1ska n ASN 82 Ca 0.11 0.04 -0.41 0.00 1.68 0.00 0.00 54.58 56.01 1ska n ASN 82 Cb 0.11 1.17 -0.03 0.00 -1.54 0.00 0.00 39.78 39.48 1ska n ASN 82 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1ska s ALA 83 N -2.80 3.45 -0.18 5.41 0.00 -0.20 -4.42 121.76 123.02 1ska s ALA 83 Ca -0.09 1.05 0.18 0.00 0.00 0.00 0.00 51.96 53.10 1ska s ALA 83 Cb 0.08 -3.40 -0.01 0.00 0.00 0.00 0.00 23.12 19.79 1ska s ALA 83 CO 0.85 -0.39 1.10 1.79 0.00 0.00 0.00 175.76 179.12 1ska h THR 84 N 3.20 0.45 -2.89 0.00 1.35 -0.85 -3.46 112.91 110.71 1ska h THR 84 Ca -0.47 -1.76 -0.13 0.00 -0.55 0.00 0.00 66.41 63.50 1ska h THR 84 Cb 1.22 2.02 -0.23 0.00 -1.73 0.00 0.00 68.15 69.43 1ska h THR 84 CO 0.68 0.26 -0.27 -0.62 -0.25 0.00 0.00 175.52 175.31 1ska s ASP 85 N -5.91 -0.33 -0.43 5.36 2.15 -1.26 -5.05 116.67 111.20 1ska s ASP 85 Ca 0.00 0.54 -0.09 0.00 0.43 0.00 0.00 52.55 53.43 1ska s ASP 85 Cb 0.08 0.61 0.08 0.00 -0.30 0.00 0.00 42.92 43.40 1ska s ASP 85 CO 0.78 -0.23 0.27 -0.36 -0.17 0.00 0.00 175.17 175.46 1ska s PHE 86 N -0.30 3.35 0.01 -5.34 0.40 -1.26 -4.00 117.98 110.84 1ska s PHE 86 Ca -0.04 -1.56 -0.20 0.00 -0.60 0.00 0.00 56.93 54.52 1ska s PHE 86 Cb -0.03 -3.04 -0.06 0.00 0.51 0.00 0.00 43.02 40.40 1ska s PHE 86 CO 0.02 -0.87 0.59 0.15 0.70 0.00 0.00 175.22 175.81 1ska s LYS 87 N 1.42 4.29 7.22 0.44 1.02 0.25 -3.77 119.74 130.61 1ska s LYS 87 Ca 0.03 0.73 0.00 0.00 0.02 0.00 0.00 55.97 56.76 1ska s LYS 87 Cb -0.23 -3.32 0.00 0.00 -0.52 0.00 0.00 37.83 33.75 1ska s LYS 87 CO 0.02 0.42 0.00 0.41 -0.92 0.00 0.00 175.35 175.28 1ska n GLY 88 N 2.31 3.10 0.22 -3.33 0.00 -1.26 -1.45 105.19 104.78 1ska n GLY 88 Ca -0.08 -0.24 0.16 0.00 0.00 0.00 0.00 46.02 45.86 1ska n GLY 88 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ska h LYS 89 N 0.00 0.00 -0.04 1.61 1.57 -1.96 0.53 116.57 118.28 1ska h LYS 89 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1ska h LYS 89 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1ska h LYS 89 CO 0.00 0.00 0.00 1.19 -0.57 0.00 0.00 179.45 180.07 1ska n PHE 90 N -2.64 0.05 0.25 -1.35 3.01 -0.53 -4.26 117.46 111.99 1ska n PHE 90 Ca -0.00 -0.02 0.14 0.00 1.01 0.00 0.00 57.45 58.57 1ska n PHE 90 Cb 0.15 0.00 0.58 0.00 -0.01 0.00 0.00 39.48 40.21 1ska n PHE 90 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1ska h ALA 91 N 3.91 1.02 -0.12 4.37 0.00 -0.97 -1.75 119.26 125.72 1ska h ALA 91 Ca 0.00 -0.09 0.04 0.00 0.00 0.00 0.00 54.91 54.85 1ska h ALA 91 Cb 0.18 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 1ska h ALA 91 CO 0.00 0.13 0.14 0.27 0.00 0.00 0.00 179.25 179.79 1ska h PHE 92 N 0.00 0.00 0.00 0.00 -0.00 -1.82 -1.05 116.94 114.07 1ska h PHE 92 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.97 1ska h PHE 92 Cb 0.61 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.56 1ska h PHE 92 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 178.31 178.24 1ska h LEU 93 N 0.00 0.00 -0.67 2.10 3.38 -1.64 -0.67 115.31 117.81 1ska h LEU 93 Ca 0.06 0.00 0.10 0.00 0.09 0.00 0.00 57.88 58.13 1ska h LEU 93 Cb 0.34 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.01 1ska h LEU 93 CO -0.00 0.00 0.28 0.50 0.09 0.00 0.00 178.44 179.31 1ska h LYS 94 N 0.00 0.47 0.00 1.13 3.64 -1.38 -3.30 116.57 117.13 1ska h LYS 94 Ca 0.00 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1ska h LYS 94 Cb 0.24 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 1ska h LYS 94 CO 0.00 0.31 -0.60 0.25 -2.27 0.00 0.00 179.45 177.14 1ska n THR 95 N -4.95 0.00 -1.63 1.00 -2.24 -0.73 -5.03 114.28 100.69 1ska n THR 95 Ca 0.10 -0.24 -0.46 0.00 -2.27 0.00 0.00 64.05 61.18 1ska n THR 95 Cb 0.30 0.94 -0.03 0.00 -2.10 0.00 0.00 70.33 69.44 1ska n THR 95 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ska n TYR 96 N -1.31 1.83 -4.22 4.78 9.36 -0.33 -4.97 117.16 122.29 1ska n TYR 96 Ca 0.02 0.52 -0.33 0.00 3.32 0.00 0.00 57.90 61.43 1ska n TYR 96 Cb 0.18 -2.39 -0.16 0.00 -0.63 0.00 0.00 39.34 36.35 1ska n TYR 96 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 1ska s ASN 97 N 0.20 3.46 -0.15 2.98 3.84 -1.26 -5.00 114.94 119.00 1ska s ASN 97 Ca 0.71 -0.56 -0.29 0.00 0.21 0.00 0.00 52.86 52.92 1ska s ASN 97 Cb -0.73 -1.54 -0.02 0.00 -0.55 0.00 0.00 41.25 38.40 1ska s ASN 97 CO 0.50 0.02 1.37 -0.47 -2.79 0.00 0.00 177.10 175.73 1ska s TYR 98 N 1.18 2.60 0.00 0.43 6.14 -1.26 -4.82 117.35 121.62 1ska s TYR 98 Ca 0.02 0.79 0.00 0.00 0.64 0.00 0.00 57.07 58.52 1ska s TYR 98 Cb -0.14 -3.65 0.00 0.00 0.42 0.00 0.00 41.96 38.59 1ska s TYR 98 CO -0.07 -2.25 0.22 -2.37 0.64 0.00 0.00 175.55 171.72 1ska n THR 99 N 5.50 0.01 -2.09 4.34 5.66 -1.26 -5.08 114.28 121.37 1ska n THR 99 Ca 0.15 -0.22 -0.36 0.00 -3.05 0.00 0.00 64.05 60.57 1ska n THR 99 Cb 0.44 1.56 0.02 0.00 -1.55 0.00 0.00 70.33 70.80 1ska n THR 99 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 1ska s LEU 100 N -0.01 3.79 0.00 1.09 1.43 -1.26 -5.03 118.68 118.69 1ska s LEU 100 Ca 0.00 2.38 0.00 0.00 -1.03 0.00 0.00 54.13 55.48 1ska s LEU 100 Cb 0.00 -4.46 0.00 0.00 0.03 0.00 0.00 46.19 41.76 1ska s LEU 100 CO 0.00 -1.35 0.00 0.61 0.23 0.00 0.00 176.35 175.84 1ska n GLY 101 N 0.46 0.08 3.14 -3.19 0.00 -1.26 -5.05 105.19 99.37 1ska n GLY 101 Ca 0.11 -1.77 -0.16 0.00 0.00 0.00 0.00 46.02 44.20 1ska n GLY 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ska s ALA 102 N -3.35 0.99 0.00 4.61 0.00 -1.26 -4.22 121.76 118.53 1ska s ALA 102 Ca 0.00 -0.98 0.00 0.00 0.00 0.00 0.00 51.96 50.98 1ska s ALA 102 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 23.12 23.09 1ska s ALA 102 CO 0.00 0.07 0.00 -0.25 0.00 0.00 0.00 175.76 175.58 1ska n ASP 103 N 1.16 0.00 -4.79 0.00 8.00 0.60 -4.87 116.55 116.64 1ska n ASP 103 Ca -0.20 0.00 -0.33 0.00 0.71 0.00 0.00 54.79 54.96 1ska n ASP 103 Cb 0.55 0.00 0.02 0.00 -0.02 0.00 0.00 41.12 41.67 1ska n ASP 103 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1ska s ASP 104 N 0.00 5.61 0.51 -2.24 1.01 -1.26 -4.58 116.67 115.72 1ska s ASP 104 Ca 0.00 1.93 -0.22 0.00 0.71 0.00 0.00 52.55 54.98 1ska s ASP 104 Cb 0.00 -2.55 -0.07 0.00 1.01 0.00 0.00 42.92 41.31 1ska s ASP 104 CO 0.00 -1.28 1.04 0.18 0.21 0.00 0.00 175.17 175.32 1ska n LEU 105 N -1.95 3.47 -4.92 1.23 4.77 -1.26 -0.98 117.00 117.36 1ska n LEU 105 Ca 0.10 0.93 -0.26 0.00 -0.03 0.00 0.00 56.01 56.75 1ska n LEU 105 Cb 0.52 -1.40 0.02 0.00 -2.33 0.00 0.00 43.42 40.22 1ska n LEU 105 CO 0.46 -1.49 0.44 0.42 -1.33 0.00 0.00 177.39 175.89 1ska s THR 106 N -1.38 4.19 0.26 -5.08 -4.23 -0.77 -4.75 115.64 103.88 1ska s THR 106 Ca 0.69 -0.04 -0.03 0.00 -1.18 0.00 0.00 61.69 61.13 1ska s THR 106 Cb -0.47 -3.61 0.24 0.00 1.34 0.00 0.00 72.50 70.00 1ska s THR 106 CO 0.52 -0.57 1.84 -0.65 -0.54 0.00 0.00 174.62 175.21 1ska h PRO 107 N 0.10 0.92 -0.61 3.99 0.11 -1.85 -0.30 132.00 134.36 1ska h PRO 107 Ca -0.46 -0.06 0.02 0.00 0.11 0.00 0.00 66.00 65.61 1ska h PRO 107 Cb 1.24 -0.21 -0.03 0.00 0.11 0.00 0.00 31.00 32.11 1ska h PRO 107 CO 0.60 0.61 0.39 0.35 -0.21 0.00 0.00 178.00 179.74 1ska h PHE 108 N 0.95 0.74 -0.21 0.65 3.57 -1.69 -1.75 116.94 119.20 1ska h PHE 108 Ca 0.43 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.91 1ska h PHE 108 Cb 0.33 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 38.81 1ska h PHE 108 CO -0.03 0.45 -0.04 0.78 -2.23 0.00 0.00 178.31 177.24 1ska h GLY 109 N 0.79 0.34 0.93 2.40 0.00 -1.25 -1.28 103.07 105.00 1ska h GLY 109 Ca 0.23 -0.19 -0.02 0.00 0.00 0.00 0.00 47.33 47.35 1ska h GLY 109 CO -0.07 0.18 0.13 0.83 0.00 0.00 0.00 176.54 177.60 1ska h GLU 110 N 0.31 0.53 -0.05 4.80 5.08 -0.69 -2.92 114.58 121.64 1ska h GLU 110 Ca 0.07 -0.10 -0.04 0.00 -1.00 0.00 0.00 59.36 58.29 1ska h GLU 110 Cb 0.28 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 1ska h GLU 110 CO 0.01 0.54 -0.15 0.37 -1.00 0.00 0.00 179.01 178.77 1ska h GLN 111 N 0.42 0.07 -0.85 2.33 5.75 -0.99 -1.89 115.11 119.95 1ska h GLN 111 Ca 0.12 -0.01 -0.02 0.00 -0.15 0.00 0.00 58.65 58.58 1ska h GLN 111 Cb 0.21 -0.01 -0.04 0.00 1.07 0.00 0.00 27.48 28.71 1ska h GLN 111 CO -0.01 0.23 0.44 1.96 -2.65 0.00 0.00 178.83 178.81 1ska h GLN 112 N 0.07 1.19 -0.03 1.69 4.20 -1.06 0.11 115.11 121.28 1ska h GLN 112 Ca 0.01 -0.15 -0.22 0.00 0.06 0.00 0.00 58.65 58.35 1ska h GLN 112 Cb 0.32 -0.23 0.01 0.00 0.30 0.00 0.00 27.48 27.87 1ska h GLN 112 CO 0.02 0.89 -0.90 -0.07 -0.67 0.00 0.00 178.83 178.09 1ska h LEU 113 N 1.19 0.63 -0.47 1.46 -0.00 -1.24 -0.51 115.31 116.37 1ska h LEU 113 Ca 0.30 -0.48 0.05 0.00 -0.00 0.00 0.00 57.88 57.75 1ska h LEU 113 Cb 0.06 -0.19 -0.04 0.00 -0.00 0.00 0.00 40.66 40.48 1ska h LEU 113 CO -0.04 1.27 0.21 0.58 -0.00 0.00 0.00 178.44 180.46 1ska h VAL 114 N 0.30 0.92 -0.74 1.22 2.07 -1.06 -1.66 116.25 117.29 1ska h VAL 114 Ca -0.08 -0.15 0.06 0.00 0.82 0.00 0.00 66.70 67.36 1ska h VAL 114 Cb 1.53 0.46 -0.06 0.00 -1.52 0.00 0.00 31.29 31.70 1ska h VAL 114 CO 0.16 0.08 0.43 0.78 0.02 0.00 0.00 177.57 179.04 1ska h ASN 115 N 0.43 0.66 -0.72 0.57 2.35 -0.58 -1.57 115.58 116.72 1ska h ASN 115 Ca 0.21 0.03 0.03 0.00 -0.55 0.00 0.00 56.30 56.02 1ska h ASN 115 Cb 0.15 -0.11 -0.04 0.00 0.05 0.00 0.00 38.32 38.37 1ska h ASN 115 CO -0.17 0.42 0.46 -1.28 -1.65 0.00 0.00 177.43 175.20 1ska h SER 116 N 0.79 0.76 -0.60 5.81 0.87 -0.72 0.03 113.55 120.49 1ska h SER 116 Ca 0.33 -0.00 -0.08 0.00 -1.23 0.00 0.00 61.79 60.81 1ska h SER 116 Cb 0.19 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 61.96 1ska h SER 116 CO -0.18 0.53 0.07 1.23 -0.53 0.00 0.00 176.83 177.95 1ska h GLY 117 N 0.90 1.09 0.99 5.77 0.00 -0.53 -0.88 103.07 110.41 1ska h GLY 117 Ca 0.28 -0.74 0.00 0.00 0.00 0.00 0.00 47.33 46.87 1ska h GLY 117 CO -0.10 0.69 0.29 -2.22 0.00 0.00 0.00 176.54 175.20 1ska h ILE 118 N 0.91 1.13 -0.68 2.60 2.04 -0.95 -1.85 117.51 120.71 1ska h ILE 118 Ca 0.18 -0.27 -0.06 0.00 1.00 0.00 0.00 64.86 65.71 1ska h ILE 118 Cb 0.46 0.49 -0.03 0.00 -0.74 0.00 0.00 36.82 37.00 1ska h ILE 118 CO 0.02 0.13 0.20 0.50 0.00 0.00 0.00 178.15 178.99 1ska h LYS 119 N 0.61 1.06 -0.39 2.37 1.63 -0.90 -0.71 116.57 120.25 1ska h LYS 119 Ca 0.17 -0.24 0.04 0.00 -0.85 0.00 0.00 60.65 59.77 1ska h LYS 119 Cb -0.04 -0.15 -0.04 0.00 -0.60 0.00 0.00 32.23 31.41 1ska h LYS 119 CO -0.03 0.93 0.16 0.35 -3.45 0.00 0.00 179.45 177.40 1ska h PHE 120 N 0.99 0.29 -0.36 1.91 3.57 -1.00 0.11 116.94 122.46 1ska h PHE 120 Ca 0.22 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.73 1ska h PHE 120 Cb 0.32 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 38.97 1ska h PHE 120 CO 0.02 0.13 0.20 -0.92 -2.23 0.00 0.00 178.31 175.52 1ska h TYR 121 N 0.33 0.49 -0.55 0.41 5.03 -0.92 -2.20 116.97 119.56 1ska h TYR 121 Ca 0.17 -0.01 -0.08 0.00 2.58 0.00 0.00 58.73 61.39 1ska h TYR 121 Cb 0.12 -0.16 -0.02 0.00 1.55 0.00 0.00 36.73 38.22 1ska h TYR 121 CO -0.13 0.38 0.02 1.96 -1.32 0.00 0.00 178.16 179.08 1ska h GLN 122 N 0.46 0.96 -0.18 1.82 4.20 -0.77 -1.05 115.11 120.55 1ska h GLN 122 Ca 0.13 -0.29 -0.12 0.00 0.06 0.00 0.00 58.65 58.42 1ska h GLN 122 Cb 0.05 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.73 1ska h GLN 122 CO -0.02 0.95 -0.41 -0.09 -0.67 0.00 0.00 178.83 178.59 1ska h ARG 123 N 0.84 0.41 -0.47 1.46 2.43 -0.70 -3.15 114.38 115.20 1ska h ARG 123 Ca 0.16 -0.20 -0.30 0.00 -0.81 0.00 0.00 59.98 58.83 1ska h ARG 123 Cb 0.50 0.00 -0.19 0.00 -0.42 0.00 0.00 29.97 29.87 1ska h ARG 123 CO 0.02 0.75 -0.20 0.66 -1.51 0.00 0.00 179.97 179.69 1ska n TYR 124 N -4.02 1.57 -0.34 2.20 4.01 -0.84 -4.84 117.16 114.90 1ska n TYR 124 Ca -0.02 -1.89 0.04 0.00 -0.16 0.00 0.00 57.90 55.88 1ska n TYR 124 Cb 0.50 -0.53 0.20 0.00 -0.31 0.00 0.00 39.34 39.20 1ska n TYR 124 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 1ska h LYS 125 N 1.37 0.95 -0.11 -0.72 3.64 -1.15 0.17 116.57 120.72 1ska h LYS 125 Ca 0.27 -0.06 -0.04 0.00 -1.27 0.00 0.00 60.65 59.55 1ska h LYS 125 Cb 1.49 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 33.08 1ska h LYS 125 CO 0.56 0.63 -0.13 0.00 -2.27 0.00 0.00 179.45 178.23 1ska h ALA 126 N 1.49 1.59 0.05 5.00 0.00 -1.88 0.17 119.26 125.68 1ska h ALA 126 Ca 0.45 -0.18 -0.15 0.00 0.00 0.00 0.00 54.91 55.03 1ska h ALA 126 Cb 0.36 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 1ska h ALA 126 CO -0.23 0.30 -0.75 1.25 0.00 0.00 0.00 179.25 179.82 1ska h LEU 127 N 0.16 0.18 -1.86 0.00 6.46 -1.66 -3.38 115.31 115.21 1ska h LEU 127 Ca 0.03 -0.85 -0.03 0.00 -0.12 0.00 0.00 57.88 56.91 1ska h LEU 127 Cb 0.34 -0.06 -0.00 0.00 -0.73 0.00 0.00 40.66 40.20 1ska h LEU 127 CO 0.02 1.32 -0.12 0.00 -0.62 0.00 0.00 178.44 179.04 1ska h ALA 128 N -0.10 1.25 -0.64 1.25 0.00 -0.30 -2.39 119.26 118.33 1ska h ALA 128 Ca -0.17 -0.11 0.15 0.00 0.00 0.00 0.00 54.91 54.78 1ska h ALA 128 Cb 1.37 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 19.10 1ska h ALA 128 CO -0.00 0.15 0.44 0.00 0.00 0.00 0.00 179.25 179.84 1ska h ARG 129 N 0.00 0.17 -0.07 0.00 3.08 -0.85 -2.88 114.38 113.83 1ska h ARG 129 Ca -0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1ska h ARG 129 Cb 0.36 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.38 1ska h ARG 129 CO 0.02 0.11 0.00 -1.13 -1.07 0.00 0.00 179.97 177.90 1ska n SER 130 N -4.42 1.96 -4.28 7.04 3.41 -0.91 -1.25 113.62 115.18 1ska n SER 130 Ca 0.12 -1.71 -0.28 0.00 -0.26 0.00 0.00 58.87 56.74 1ska n SER 130 Cb 0.59 -0.05 -0.15 0.00 -0.26 0.00 0.00 64.21 64.34 1ska n SER 130 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1ska s VAL 131 N -0.76 1.83 -0.26 -3.33 1.01 -1.09 -4.69 120.40 113.11 1ska s VAL 131 Ca 0.06 -1.19 -0.05 0.00 0.00 0.00 0.00 61.98 60.80 1ska s VAL 131 Cb 0.04 -1.57 0.00 0.00 0.00 0.00 0.00 36.38 34.85 1ska s VAL 131 CO 0.05 0.33 0.03 -0.69 0.00 0.00 0.00 175.10 174.82 1ska s VAL 132 N -0.72 3.72 0.69 2.92 1.01 -1.26 -4.83 120.40 121.93 1ska s VAL 132 Ca 0.09 -0.61 -0.16 0.00 0.00 0.00 0.00 61.98 61.31 1ska s VAL 132 Cb -0.09 -2.83 0.02 0.00 0.00 0.00 0.00 36.38 33.48 1ska s VAL 132 CO 0.01 0.22 1.20 -2.84 0.00 0.00 0.00 175.10 173.69 1ska s PRO 133 N 1.49 2.38 -0.22 2.72 0.02 -1.26 -4.81 135.00 135.32 1ska s PRO 133 Ca 0.04 1.73 -0.16 0.00 0.02 0.00 0.00 61.00 62.62 1ska s PRO 133 Cb -0.16 -1.87 -0.04 0.00 0.02 0.00 0.00 34.50 32.46 1ska s PRO 133 CO 0.00 -1.64 0.42 0.12 -0.33 0.00 0.00 177.00 175.57 1ska s PHE 134 N -1.95 3.34 -0.09 6.54 5.36 0.09 -4.74 117.98 126.53 1ska s PHE 134 Ca 0.74 0.61 0.03 0.00 -0.96 0.00 0.00 56.93 57.35 1ska s PHE 134 Cb -0.28 -2.57 0.00 0.00 -0.34 0.00 0.00 43.02 39.83 1ska s PHE 134 CO 0.42 -0.08 -0.20 0.42 -1.46 0.00 0.00 175.22 174.33 1ska s ILE 135 N 1.55 1.72 0.19 3.12 1.01 -1.26 -1.26 121.20 126.28 1ska s ILE 135 Ca 0.19 -0.82 0.10 0.00 0.00 0.00 0.00 60.65 60.12 1ska s ILE 135 Cb -0.15 -1.51 -0.04 0.00 0.01 0.00 0.00 42.46 40.77 1ska s ILE 135 CO 0.09 0.48 -0.21 -0.13 0.00 0.00 0.00 174.94 175.17 1ska s ARG 136 N 0.43 1.45 -0.00 2.79 0.52 -0.61 -0.85 118.95 122.68 1ska s ARG 136 Ca -0.17 -1.52 0.00 0.00 -0.52 0.00 0.00 55.73 53.53 1ska s ARG 136 Cb -0.17 -1.64 0.00 0.00 0.52 0.00 0.00 34.95 33.66 1ska s ARG 136 CO 0.07 0.34 -0.00 0.00 0.02 0.00 0.00 175.30 175.73 1ska s ALA 137 N -1.93 0.02 0.47 2.13 0.00 -0.24 -1.35 121.76 120.86 1ska s ALA 137 Ca 0.20 -0.00 -0.22 0.00 0.00 0.00 0.00 51.96 51.94 1ska s ALA 137 Cb -0.07 -0.01 -0.07 0.00 0.00 0.00 0.00 23.12 22.97 1ska s ALA 137 CO 0.09 0.00 1.12 0.45 0.00 0.00 0.00 175.76 177.42 1ska s SER 138 N 0.01 6.20 -1.34 0.00 0.15 -0.25 -0.66 113.70 117.80 1ska s SER 138 Ca -0.00 2.17 -0.17 0.00 0.70 0.00 0.00 55.95 58.65 1ska s SER 138 Cb -0.00 -2.59 0.04 0.00 -1.71 0.00 0.00 66.02 61.76 1ska s SER 138 CO -0.00 -0.89 1.95 0.61 1.20 0.00 0.00 173.24 176.11 1ska n GLY 139 N 0.25 3.24 2.87 9.45 0.00 0.15 -4.37 105.19 116.78 1ska n GLY 139 Ca 0.08 -1.47 -0.17 0.00 0.00 0.00 0.00 46.02 44.46 1ska n GLY 139 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ska s SER 140 N 3.96 0.53 0.23 1.61 0.15 -1.26 -4.47 113.70 114.45 1ska s SER 140 Ca 0.52 -0.06 -0.06 0.00 0.70 0.00 0.00 55.95 57.05 1ska s SER 140 Cb 0.08 -0.21 0.37 0.00 -1.71 0.00 0.00 66.02 64.55 1ska s SER 140 CO 0.02 -0.04 1.78 0.44 1.20 0.00 0.00 173.24 176.64 1ska h ASP 141 N 6.85 0.51 -0.84 5.45 3.32 -2.00 -0.58 116.42 129.13 1ska h ASP 141 Ca -0.37 0.06 -0.02 0.00 0.02 0.00 0.00 57.03 56.72 1ska h ASP 141 Cb 1.16 -0.03 -0.04 0.00 0.22 0.00 0.00 39.33 40.64 1ska h ASP 141 CO 0.49 0.28 0.44 0.03 -1.72 0.00 0.00 179.24 178.76 1ska h ARG 142 N 0.64 1.19 -0.27 3.56 3.08 -1.95 -0.05 114.38 120.57 1ska h ARG 142 Ca 0.37 -0.15 -0.07 0.00 0.07 0.00 0.00 59.98 60.21 1ska h ARG 142 Cb 0.40 -0.23 -0.01 0.00 0.08 0.00 0.00 29.97 30.21 1ska h ARG 142 CO -0.27 0.88 -0.09 0.28 -1.07 0.00 0.00 179.97 179.69 1ska h VAL 143 N 1.19 1.29 -0.42 2.04 2.07 -1.51 -1.22 116.25 119.70 1ska h VAL 143 Ca 0.30 -1.15 -0.06 0.00 0.82 0.00 0.00 66.70 66.61 1ska h VAL 143 Cb 0.06 1.49 -0.02 0.00 -1.52 0.00 0.00 31.29 31.30 1ska h VAL 143 CO -0.04 0.36 0.02 0.40 0.02 0.00 0.00 177.57 178.33 1ska h ILE 144 N 0.27 1.26 -0.98 4.57 2.04 -1.00 -1.08 117.51 122.60 1ska h ILE 144 Ca 0.06 -0.98 0.04 0.00 1.00 0.00 0.00 64.86 64.98 1ska h ILE 144 Cb 0.59 1.07 -0.06 0.00 -0.74 0.00 0.00 36.82 37.67 1ska h ILE 144 CO 0.03 0.33 0.64 0.00 0.00 0.00 0.00 178.15 179.16 1ska h ALA 145 N 0.91 1.37 -0.79 1.87 0.00 -1.01 -0.58 119.26 121.04 1ska h ALA 145 Ca 0.12 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 1ska h ALA 145 Cb 0.45 -0.34 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 1ska h ALA 145 CO 0.02 0.52 0.33 0.77 0.00 0.00 0.00 179.25 180.89 1ska h SER 146 N 1.22 1.08 -0.56 0.00 0.02 -0.78 -1.28 113.55 113.25 1ska h SER 146 Ca 0.39 -0.17 0.00 0.00 -0.84 0.00 0.00 61.79 61.18 1ska h SER 146 Cb 0.02 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 62.26 1ska h SER 146 CO -0.12 0.95 0.36 1.23 -1.14 0.00 0.00 176.83 178.11 1ska h GLY 147 N 1.14 0.80 1.14 -3.77 0.00 -0.08 0.90 103.07 103.21 1ska h GLY 147 Ca 0.26 -0.31 -0.03 0.00 0.00 0.00 0.00 47.33 47.25 1ska h GLY 147 CO -0.02 0.31 0.35 0.83 0.00 0.00 0.00 176.54 178.00 1ska h GLU 148 N 0.76 1.10 -0.30 4.80 5.08 -0.80 -0.72 114.58 124.50 1ska h GLU 148 Ca 0.20 -0.17 -0.16 0.00 -1.00 0.00 0.00 59.36 58.23 1ska h GLU 148 Cb -0.06 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 28.99 1ska h GLU 148 CO -0.04 0.86 -0.46 0.87 -1.00 0.00 0.00 179.01 179.25 1ska h LYS 149 N 1.09 0.80 -0.79 2.33 1.79 -0.85 -0.47 116.57 120.48 1ska h LYS 149 Ca 0.26 -0.45 -0.01 0.00 -2.18 0.00 0.00 60.65 58.27 1ska h LYS 149 Cb 0.14 0.03 -0.04 0.00 -1.58 0.00 0.00 32.23 30.78 1ska h LYS 149 CO -0.03 1.08 0.45 0.35 -1.08 0.00 0.00 179.45 180.22 1ska h PHE 150 N 0.64 1.07 -0.57 -1.35 3.04 -0.53 -1.24 116.94 117.99 1ska h PHE 150 Ca 0.04 -0.02 -0.04 0.00 3.98 0.00 0.00 57.97 61.93 1ska h PHE 150 Cb 1.03 -0.34 -0.02 0.00 2.56 0.00 0.00 35.95 39.17 1ska h PHE 150 CO 0.06 0.74 0.20 0.82 -2.02 0.00 0.00 178.31 178.11 1ska h ILE 151 N 1.09 1.23 -0.48 1.41 2.04 -0.83 0.23 117.51 122.21 1ska h ILE 151 Ca 0.28 -0.76 0.07 0.00 1.00 0.00 0.00 64.86 65.45 1ska h ILE 151 Cb 0.01 0.65 -0.06 0.00 -0.74 0.00 0.00 36.82 36.68 1ska h ILE 151 CO -0.05 0.29 0.13 -0.08 0.00 0.00 0.00 178.15 178.44 1ska h GLU 152 N 0.80 0.27 -0.46 2.37 4.81 -0.54 0.52 114.58 122.35 1ska h GLU 152 Ca 0.19 -0.02 -0.13 0.00 -0.13 0.00 0.00 59.36 59.27 1ska h GLU 152 Cb 0.25 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 1ska h GLU 152 CO -0.01 0.18 -0.23 0.78 -0.73 0.00 0.00 179.01 179.00 1ska h GLY 153 N 0.28 1.05 0.89 1.92 0.00 -0.63 -0.56 103.07 106.01 1ska h GLY 153 Ca 0.24 -0.95 0.02 0.00 0.00 0.00 0.00 47.33 46.63 1ska h GLY 153 CO -0.28 0.86 0.22 -2.75 0.00 0.00 0.00 176.54 174.60 1ska h PHE 154 N 0.81 0.42 -0.43 5.60 3.57 -0.48 -1.36 116.94 125.07 1ska h PHE 154 Ca 0.10 0.01 -0.13 0.00 3.53 0.00 0.00 57.97 61.49 1ska h PHE 154 Cb 0.81 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.40 1ska h PHE 154 CO 0.06 0.24 -0.23 1.96 -2.23 0.00 0.00 178.31 178.10 1ska h GLN 155 N 0.46 0.88 -0.37 1.11 1.08 -0.85 0.05 115.11 117.47 1ska h GLN 155 Ca 0.16 -0.37 0.06 0.00 -1.45 0.00 0.00 58.65 57.04 1ska h GLN 155 Cb 0.02 -0.03 -0.05 0.00 -0.05 0.00 0.00 27.48 27.36 1ska h GLN 155 CO -0.08 1.02 0.06 0.37 -0.95 0.00 0.00 178.83 179.25 1ska h GLN 156 N 0.76 0.17 -0.17 1.46 4.15 -0.72 0.11 115.11 120.87 1ska h GLN 156 Ca 0.10 -0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.50 1ska h GLN 156 Cb 0.78 -0.04 -0.01 0.00 0.21 0.00 0.00 27.48 28.42 1ska h GLN 156 CO 0.06 0.11 0.06 0.00 -1.93 0.00 0.00 178.83 177.14 1ska h ALA 157 N 1.29 0.22 -0.22 3.38 0.00 -1.18 -3.01 119.26 119.74 1ska h ALA 157 Ca 0.18 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1ska h ALA 157 Cb 0.22 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1ska h ALA 157 CO -0.25 -0.17 0.14 -0.22 0.00 0.00 0.00 179.25 178.75 1ska h LYS 158 N 0.11 0.30 0.00 0.00 3.64 -0.66 -2.54 116.57 117.43 1ska h LYS 158 Ca 0.06 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1ska h LYS 158 Cb 0.20 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.96 1ska h LYS 158 CO -0.00 0.24 0.00 -0.11 -2.27 0.00 0.00 179.45 177.31 1ska n LEU 159 N -4.90 0.00 -0.42 5.20 7.94 0.36 -1.43 117.00 123.75 1ska n LEU 159 Ca -0.03 0.48 0.13 0.00 -1.11 0.00 0.00 56.01 55.48 1ska n LEU 159 Cb 0.05 -0.48 0.29 0.00 0.53 0.00 0.00 43.42 43.81 1ska n LEU 159 CO 0.34 -0.24 0.61 0.00 -1.11 0.00 0.00 177.39 176.99 1ska n ALA 160 N -1.48 3.04 -2.58 1.96 0.00 -0.97 -4.85 120.51 115.63 1ska n ALA 160 Ca 0.04 -0.50 -0.41 0.00 0.00 0.00 0.00 53.44 52.57 1ska n ALA 160 Cb 0.16 -1.03 -0.10 0.00 0.00 0.00 0.00 19.45 18.48 1ska n ALA 160 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1ska s ASP 161 N -2.35 5.98 0.28 0.00 2.15 -0.52 -4.96 116.67 117.25 1ska s ASP 161 Ca 0.26 -0.77 0.23 0.00 0.43 0.00 0.00 52.55 52.69 1ska s ASP 161 Cb 0.19 -2.11 1.04 0.00 -0.30 0.00 0.00 42.92 41.74 1ska s ASP 161 CO 0.48 -0.36 1.69 -0.81 -0.17 0.00 0.00 175.17 175.99 1ska n PRO 162 N 5.10 0.18 -0.01 4.34 -0.04 -1.26 -1.81 135.00 141.50 1ska n PRO 162 Ca -0.12 0.50 0.14 0.00 -0.04 0.00 0.00 63.50 63.98 1ska n PRO 162 Cb 0.48 -1.90 0.72 0.00 -0.04 0.00 0.00 33.50 32.76 1ska n PRO 162 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ska n GLY 163 N -0.45 -0.64 3.71 0.55 0.00 -1.26 -4.88 105.19 102.22 1ska n GLY 163 Ca 0.01 -0.26 -0.42 0.00 0.00 0.00 0.00 46.02 45.34 1ska n GLY 163 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ska s ALA 164 N -1.98 3.19 -0.31 4.61 0.00 -0.75 -4.89 121.76 121.64 1ska s ALA 164 Ca 0.41 0.58 0.09 0.00 0.00 0.00 0.00 51.96 53.04 1ska s ALA 164 Cb 0.20 -3.35 -0.12 0.00 0.00 0.00 0.00 23.12 19.85 1ska s ALA 164 CO 0.32 -0.25 0.34 0.25 0.00 0.00 0.00 175.76 176.42 1ska n THR 165 N 3.86 0.00 -3.65 0.00 -2.24 -0.38 -4.85 114.28 107.02 1ska n THR 165 Ca 0.06 -0.26 -0.29 0.00 -2.27 0.00 0.00 64.05 61.30 1ska n THR 165 Cb 0.50 0.77 -0.16 0.00 -2.10 0.00 0.00 70.33 69.35 1ska n THR 165 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1ska s ASN 167 N -2.27 3.42 0.00 3.42 3.84 -1.06 -4.98 114.94 117.30 1ska s ASN 167 Ca 0.01 -1.22 0.11 0.00 0.21 0.00 0.00 52.86 51.98 1ska s ASN 167 Cb 0.07 -0.55 0.27 0.00 -0.55 0.00 0.00 41.25 40.49 1ska s ASN 167 CO 0.39 -0.39 1.17 0.54 -2.79 0.00 0.00 177.10 176.02 1ska n ARG 168 N 5.09 2.33 -1.67 0.43 1.74 -1.26 -4.55 116.66 118.77 1ska n ARG 168 Ca -0.06 -1.87 -0.44 0.00 -0.77 0.00 0.00 57.85 54.72 1ska n ARG 168 Cb 0.44 -1.27 -0.01 0.00 -1.02 0.00 0.00 32.46 30.60 1ska n ARG 168 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ska n ALA 169 N 0.59 0.90 -1.78 7.54 0.00 -1.26 -4.94 120.51 121.56 1ska n ALA 169 Ca 0.11 0.38 -0.37 0.00 0.00 0.00 0.00 53.44 53.56 1ska n ALA 169 Cb 0.40 -2.21 -0.06 0.00 0.00 0.00 0.00 19.45 17.58 1ska n ALA 169 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ska s ALA 170 N -0.82 3.22 0.51 0.00 0.00 -1.26 -4.89 121.76 118.52 1ska s ALA 170 Ca 0.59 0.54 -0.17 0.00 0.00 0.00 0.00 51.96 52.92 1ska s ALA 170 Cb -0.62 -3.19 -0.08 0.00 0.00 0.00 0.00 23.12 19.23 1ska s ALA 170 CO 0.59 0.16 0.99 -1.25 0.00 0.00 0.00 175.76 176.25 1ska s PRO 171 N -1.99 3.89 0.24 0.00 0.04 -1.26 -5.05 135.00 130.87 1ska s PRO 171 Ca 0.50 1.04 0.07 0.00 0.04 0.00 0.00 61.00 62.64 1ska s PRO 171 Cb -0.20 -2.13 -0.04 0.00 0.04 0.00 0.00 34.50 32.18 1ska s PRO 171 CO 0.25 -0.32 0.20 0.00 0.04 0.00 0.00 177.00 177.16 1ska s ALA 172 N -2.50 3.60 -0.52 8.56 0.00 -1.26 -5.04 121.76 124.59 1ska s ALA 172 Ca 0.60 -1.38 -0.28 0.00 0.00 0.00 0.00 51.96 50.90 1ska s ALA 172 Cb -0.11 -1.33 0.03 0.00 0.00 0.00 0.00 23.12 21.71 1ska s ALA 172 CO 0.29 0.29 1.23 0.42 0.00 0.00 0.00 175.76 177.99 1ska s ILE 173 N -2.07 4.03 0.06 0.00 1.01 -1.26 -4.30 121.20 118.67 1ska s ILE 173 Ca 0.33 0.98 0.12 0.00 0.00 0.00 0.00 60.65 62.07 1ska s ILE 173 Cb -0.08 -4.59 -0.05 0.00 0.01 0.00 0.00 42.46 37.75 1ska s ILE 173 CO 0.25 -1.14 1.44 0.28 0.00 0.00 0.00 174.94 175.77 1ska h SER 174 N 9.79 0.00 -3.37 3.58 0.02 -1.39 -3.45 113.55 118.73 1ska h SER 174 Ca -0.25 0.00 -0.38 0.00 -0.84 0.00 0.00 61.79 60.32 1ska h SER 174 Cb 1.07 0.00 -0.37 0.00 0.14 0.00 0.00 62.40 63.24 1ska h SER 174 CO 1.15 0.71 -0.75 -0.69 -1.14 0.00 0.00 176.83 176.11 1ska s VAL 175 N -3.04 0.15 -0.29 2.27 1.01 -1.20 -5.00 120.40 114.29 1ska s VAL 175 Ca 0.01 0.20 -0.08 0.00 0.00 0.00 0.00 61.98 62.12 1ska s VAL 175 Cb 0.10 -0.31 -0.00 0.00 0.00 0.00 0.00 36.38 36.16 1ska s VAL 175 CO 0.77 0.19 0.10 -0.63 0.00 0.00 0.00 175.10 175.53 1ska s ILE 176 N 1.65 4.21 -0.27 2.22 1.01 -1.26 -1.08 121.20 127.69 1ska s ILE 176 Ca -0.01 -0.52 -0.14 0.00 0.00 0.00 0.00 60.65 59.99 1ska s ILE 176 Cb -0.13 -3.12 -0.04 0.00 0.01 0.00 0.00 42.46 39.18 1ska s ILE 176 CO -0.03 0.13 0.32 -0.63 0.00 0.00 0.00 174.94 174.73 1ska s ILE 177 N 1.55 5.22 0.57 2.92 1.01 0.16 -4.84 121.20 127.79 1ska s ILE 177 Ca 0.04 0.46 -0.20 0.00 0.00 0.00 0.00 60.65 60.95 1ska s ILE 177 Cb -0.17 -3.65 -0.04 0.00 0.01 0.00 0.00 42.46 38.61 1ska s ILE 177 CO 0.04 0.19 1.26 -2.65 0.00 0.00 0.00 174.94 173.78 1ska n PRO 178 N 5.20 1.41 -3.69 2.79 -0.02 -1.26 0.31 135.00 139.73 1ska n PRO 178 Ca -0.10 0.53 -0.39 0.00 -2.02 0.00 0.00 63.50 61.52 1ska n PRO 178 Cb 0.51 -2.47 -0.11 0.00 -0.02 0.00 0.00 33.50 31.41 1ska n PRO 178 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1ska s GLU 179 N -2.94 2.59 0.39 -0.52 2.02 -1.26 -4.70 118.70 114.27 1ska s GLU 179 Ca 0.75 -1.31 -0.11 0.00 0.02 0.00 0.00 54.97 54.31 1ska s GLU 179 Cb -0.42 -3.60 0.04 0.00 0.10 0.00 0.00 34.13 30.26 1ska s GLU 179 CO 0.47 -0.79 0.71 -1.54 0.02 0.00 0.00 175.26 174.13 1ska s SER 180 N 1.68 0.32 0.14 -0.19 1.04 -1.26 -5.01 113.70 110.42 1ska s SER 180 Ca 0.01 -1.30 0.27 0.00 0.48 0.00 0.00 55.95 55.41 1ska s SER 180 Cb -0.21 0.82 0.93 0.00 0.10 0.00 0.00 66.02 67.66 1ska s SER 180 CO 0.02 -1.62 1.81 1.21 0.98 0.00 0.00 173.24 175.65 1ska n GLU 181 N -0.56 0.18 -0.01 4.02 2.13 -1.26 -4.09 120.64 121.05 1ska n GLU 181 Ca -0.06 0.15 0.01 0.00 0.66 0.00 0.00 57.16 57.91 1ska n GLU 181 Cb 0.60 -1.71 0.01 0.00 0.27 0.00 0.00 31.44 30.61 1ska n GLU 181 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 1ska n THR 182 N -2.02 0.34 -3.53 6.31 -2.24 -1.26 -4.25 114.28 107.63 1ska n THR 182 Ca 0.06 -0.67 -0.37 0.00 -2.27 0.00 0.00 64.05 60.81 1ska n THR 182 Cb 0.40 0.85 -0.07 0.00 -2.10 0.00 0.00 70.33 69.41 1ska n THR 182 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1ska s PHE 183 N -0.40 3.43 -0.60 4.78 2.19 -1.26 -5.03 117.98 121.09 1ska s PHE 183 Ca 0.02 0.55 -0.28 0.00 0.33 0.00 0.00 56.93 57.55 1ska s PHE 183 Cb 0.01 -2.36 0.02 0.00 -1.31 0.00 0.00 43.02 39.37 1ska s PHE 183 CO 0.02 0.17 1.36 -0.80 1.83 0.00 0.00 175.22 177.79 1ska s ASN 184 N 0.65 6.17 -0.21 6.13 0.01 -1.26 -4.64 114.94 121.78 1ska s ASN 184 Ca 0.16 0.11 0.01 0.00 -0.71 0.00 0.00 52.86 52.43 1ska s ASN 184 Cb -0.13 -2.55 0.04 0.00 0.41 0.00 0.00 41.25 39.02 1ska s ASN 184 CO 0.04 -1.71 -0.12 0.21 -1.51 0.00 0.00 177.10 174.01 1ska s ASN 185 N 4.12 3.58 0.00 -1.22 3.84 -1.15 -3.99 114.94 120.11 1ska s ASN 185 Ca 0.48 -0.96 0.24 0.00 0.21 0.00 0.00 52.86 52.83 1ska s ASN 185 Cb -0.10 -1.34 1.13 0.00 -0.55 0.00 0.00 41.25 40.39 1ska s ASN 185 CO 0.23 -0.13 1.80 0.35 -2.79 0.00 0.00 177.10 176.56 1ska n THR 186 N 4.62 0.28 0.49 -5.21 -2.24 -1.23 -3.05 114.28 107.94 1ska n THR 186 Ca -0.16 0.07 0.12 0.00 -2.27 0.00 0.00 64.05 61.81 1ska n THR 186 Cb 0.46 -0.66 0.21 0.00 -2.10 0.00 0.00 70.33 68.24 1ska n THR 186 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1ska n LEU 187 N -1.41 3.28 -3.69 3.22 4.77 -1.26 -4.28 117.00 117.62 1ska n LEU 187 Ca 0.08 -1.36 -0.11 0.00 -0.03 0.00 0.00 56.01 54.60 1ska n LEU 187 Cb 0.25 -0.20 -0.06 0.00 -2.33 0.00 0.00 43.42 41.08 1ska n LEU 187 CO 0.21 0.68 0.10 -0.62 -1.33 0.00 0.00 177.39 176.43 1ska s ASP 188 N -1.59 -0.18 0.16 -1.43 2.15 -1.17 -3.79 116.67 110.82 1ska s ASP 188 Ca 0.37 -0.27 0.04 0.00 0.43 0.00 0.00 52.55 53.11 1ska s ASP 188 Cb 0.22 0.42 -0.04 0.00 -0.30 0.00 0.00 42.92 43.23 1ska s ASP 188 CO 0.31 -0.75 0.25 -1.38 -0.17 0.00 0.00 175.17 173.43 1ska s HIS 189 N -3.28 3.38 0.00 -5.34 -3.43 -1.26 -4.59 115.29 100.77 1ska s HIS 189 Ca -0.00 0.06 0.00 0.00 -0.80 0.00 0.00 55.06 54.32 1ska s HIS 189 Cb 0.01 -1.61 0.00 0.00 -1.43 0.00 0.00 32.58 29.56 1ska s HIS 189 CO -0.08 0.51 0.00 0.41 -2.00 0.00 0.00 174.74 173.58 1ska n GLY 190 N -0.58 0.00 0.25 -1.38 0.00 -1.26 -4.88 105.19 97.34 1ska n GLY 190 Ca -0.08 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.06 1ska n GLY 190 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1ska n VAL 191 N -0.06 0.00 -2.89 1.61 0.24 -1.26 -4.50 118.33 111.46 1ska n VAL 191 Ca 0.00 -0.13 -0.43 0.00 -2.04 0.00 0.00 64.34 61.74 1ska n VAL 191 Cb 0.00 0.80 -0.03 0.00 -1.47 0.00 0.00 33.84 33.14 1ska n VAL 191 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ska h THR 193 N 5.93 0.40 -0.84 0.00 2.02 -1.84 -1.59 112.91 116.99 1ska h THR 193 Ca 0.01 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.20 1ska h THR 193 Cb 1.04 0.40 -0.04 0.00 -1.74 0.00 0.00 68.15 67.81 1ska h THR 193 CO 1.15 0.00 0.55 0.50 0.37 0.00 0.00 175.52 178.09 1ska h LYS 194 N -0.29 1.10 -1.00 6.66 3.64 -1.04 -2.20 116.57 123.45 1ska h LYS 194 Ca 0.11 -0.07 0.06 0.00 -1.27 0.00 0.00 60.65 59.48 1ska h LYS 194 Cb 0.46 -0.25 -0.06 0.00 -0.41 0.00 0.00 32.23 31.97 1ska h LYS 194 CO -0.34 0.73 0.65 0.35 -2.27 0.00 0.00 179.45 178.57 1ska h PHE 195 N 1.13 1.20 0.00 1.91 3.57 -1.57 -2.60 116.94 120.59 1ska h PHE 195 Ca 0.31 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.82 1ska h PHE 195 Cb -0.13 -0.40 -0.00 0.00 2.79 0.00 0.00 35.95 38.21 1ska h PHE 195 CO -0.01 0.64 -0.08 0.93 -2.23 0.00 0.00 178.31 177.56 1ska h GLU 196 N 1.20 0.00 -0.00 1.11 4.39 -0.74 -1.12 114.58 119.41 1ska h GLU 196 Ca 0.42 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.12 1ska h GLU 196 Cb 0.12 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.77 1ska h GLU 196 CO -0.16 0.08 -0.21 0.00 -1.16 0.00 0.00 179.01 177.56 1ska n ALA 197 N -2.26 2.94 -1.85 3.43 0.00 -0.99 -4.93 120.51 116.85 1ska n ALA 197 Ca -0.02 -0.31 -0.41 0.00 0.00 0.00 0.00 53.44 52.70 1ska n ALA 197 Cb 0.19 -1.25 -0.03 0.00 0.00 0.00 0.00 19.45 18.36 1ska n ALA 197 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1ska s SER 198 N -2.61 6.85 0.00 0.00 0.15 -0.43 -4.91 113.70 112.75 1ska s SER 198 Ca 0.23 2.56 0.08 0.00 0.70 0.00 0.00 55.95 59.52 1ska s SER 198 Cb 0.19 -2.63 0.16 0.00 -1.71 0.00 0.00 66.02 62.03 1ska s SER 198 CO 0.53 -0.51 1.00 0.00 1.20 0.00 0.00 173.24 175.46 1ska n GLN 199 N 1.59 1.71 -0.11 5.44 6.02 -1.26 -4.84 117.38 125.93 1ska n GLN 199 Ca 0.03 -1.51 -0.09 0.00 -0.01 0.00 0.00 57.00 55.42 1ska n GLN 199 Cb 0.42 -1.18 -0.01 0.00 1.02 0.00 0.00 30.24 30.49 1ska n GLN 199 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 1ska h LEU 200 N 1.54 0.45 -0.94 1.08 5.85 -1.91 -0.71 115.31 120.67 1ska h LEU 200 Ca 0.00 -0.10 0.01 0.00 0.84 0.00 0.00 57.88 58.63 1ska h LEU 200 Cb 0.53 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.40 1ska h LEU 200 CO 0.00 0.42 0.61 1.23 -0.34 0.00 0.00 178.44 180.36 1ska h GLY 201 N 0.45 1.33 0.91 3.75 0.00 -1.85 0.32 103.07 107.98 1ska h GLY 201 Ca 0.12 -0.51 -0.04 0.00 0.00 0.00 0.00 47.33 46.91 1ska h GLY 201 CO -0.02 0.50 0.08 -0.55 0.00 0.00 0.00 176.54 176.55 1ska h ASP 202 N 1.28 0.54 -0.49 0.19 3.32 -1.76 0.25 116.42 119.75 1ska h ASP 202 Ca 0.34 -0.24 -0.04 0.00 0.02 0.00 0.00 57.03 57.11 1ska h ASP 202 Cb -0.12 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.26 1ska h ASP 202 CO -0.07 0.64 0.15 -0.33 -1.72 0.00 0.00 179.24 177.91 1ska h GLU 203 N 0.41 0.76 -0.35 3.56 5.08 -0.56 -0.29 114.58 123.19 1ska h GLU 203 Ca 0.11 -0.17 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 1ska h GLU 203 Cb 0.32 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 1ska h GLU 203 CO 0.00 0.72 0.17 0.28 -1.00 0.00 0.00 179.01 179.18 1ska h VAL 204 N 0.66 1.16 -0.66 3.13 2.07 -0.85 -0.21 116.25 121.56 1ska h VAL 204 Ca 0.16 -0.46 -0.06 0.00 0.82 0.00 0.00 66.70 67.16 1ska h VAL 204 Cb 0.28 0.82 -0.03 0.00 -1.52 0.00 0.00 31.29 30.84 1ska h VAL 204 CO -0.00 0.17 0.19 0.00 0.02 0.00 0.00 177.57 177.95 1ska h ALA 205 N 1.02 0.87 -0.43 1.67 0.00 -0.79 -1.03 119.26 120.57 1ska h ALA 205 Ca 0.12 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.73 1ska h ALA 205 Cb 0.12 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1ska h ALA 205 CO -0.02 0.56 -0.03 0.00 0.00 0.00 0.00 179.25 179.76 1ska h ALA 206 N 1.08 0.58 -0.83 0.00 0.00 -0.88 0.17 119.26 119.38 1ska h ALA 206 Ca 0.21 -0.29 0.04 0.00 0.00 0.00 0.00 54.91 54.87 1ska h ALA 206 Cb 0.32 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.90 1ska h ALA 206 CO -0.00 0.40 0.53 -0.91 0.00 0.00 0.00 179.25 179.26 1ska h ASN 207 N 0.61 0.87 -0.18 0.00 4.21 -0.73 -0.96 115.58 119.41 1ska h ASN 207 Ca 0.12 -0.00 -0.08 0.00 1.21 0.00 0.00 56.30 57.54 1ska h ASN 207 Cb 0.53 -0.19 -0.00 0.00 -1.12 0.00 0.00 38.32 37.54 1ska h ASN 207 CO 0.03 0.59 -0.22 0.15 -1.29 0.00 0.00 177.43 176.69 1ska h PHE 208 N 1.02 0.57 -0.84 1.19 3.57 -0.81 -2.43 116.94 119.22 1ska h PHE 208 Ca 0.33 -0.18 0.15 0.00 3.53 0.00 0.00 57.97 61.80 1ska h PHE 208 Cb 0.02 -0.12 -0.09 0.00 2.79 0.00 0.00 35.95 38.55 1ska h PHE 208 CO -0.03 0.85 0.42 1.15 -2.23 0.00 0.00 178.31 178.48 1ska h THR 209 N 0.12 0.71 0.00 4.41 2.02 -0.55 -1.21 112.91 118.42 1ska h THR 209 Ca 0.02 -0.20 -0.02 0.00 0.77 0.00 0.00 66.41 66.98 1ska h THR 209 Cb 0.78 0.07 -0.00 0.00 -1.74 0.00 0.00 68.15 67.25 1ska h THR 209 CO 0.05 0.11 -0.08 0.00 0.37 0.00 0.00 175.52 175.97 1ska h ALA 210 N 1.56 1.03 0.15 6.16 0.00 -0.83 -1.30 119.26 126.03 1ska h ALA 210 Ca 0.46 -0.07 -0.27 0.00 0.00 0.00 0.00 54.91 55.03 1ska h ALA 210 Cb 0.66 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.45 1ska h ALA 210 CO -0.37 0.10 -1.30 -0.07 0.00 0.00 0.00 179.25 177.61 1ska h LEU 211 N 0.00 0.51 0.00 0.00 3.38 -0.89 -3.41 115.31 114.90 1ska h LEU 211 Ca -0.00 -0.90 -0.30 0.00 0.09 0.00 0.00 57.88 56.77 1ska h LEU 211 Cb 0.57 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 41.10 1ska h LEU 211 CO 0.01 1.59 -1.81 2.22 0.09 0.00 0.00 178.44 180.55 1ska n PHE 212 N -3.91 0.83 0.05 1.13 -1.74 -0.53 -4.55 117.46 108.75 1ska n PHE 212 Ca -0.21 0.30 -0.09 0.00 -0.56 0.00 0.00 57.45 56.90 1ska n PHE 212 Cb 0.93 -1.15 0.05 0.00 1.52 0.00 0.00 39.48 40.83 1ska n PHE 212 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1ska h ALA 213 N 1.02 0.66 -0.67 1.98 0.00 -1.47 -3.38 119.26 117.40 1ska h ALA 213 Ca -0.32 -0.58 0.14 0.00 0.00 0.00 0.00 54.91 54.15 1ska h ALA 213 Cb 2.03 -0.07 -0.10 0.00 0.00 0.00 0.00 17.79 19.65 1ska h ALA 213 CO 0.07 0.75 0.11 -1.35 0.00 0.00 0.00 179.25 178.83 1ska h PRO 214 N 0.27 0.21 -0.31 0.00 0.11 -1.79 0.16 132.00 130.66 1ska h PRO 214 Ca -0.02 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 66.04 1ska h PRO 214 Cb 1.24 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.29 1ska h PRO 214 CO 0.12 0.14 0.02 -0.44 -0.21 0.00 0.00 178.00 177.62 1ska h ASP 215 N 0.21 0.43 0.12 -2.05 3.32 -1.90 -1.06 116.42 115.50 1ska h ASP 215 Ca 0.37 -0.07 -0.25 0.00 0.02 0.00 0.00 57.03 57.10 1ska h ASP 215 Cb 0.60 -0.11 0.01 0.00 0.22 0.00 0.00 39.33 40.05 1ska h ASP 215 CO -0.50 0.48 -0.99 0.40 -1.72 0.00 0.00 179.24 176.91 1ska h ILE 216 N 0.45 1.32 -0.38 0.35 2.04 -1.42 -2.57 117.51 117.31 1ska h ILE 216 Ca 0.10 -2.30 0.05 0.00 1.00 0.00 0.00 64.86 63.71 1ska h ILE 216 Cb 0.27 2.37 -0.05 0.00 -0.74 0.00 0.00 36.82 38.68 1ska h ILE 216 CO 0.01 0.70 0.10 -0.09 0.00 0.00 0.00 178.15 178.87 1ska h ARG 217 N 0.34 0.24 -0.27 2.37 1.12 -0.26 0.12 114.38 118.04 1ska h ARG 217 Ca -0.11 -0.01 -0.01 0.00 -1.11 0.00 0.00 59.98 58.74 1ska h ARG 217 Cb 1.64 -0.05 -0.01 0.00 -0.01 0.00 0.00 29.97 31.53 1ska h ARG 217 CO 0.19 0.16 0.14 0.00 -3.11 0.00 0.00 179.97 177.34 1ska h ALA 218 N 1.26 0.35 -0.35 2.80 0.00 -1.23 -0.60 119.26 121.50 1ska h ALA 218 Ca 0.18 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 1ska h ALA 218 Cb 0.18 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1ska h ALA 218 CO -0.21 -0.09 -0.12 -0.09 0.00 0.00 0.00 179.25 178.74 1ska h ARG 219 N 0.31 0.69 -0.65 0.00 2.43 -1.15 -2.90 114.38 113.12 1ska h ARG 219 Ca 0.09 -0.28 -0.00 0.00 -0.81 0.00 0.00 59.98 58.98 1ska h ARG 219 Cb 0.11 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.60 1ska h ARG 219 CO -0.01 0.87 0.39 0.00 -1.51 0.00 0.00 179.97 179.71 1ska h ALA 220 N 0.80 0.83 -0.29 2.80 0.00 -0.66 -2.80 119.26 119.93 1ska h ALA 220 Ca 0.08 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 54.94 1ska h ALA 220 Cb 0.64 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1ska h ALA 220 CO 0.04 0.31 0.20 0.93 0.00 0.00 0.00 179.25 180.72 1ska h GLU 221 N 0.88 0.26 0.00 0.00 5.08 -0.91 -1.64 114.58 118.25 1ska h GLU 221 Ca 0.23 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 1ska h GLU 221 Cb -0.02 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.17 1ska h GLU 221 CO -0.04 0.18 0.00 1.17 -1.00 0.00 0.00 179.01 179.31 1ska n LYS 222 N -4.49 0.17 0.00 2.33 0.00 -1.06 -1.17 118.16 113.94 1ska n LYS 222 Ca 0.02 0.22 0.14 0.00 0.00 0.00 0.00 58.31 58.69 1ska n LYS 222 Cb 0.17 -1.73 0.55 0.00 0.00 0.00 0.00 35.03 34.02 1ska n LYS 222 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.40 178.12 1ska n HIS 223 N -2.03 0.00 -3.18 5.64 8.25 -0.62 -4.40 115.22 118.88 1ska n HIS 223 Ca 0.05 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.29 1ska n HIS 223 Cb 0.34 -0.11 -0.05 0.00 1.12 0.00 0.00 29.99 31.29 1ska n HIS 223 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1ska n LEU 224 N -0.64 1.21 -4.61 2.41 4.77 -0.32 -0.58 117.00 119.24 1ska n LEU 224 Ca 0.15 -5.00 -0.50 0.00 -0.03 0.00 0.00 56.01 50.63 1ska n LEU 224 Cb 0.30 0.45 -0.05 0.00 -2.33 0.00 0.00 43.42 41.79 1ska n LEU 224 CO 0.22 2.20 0.98 -0.81 -1.33 0.00 0.00 177.39 178.65 1ska n PRO 225 N 0.66 1.45 0.00 3.23 -0.04 -1.22 -0.90 135.00 138.18 1ska n PRO 225 Ca 0.25 0.52 0.00 0.00 -0.04 0.00 0.00 63.50 64.23 1ska n PRO 225 Cb 0.57 -2.20 0.00 0.00 -0.04 0.00 0.00 33.50 31.83 1ska n PRO 225 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ska n GLY 226 N 2.74 1.64 3.71 0.55 0.00 -1.26 -0.16 105.19 112.40 1ska n GLY 226 Ca 0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 1ska n GLY 226 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ska s VAL 227 N -2.25 4.42 -0.12 1.61 1.01 -0.08 -4.63 120.40 120.36 1ska s VAL 227 Ca 0.00 -0.26 0.01 0.00 0.00 0.00 0.00 61.98 61.74 1ska s VAL 227 Cb 0.00 -2.89 -0.01 0.00 0.00 0.00 0.00 36.38 33.48 1ska s VAL 227 CO 0.00 0.57 -0.17 -0.89 0.00 0.00 0.00 175.10 174.61 1ska s THR 228 N -0.94 2.65 0.22 3.92 2.01 -1.26 -4.86 115.64 117.38 1ska s THR 228 Ca 0.15 -0.80 0.09 0.00 0.31 0.00 0.00 61.69 61.44 1ska s THR 228 Cb -0.11 -2.08 -0.04 0.00 0.01 0.00 0.00 72.50 70.27 1ska s THR 228 CO 0.04 0.54 -0.08 -0.76 -0.69 0.00 0.00 174.62 173.66 1ska s LEU 229 N 0.42 2.99 0.48 4.42 1.43 -1.26 -5.06 118.68 122.10 1ska s LEU 229 Ca -0.13 -0.66 0.06 0.00 -1.03 0.00 0.00 54.13 52.38 1ska s LEU 229 Cb -0.17 -1.60 0.00 0.00 0.03 0.00 0.00 46.19 44.45 1ska s LEU 229 CO 0.06 0.06 0.34 0.42 0.23 0.00 0.00 176.35 177.46 1ska s THR 230 N -1.99 2.05 0.27 5.49 -4.23 -1.26 -4.97 115.64 110.99 1ska s THR 230 Ca 0.27 -1.51 -0.04 0.00 -1.18 0.00 0.00 61.69 59.23 1ska s THR 230 Cb -0.08 -2.56 0.25 0.00 1.34 0.00 0.00 72.50 71.46 1ska s THR 230 CO 0.17 0.00 1.93 0.44 -0.54 0.00 0.00 174.62 176.62 1ska h ASP 231 N 0.99 1.07 0.11 3.99 3.32 -1.95 -2.33 116.42 121.62 1ska h ASP 231 Ca -0.39 -0.04 -0.10 0.00 0.02 0.00 0.00 57.03 56.51 1ska h ASP 231 Cb 1.28 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 40.55 1ska h ASP 231 CO 0.61 0.79 -0.35 -0.08 -1.72 0.00 0.00 179.24 178.48 1ska h GLU 232 N 1.25 0.34 -0.72 3.56 4.57 -1.95 -2.01 114.58 119.62 1ska h GLU 232 Ca 0.33 -0.15 0.03 0.00 -1.18 0.00 0.00 59.36 58.40 1ska h GLU 232 Cb -0.12 -0.01 -0.05 0.00 -0.16 0.00 0.00 28.75 28.42 1ska h GLU 232 CO -0.07 0.65 0.45 -0.44 -1.18 0.00 0.00 179.01 178.42 1ska h ASP 233 N 0.29 0.74 -0.37 1.04 3.32 -1.83 -0.40 116.42 119.20 1ska h ASP 233 Ca 0.03 0.00 0.06 0.00 0.02 0.00 0.00 57.03 57.14 1ska h ASP 233 Cb 0.76 -0.16 -0.05 0.00 0.22 0.00 0.00 39.33 40.10 1ska h ASP 233 CO 0.06 0.51 0.07 0.58 -1.72 0.00 0.00 179.24 178.74 1ska h VAL 234 N 0.87 0.81 -0.72 -1.35 2.07 -0.90 -0.71 116.25 116.32 1ska h VAL 234 Ca 0.29 -0.07 -0.02 0.00 0.82 0.00 0.00 66.70 67.73 1ska h VAL 234 Cb 0.03 0.60 -0.03 0.00 -1.52 0.00 0.00 31.29 30.36 1ska h VAL 234 CO -0.11 0.04 0.39 0.58 0.02 0.00 0.00 177.57 178.48 1ska h VAL 235 N 0.20 1.22 -0.41 2.57 2.07 -1.19 -0.25 116.25 120.47 1ska h VAL 235 Ca 0.18 -0.56 -0.14 0.00 0.82 0.00 0.00 66.70 67.00 1ska h VAL 235 Cb 0.20 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 30.22 1ska h VAL 235 CO -0.23 0.25 -0.28 0.28 0.02 0.00 0.00 177.57 177.60 1ska h SER 236 N 1.01 0.95 -0.26 0.57 0.02 -0.70 0.76 113.55 115.90 1ska h SER 236 Ca 0.25 -0.43 -0.06 0.00 -0.84 0.00 0.00 61.79 60.72 1ska h SER 236 Cb 0.04 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.30 1ska h SER 236 CO -0.04 1.18 -0.01 -0.07 -1.14 0.00 0.00 176.83 176.74 1ska h LEU 237 N 0.72 0.55 -0.30 5.07 3.38 -0.63 -1.01 115.31 123.09 1ska h LEU 237 Ca 0.08 -0.11 -0.11 0.00 0.09 0.00 0.00 57.88 57.82 1ska h LEU 237 Cb 0.86 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 1ska h LEU 237 CO 0.08 0.63 -0.26 0.24 0.09 0.00 0.00 178.44 179.22 1ska h MET 238 N 0.55 0.70 -0.90 1.13 2.86 -0.52 -2.87 114.93 115.87 1ska h MET 238 Ca 0.11 -0.36 0.11 0.00 -2.06 0.00 0.00 59.70 57.51 1ska h MET 238 Cb 0.38 0.01 -0.08 0.00 0.06 0.00 0.00 31.60 31.96 1ska h MET 238 CO 0.01 0.97 0.54 -0.44 1.06 0.00 0.00 176.91 179.05 1ska h ASP 239 N 0.45 0.77 -0.45 1.22 3.32 -0.62 -1.65 116.42 119.46 1ska h ASP 239 Ca 0.05 0.05 0.08 0.00 0.02 0.00 0.00 57.03 57.23 1ska h ASP 239 Cb 0.82 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 40.25 1ska h ASP 239 CO 0.07 0.42 0.30 0.24 -1.72 0.00 0.00 179.24 178.55 1ska h MET 240 N 0.87 0.27 -0.27 3.56 2.86 -0.97 -2.11 114.93 119.13 1ska h MET 240 Ca 0.44 -0.02 0.04 0.00 -2.06 0.00 0.00 59.70 58.11 1ska h MET 240 Cb 0.43 -0.06 -0.04 0.00 0.06 0.00 0.00 31.60 31.99 1ska h MET 240 CO -0.26 0.18 0.03 0.00 1.06 0.00 0.00 176.91 177.91 1ska h SER 242 N 0.12 0.13 -0.56 0.00 4.64 -1.57 -2.16 113.55 114.16 1ska h SER 242 Ca 0.13 -0.57 -0.05 0.00 -0.47 0.00 0.00 61.79 60.82 1ska h SER 242 Cb 0.15 -0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 62.18 1ska h SER 242 CO -0.19 0.68 0.14 -0.26 -0.87 0.00 0.00 176.83 176.33 1ska h PHE 243 N -0.41 0.94 -0.33 4.77 0.04 -1.30 0.33 116.94 120.97 1ska h PHE 243 Ca 0.00 -0.11 -0.15 0.00 2.80 0.00 0.00 57.97 60.51 1ska h PHE 243 Cb 0.66 -0.27 -0.00 0.00 2.20 0.00 0.00 35.95 38.54 1ska h PHE 243 CO 0.12 0.81 -0.40 0.22 -0.60 0.00 0.00 178.31 178.46 1ska h ASP 244 N 0.80 0.93 -0.68 2.17 3.58 -0.98 -2.57 116.42 119.67 1ska h ASP 244 Ca 0.18 -0.49 0.04 0.00 0.42 0.00 0.00 57.03 57.18 1ska h ASP 244 Cb 0.34 -0.26 -0.05 0.00 1.72 0.00 0.00 39.33 41.08 1ska h ASP 244 CO 0.00 1.23 0.41 0.74 -2.88 0.00 0.00 179.24 178.74 1ska h THR 245 N 0.65 1.05 -0.00 2.25 2.02 -0.71 -0.11 112.91 118.06 1ska h THR 245 Ca 0.04 -0.27 0.00 0.00 0.77 0.00 0.00 66.41 66.95 1ska h THR 245 Cb 0.99 0.20 0.00 0.00 -1.74 0.00 0.00 68.15 67.60 1ska h THR 245 CO 0.10 0.14 -0.06 1.33 0.37 0.00 0.00 175.52 177.40 1ska n VAL 246 N -4.71 0.00 -0.07 3.16 0.24 0.04 -3.75 118.33 113.25 1ska n VAL 246 Ca 0.08 -0.05 -0.07 0.00 -2.04 0.00 0.00 64.34 62.26 1ska n VAL 246 Cb 0.11 -0.22 -0.10 0.00 -1.47 0.00 0.00 33.84 32.16 1ska n VAL 246 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ska n ALA 247 N -0.96 1.68 0.25 2.33 0.00 -0.99 -4.44 120.51 118.38 1ska n ALA 247 Ca 0.17 -0.82 0.13 0.00 0.00 0.00 0.00 53.44 52.92 1ska n ALA 247 Cb 0.24 0.00 0.52 0.00 0.00 0.00 0.00 19.45 20.21 1ska n ALA 247 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 1ska h ARG 248 N 0.00 0.00 -4.69 0.00 0.11 -1.11 -3.43 114.38 105.27 1ska h ARG 248 Ca -0.35 0.00 -0.24 0.00 0.10 0.00 0.00 59.98 59.50 1ska h ARG 248 Cb 1.75 0.00 -0.15 0.00 1.11 0.00 0.00 29.97 32.68 1ska h ARG 248 CO 0.01 0.11 -0.70 0.95 0.10 0.00 0.00 179.97 180.43 1ska s THR 249 N -3.60 0.72 -0.68 0.08 -4.23 -1.26 -5.04 115.64 101.63 1ska s THR 249 Ca 0.02 -1.89 0.25 0.00 -1.18 0.00 0.00 61.69 58.89 1ska s THR 249 Cb 0.09 -1.63 0.27 0.00 1.34 0.00 0.00 72.50 72.57 1ska s THR 249 CO 0.60 -0.83 1.76 -1.54 -0.54 0.00 0.00 174.62 174.07 1ska n SER 250 N 0.05 0.71 -0.21 3.99 3.41 -1.26 -2.90 113.62 117.41 1ska n SER 250 Ca -0.13 0.60 0.04 0.00 -0.26 0.00 0.00 58.87 59.11 1ska n SER 250 Cb 0.60 -0.78 0.07 0.00 -0.26 0.00 0.00 64.21 63.85 1ska n SER 250 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1ska n ASP 251 N -2.20 2.39 -4.02 4.04 5.75 -1.26 -2.39 116.55 118.86 1ska n ASP 251 Ca 0.05 -2.26 -0.31 0.00 -0.01 0.00 0.00 54.79 52.26 1ska n ASP 251 Cb 0.36 -0.16 -0.00 0.00 -1.03 0.00 0.00 41.12 40.29 1ska n ASP 251 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1ska n ALA 252 N -0.44 -1.45 1.35 2.12 0.00 -1.14 -4.49 120.51 116.45 1ska n ALA 252 Ca 0.07 0.02 0.14 0.00 0.00 0.00 0.00 53.44 53.66 1ska n ALA 252 Cb 0.40 -3.44 0.57 0.00 0.00 0.00 0.00 19.45 16.98 1ska n ALA 252 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1ska n SER 253 N -2.81 0.51 -3.93 0.00 3.41 -1.26 -4.77 113.62 104.77 1ska n SER 253 Ca -0.03 -0.54 -0.29 0.00 -0.26 0.00 0.00 58.87 57.76 1ska n SER 253 Cb 0.55 -0.06 -0.16 0.00 -0.26 0.00 0.00 64.21 64.28 1ska n SER 253 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 1ska s GLN 254 N -2.53 1.68 0.27 4.33 0.74 -1.26 -5.06 119.66 117.83 1ska s GLN 254 Ca 0.27 -0.57 -0.30 0.00 0.05 0.00 0.00 55.36 54.81 1ska s GLN 254 Cb 0.20 -2.06 -0.10 0.00 1.10 0.00 0.00 33.01 32.14 1ska s GLN 254 CO 0.49 -0.39 1.44 -0.51 -0.55 0.00 0.00 175.29 175.77 1ska s LEU 255 N 1.57 4.38 0.53 3.68 2.01 -1.26 -4.71 118.68 124.88 1ska s LEU 255 Ca 0.01 2.72 -0.21 0.00 0.01 0.00 0.00 54.13 56.66 1ska s LEU 255 Cb -0.15 -3.63 -0.05 0.00 0.01 0.00 0.00 46.19 42.37 1ska s LEU 255 CO -0.08 -0.71 1.25 -0.55 1.01 0.00 0.00 176.35 177.27 1ska s SER 256 N 0.22 5.55 0.64 2.29 0.15 -1.26 -4.90 113.70 116.39 1ska s SER 256 Ca 0.58 2.50 0.41 0.00 0.70 0.00 0.00 55.95 60.14 1ska s SER 256 Cb -0.42 -2.61 2.26 0.00 -1.71 0.00 0.00 66.02 63.53 1ska s SER 256 CO 0.46 -1.36 2.27 1.55 1.20 0.00 0.00 173.24 177.37 1ska h PRO 257 N 1.49 0.00 0.00 5.44 0.13 -1.94 -2.05 132.00 135.08 1ska h PRO 257 Ca -0.50 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.59 1ska h PRO 257 Cb 1.28 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.41 1ska h PRO 257 CO 0.58 0.00 -0.19 0.74 -0.23 0.00 0.00 178.00 178.89 1ska h PHE 258 N 0.00 0.00 -0.47 1.56 -1.00 -1.90 -3.30 116.94 111.82 1ska h PHE 258 Ca 0.00 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.76 1ska h PHE 258 Cb 0.08 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.62 1ska h PHE 258 CO 0.00 0.19 0.23 0.00 -1.61 0.00 0.00 178.31 177.12 1ska n GLN 260 N -4.64 0.03 0.30 0.00 10.64 -1.24 -2.59 117.38 119.88 1ska n GLN 260 Ca 0.01 0.38 0.19 0.00 -1.83 0.00 0.00 57.00 55.75 1ska n GLN 260 Cb 0.11 -1.56 0.85 0.00 -0.86 0.00 0.00 30.24 28.77 1ska n GLN 260 CO 0.00 0.00 0.00 -0.07 -1.83 0.00 0.00 177.06 175.16 1ska h LEU 261 N 0.00 0.00 -8.47 2.61 3.38 -1.66 -3.43 115.31 107.74 1ska h LEU 261 Ca 0.00 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.40 1ska h LEU 261 Cb 0.16 0.00 -0.27 0.00 0.09 0.00 0.00 40.66 40.64 1ska h LEU 261 CO 0.00 0.01 -0.84 -0.36 0.09 0.00 0.00 178.44 177.34 1ska s PHE 262 N -3.83 1.73 0.73 1.13 0.08 -1.07 -5.06 117.98 111.69 1ska s PHE 262 Ca -0.01 -0.35 -0.11 0.00 0.12 0.00 0.00 56.93 56.58 1ska s PHE 262 Cb 0.10 -1.06 0.03 0.00 -0.57 0.00 0.00 43.02 41.52 1ska s PHE 262 CO 0.51 0.04 1.08 0.95 -0.10 0.00 0.00 175.22 177.69 1ska s THR 263 N -0.67 3.63 0.35 0.64 -4.23 -1.26 -4.84 115.64 109.26 1ska s THR 263 Ca 0.07 0.53 0.09 0.00 -1.18 0.00 0.00 61.69 61.20 1ska s THR 263 Cb -0.08 -3.31 0.32 0.00 1.34 0.00 0.00 72.50 70.77 1ska s THR 263 CO 0.01 -0.69 1.85 -0.74 -0.54 0.00 0.00 174.62 174.50 1ska h HIS 264 N -0.84 0.86 -0.16 3.99 2.76 -1.96 0.94 115.15 120.74 1ska h HIS 264 Ca -0.45 0.03 -0.16 0.00 -2.20 0.00 0.00 60.37 57.58 1ska h HIS 264 Cb 1.24 -0.27 -0.01 0.00 1.55 0.00 0.00 27.41 29.92 1ska h HIS 264 CO 0.55 0.29 -0.57 -0.91 -1.30 0.00 0.00 177.93 175.99 1ska h ASN 265 N 0.70 0.57 -0.56 3.26 -0.26 -1.99 -1.36 115.58 115.95 1ska h ASN 265 Ca 0.48 -0.31 -0.07 0.00 -0.56 0.00 0.00 56.30 55.83 1ska h ASN 265 Cb 0.78 -0.16 -0.02 0.00 -1.06 0.00 0.00 38.32 37.85 1ska h ASN 265 CO -0.24 1.02 0.09 -0.33 -1.06 0.00 0.00 177.43 176.91 1ska h GLU 266 N 0.39 0.97 -0.88 0.81 5.08 -1.79 -2.66 114.58 116.50 1ska h GLU 266 Ca 0.00 -0.24 -0.00 0.00 -1.00 0.00 0.00 59.36 58.12 1ska h GLU 266 Cb 1.11 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 30.19 1ska h GLU 266 CO 0.10 0.90 0.55 -1.49 -1.00 0.00 0.00 179.01 178.07 1ska h TRP 267 N 0.91 1.14 -0.97 4.33 4.06 -0.16 -1.28 115.95 123.98 1ska h TRP 267 Ca 0.18 0.01 0.11 0.00 2.06 0.00 0.00 58.89 61.25 1ska h TRP 267 Cb 0.41 -0.38 -0.08 0.00 -1.00 0.00 0.00 29.16 28.12 1ska h TRP 267 CO 0.03 0.74 0.62 0.87 -3.56 0.00 0.00 178.44 177.14 1ska h LYS 268 N 1.20 0.94 -0.48 0.49 1.57 -1.05 -0.32 116.57 118.93 1ska h LYS 268 Ca 0.32 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 59.03 1ska h LYS 268 Cb -0.08 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 31.99 1ska h LYS 268 CO -0.06 0.62 0.27 0.87 -0.57 0.00 0.00 179.45 180.58 1ska h LYS 269 N 0.97 0.66 -0.31 3.15 1.57 -1.00 -1.53 116.57 120.08 1ska h LYS 269 Ca 0.46 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 59.14 1ska h LYS 269 Cb 0.44 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 1ska h LYS 269 CO -0.22 0.50 0.06 -0.92 -0.57 0.00 0.00 179.45 178.30 1ska h TYR 270 N 0.63 0.54 -0.89 -1.35 3.20 -0.89 0.58 116.97 118.79 1ska h TYR 270 Ca 0.17 -0.07 0.10 0.00 3.14 0.00 0.00 58.73 62.07 1ska h TYR 270 Cb 0.02 -0.15 -0.08 0.00 1.54 0.00 0.00 36.73 38.07 1ska h TYR 270 CO -0.02 0.58 0.53 -0.97 -1.64 0.00 0.00 178.16 176.64 1ska h ASN 271 N 0.34 0.78 -0.48 -2.11 -1.24 -1.02 -2.05 115.58 109.80 1ska h ASN 271 Ca 0.10 0.05 -0.13 0.00 0.71 0.00 0.00 56.30 57.02 1ska h ASN 271 Cb 0.33 -0.11 -0.01 0.00 0.73 0.00 0.00 38.32 39.26 1ska h ASN 271 CO 0.00 0.43 -0.22 0.22 -1.29 0.00 0.00 177.43 176.58 1ska h TYR 272 N 0.88 1.14 -0.82 0.67 3.20 -0.69 -0.93 116.97 120.41 1ska h TYR 272 Ca 0.43 -0.28 0.12 0.00 3.14 0.00 0.00 58.73 62.15 1ska h TYR 272 Cb 0.40 -0.26 -0.08 0.00 1.54 0.00 0.00 36.73 38.32 1ska h TYR 272 CO -0.04 1.11 0.43 1.25 -1.64 0.00 0.00 178.16 179.27 1ska h LEU 273 N 0.85 0.57 -0.27 2.82 5.85 -0.31 0.37 115.31 125.17 1ska h LEU 273 Ca 0.11 0.07 -0.12 0.00 0.84 0.00 0.00 57.88 58.78 1ska h LEU 273 Cb 0.80 -0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.80 1ska h LEU 273 CO 0.07 0.28 -0.31 1.56 -0.34 0.00 0.00 178.44 179.70 1ska h GLN 274 N 0.68 0.69 -0.95 1.25 1.08 -0.92 -1.38 115.11 115.56 1ska h GLN 274 Ca 0.42 -0.38 0.01 0.00 -1.45 0.00 0.00 58.65 57.26 1ska h GLN 274 Cb 0.51 0.02 -0.05 0.00 -0.05 0.00 0.00 27.48 27.91 1ska h GLN 274 CO -0.31 0.99 0.63 0.77 -0.95 0.00 0.00 178.83 179.97 1ska h SER 275 N 0.42 1.09 -0.11 1.46 0.02 -0.37 -1.89 113.55 114.16 1ska h SER 275 Ca 0.04 -0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 60.96 1ska h SER 275 Cb 0.88 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 63.15 1ska h SER 275 CO 0.07 0.78 0.06 -0.07 -1.14 0.00 0.00 176.83 176.54 1ska h LEU 276 N 1.28 0.14 -0.78 5.07 3.38 -0.13 0.65 115.31 124.92 1ska h LEU 276 Ca 0.35 -0.07 0.07 0.00 0.09 0.00 0.00 57.88 58.33 1ska h LEU 276 Cb -0.12 -0.03 -0.06 0.00 0.09 0.00 0.00 40.66 40.53 1ska h LEU 276 CO -0.08 0.17 0.45 1.23 0.09 0.00 0.00 178.44 180.29 1ska h GLY 277 N 0.09 1.18 1.10 0.83 0.00 -0.98 -0.90 103.07 104.39 1ska h GLY 277 Ca 0.04 -0.31 -0.13 0.00 0.00 0.00 0.00 47.33 46.92 1ska h GLY 277 CO -0.01 0.17 -0.23 0.50 0.00 0.00 0.00 176.54 176.97 1ska h LYS 278 N 0.80 0.97 -0.22 4.80 1.79 -1.19 -0.53 116.57 122.99 1ska h LYS 278 Ca 0.36 -0.43 -0.03 0.00 -2.18 0.00 0.00 60.65 58.36 1ska h LYS 278 Cb 0.25 -0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 30.87 1ska h LYS 278 CO -0.21 1.10 0.01 -0.92 -1.08 0.00 0.00 179.45 178.36 1ska h TYR 279 N 0.82 0.41 0.00 -1.35 3.20 -0.58 0.47 116.97 119.94 1ska h TYR 279 Ca 0.10 -0.07 0.00 0.00 3.14 0.00 0.00 58.73 61.91 1ska h TYR 279 Cb 0.81 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 38.97 1ska h TYR 279 CO 0.06 0.55 -0.56 1.88 -1.64 0.00 0.00 178.16 178.44 1ska h TYR 280 N 0.16 0.00 0.11 -3.82 0.05 -1.27 -1.32 116.97 110.88 1ska h TYR 280 Ca 0.06 0.00 -0.22 0.00 0.05 0.00 0.00 58.73 58.63 1ska h TYR 280 Cb 0.37 0.00 0.01 0.00 1.01 0.00 0.00 36.73 38.12 1ska h TYR 280 CO 0.03 0.00 -1.05 0.78 -1.05 0.00 0.00 178.16 176.87 1ska h GLY 281 N 4.21 0.27 0.00 3.88 0.00 -1.05 -3.16 103.07 107.22 1ska h GLY 281 Ca 0.00 -0.68 0.00 0.00 0.00 0.00 0.00 47.33 46.65 1ska h GLY 281 CO 0.00 0.59 -0.51 -1.72 0.00 0.00 0.00 176.54 174.90 1ska n TYR 282 N -4.09 0.00 -1.66 5.60 4.01 -0.01 -4.74 117.16 116.27 1ska n TYR 282 Ca -0.20 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.54 1ska n TYR 282 Cb 0.82 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.85 1ska n TYR 282 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ska n GLY 283 N 1.40 0.98 0.20 2.72 0.00 -0.24 -3.33 105.19 106.92 1ska n GLY 283 Ca 0.00 -1.93 0.13 0.00 0.00 0.00 0.00 46.02 44.22 1ska n GLY 283 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ska h ALA 284 N -1.01 1.03 0.00 4.61 0.00 -1.90 -1.86 119.26 120.14 1ska h ALA 284 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ska h ALA 284 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1ska h ALA 284 CO 0.00 -0.03 0.00 0.78 0.00 0.00 0.00 179.25 180.00 1ska h GLY 285 N 0.00 0.00 -5.15 0.00 0.00 -1.59 -3.42 103.07 92.92 1ska h GLY 285 Ca 0.00 0.00 -0.57 0.00 0.00 0.00 0.00 47.33 46.76 1ska h GLY 285 CO 0.00 0.00 -0.04 0.21 0.00 0.00 0.00 176.54 176.71 1ska s ASN 286 N -5.68 6.87 0.60 0.19 3.84 -0.70 -4.79 114.94 115.27 1ska s ASN 286 Ca 0.04 1.04 0.32 0.00 0.21 0.00 0.00 52.86 54.47 1ska s ASN 286 Cb 0.08 -2.34 1.88 0.00 -0.55 0.00 0.00 41.25 40.32 1ska s ASN 286 CO 0.58 0.03 2.26 -0.65 -2.79 0.00 0.00 177.10 176.53 1ska h PRO 287 N 6.20 0.00 -0.09 0.43 0.11 -1.86 -1.89 132.00 134.90 1ska h PRO 287 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1ska h PRO 287 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1ska h PRO 287 CO 0.72 0.01 0.00 1.28 -0.21 0.00 0.00 178.00 179.81 1ska n LEU 288 N -3.70 2.73 0.28 2.35 4.77 -1.26 -4.83 117.00 117.34 1ska n LEU 288 Ca -0.03 -2.83 -0.11 0.00 -0.03 0.00 0.00 56.01 53.01 1ska n LEU 288 Cb 0.10 -0.38 -0.05 0.00 -2.33 0.00 0.00 43.42 40.75 1ska n LEU 288 CO 0.26 0.67 0.41 1.23 -1.33 0.00 0.00 177.39 178.63 1ska h GLY 289 N 0.61 -0.75 1.70 -0.72 0.00 -1.50 -3.21 103.07 99.20 1ska h GLY 289 Ca 0.00 0.28 0.04 0.00 0.00 0.00 0.00 47.33 47.65 1ska h GLY 289 CO 0.06 -0.27 0.11 -2.55 0.00 0.00 0.00 176.54 173.88 1ska h PRO 290 N -0.88 0.00 -0.23 4.80 0.11 -1.68 -0.54 132.00 133.58 1ska h PRO 290 Ca -0.07 0.00 0.07 0.00 0.11 0.00 0.00 66.00 66.10 1ska h PRO 290 Cb 0.55 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.65 1ska h PRO 290 CO 0.12 0.00 0.27 0.00 -0.21 0.00 0.00 178.00 178.19 1ska h ALA 291 N 1.91 1.85 0.00 -0.75 0.00 -1.87 0.29 119.26 120.69 1ska h ALA 291 Ca 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1ska h ALA 291 Cb 0.29 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1ska h ALA 291 CO -0.00 -0.39 0.00 1.04 0.00 0.00 0.00 179.25 179.90 1ska n GLN 292 N -3.71 0.25 -0.24 0.00 1.13 -0.21 -2.64 117.38 111.96 1ska n GLN 292 Ca 0.03 0.32 0.12 0.00 -1.94 0.00 0.00 57.00 55.52 1ska n GLN 292 Cb 0.41 -1.85 0.24 0.00 0.11 0.00 0.00 30.24 29.14 1ska n GLN 292 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1ska n GLY 293 N 0.74 1.95 0.17 1.08 0.00 0.10 -4.60 105.19 104.63 1ska n GLY 293 Ca 0.04 -0.74 -0.07 0.00 0.00 0.00 0.00 46.02 45.25 1ska n GLY 293 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1ska h ILE 294 N 4.31 1.38 -0.05 -0.61 2.04 -1.47 -2.17 117.51 120.94 1ska h ILE 294 Ca 0.00 -2.03 -0.00 0.00 1.00 0.00 0.00 64.86 63.83 1ska h ILE 294 Cb 0.97 2.02 -0.00 0.00 -0.74 0.00 0.00 36.82 39.07 1ska h ILE 294 CO 0.00 0.60 0.01 1.23 0.00 0.00 0.00 178.15 180.00 1ska h GLY 295 N 1.39 0.09 1.44 5.37 0.00 -1.81 0.32 103.07 109.87 1ska h GLY 295 Ca -0.01 -0.05 -0.10 0.00 0.00 0.00 0.00 47.33 47.17 1ska h GLY 295 CO 0.10 0.05 -0.19 -2.75 0.00 0.00 0.00 176.54 173.76 1ska h PHE 296 N -0.12 0.73 -0.52 5.60 3.57 -1.74 -1.60 116.94 122.85 1ska h PHE 296 Ca 0.02 -0.15 0.05 0.00 3.53 0.00 0.00 57.97 61.42 1ska h PHE 296 Cb 0.23 -0.18 -0.05 0.00 2.79 0.00 0.00 35.95 38.74 1ska h PHE 296 CO 0.00 0.80 0.26 1.15 -2.23 0.00 0.00 178.31 178.29 1ska h THR 297 N 0.59 0.95 -0.04 4.41 2.02 -0.73 0.28 112.91 120.39 1ska h THR 297 Ca 0.09 -0.17 -0.07 0.00 0.77 0.00 0.00 66.41 67.03 1ska h THR 297 Cb 0.64 0.40 -0.01 0.00 -1.74 0.00 0.00 68.15 67.44 1ska h THR 297 CO 0.05 0.09 -0.30 0.78 0.37 0.00 0.00 175.52 176.51 1ska h ASN 298 N 0.51 0.07 -0.34 4.18 2.35 -0.56 -0.85 115.58 120.93 1ska h ASN 298 Ca 0.23 -0.02 -0.04 0.00 -0.55 0.00 0.00 56.30 55.92 1ska h ASN 298 Cb 0.15 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.48 1ska h ASN 298 CO -0.17 0.37 0.07 -0.33 -1.65 0.00 0.00 177.43 175.73 1ska h GLU 299 N 0.06 0.56 -0.76 0.81 5.08 -0.56 -1.45 114.58 118.32 1ska h GLU 299 Ca 0.01 -0.14 -0.05 0.00 -1.00 0.00 0.00 59.36 58.18 1ska h GLU 299 Cb 0.57 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.71 1ska h GLU 299 CO 0.04 0.62 0.28 1.25 -1.00 0.00 0.00 179.01 180.20 1ska h LEU 300 N 0.40 1.06 -0.70 1.33 5.85 0.00 -1.54 115.31 121.70 1ska h LEU 300 Ca 0.11 -0.17 0.02 0.00 0.84 0.00 0.00 57.88 58.68 1ska h LEU 300 Cb 0.32 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.04 1ska h LEU 300 CO 0.00 0.95 0.45 0.40 -0.34 0.00 0.00 178.44 179.90 1ska h ILE 301 N 1.11 1.12 -0.40 4.05 2.04 -1.04 0.60 117.51 125.00 1ska h ILE 301 Ca 0.25 -0.31 -0.03 0.00 1.00 0.00 0.00 64.86 65.78 1ska h ILE 301 Cb 0.24 0.15 -0.02 0.00 -0.74 0.00 0.00 36.82 36.45 1ska h ILE 301 CO -0.02 0.16 0.15 0.00 0.00 0.00 0.00 178.15 178.45 1ska h ALA 302 N 1.29 0.52 -0.25 1.87 0.00 -0.81 -1.67 119.26 120.20 1ska h ALA 302 Ca 0.27 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 1ska h ALA 302 Cb -0.02 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1ska h ALA 302 CO -0.09 0.14 0.06 0.00 0.00 0.00 0.00 179.25 179.35 1ska h ARG 303 N 0.50 0.41 -0.34 0.00 3.08 -0.75 0.17 114.38 117.45 1ska h ARG 303 Ca 0.13 -0.10 -0.02 0.00 0.07 0.00 0.00 59.98 60.06 1ska h ARG 303 Cb 0.21 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.19 1ska h ARG 303 CO -0.01 0.51 0.13 -0.07 -1.07 0.00 0.00 179.97 179.46 1ska h LEU 304 N 0.23 0.43 -2.24 3.04 3.38 -0.72 -2.76 115.31 116.68 1ska h LEU 304 Ca 0.08 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1ska h LEU 304 Cb 0.29 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1ska h LEU 304 CO 0.00 0.40 0.00 0.35 0.09 0.00 0.00 178.44 179.28 1ska n THR 305 N -4.39 0.43 -3.83 0.22 -2.24 -0.64 -4.96 114.28 98.85 1ska n THR 305 Ca 0.02 -0.71 -0.26 0.00 -2.27 0.00 0.00 64.05 60.83 1ska n THR 305 Cb 0.14 1.04 0.02 0.00 -2.10 0.00 0.00 70.33 69.44 1ska n THR 305 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1ska n ARG 306 N 1.32 -4.85 -4.05 -0.78 1.74 0.47 -4.98 116.66 105.53 1ska n ARG 306 Ca 0.17 0.57 -0.12 0.00 -0.77 0.00 0.00 57.85 57.70 1ska n ARG 306 Cb 0.56 -5.20 -0.11 0.00 -1.02 0.00 0.00 32.46 26.69 1ska n ARG 306 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1ska s SER 307 N -3.94 0.69 0.58 0.55 0.01 -0.33 -5.00 113.70 106.25 1ska s SER 307 Ca 0.27 -0.58 -0.20 0.00 1.31 0.00 0.00 55.95 56.75 1ska s SER 307 Cb -0.14 0.06 -0.04 0.00 0.21 0.00 0.00 66.02 66.12 1ska s SER 307 CO 0.83 -0.26 1.32 -2.84 0.41 0.00 0.00 173.24 172.71 1ska s PRO 308 N -1.74 2.97 0.28 12.44 0.02 -1.26 -4.40 135.00 143.30 1ska s PRO 308 Ca -0.10 2.14 -0.30 0.00 0.02 0.00 0.00 61.00 62.76 1ska s PRO 308 Cb -0.09 -2.11 -0.11 0.00 0.02 0.00 0.00 34.50 32.22 1ska s PRO 308 CO -0.01 -1.30 1.49 0.08 -0.33 0.00 0.00 177.00 176.94 1ska s VAL 309 N -1.36 2.39 -0.32 3.83 1.01 -1.26 -4.83 120.40 119.86 1ska s VAL 309 Ca 0.75 0.34 0.01 0.00 0.00 0.00 0.00 61.98 63.08 1ska s VAL 309 Cb -0.38 -3.22 0.08 0.00 0.00 0.00 0.00 36.38 32.86 1ska s VAL 309 CO 0.44 0.06 0.02 -1.10 0.00 0.00 0.00 175.10 174.52 1ska s GLN 310 N -0.62 1.99 -0.18 2.72 -1.52 -1.26 -5.09 119.66 115.69 1ska s GLN 310 Ca 0.60 -1.59 -0.27 0.00 -1.95 0.00 0.00 55.36 52.14 1ska s GLN 310 Cb -0.44 -3.18 0.07 0.00 -0.22 0.00 0.00 33.01 29.24 1ska s GLN 310 CO 0.47 -0.79 0.71 0.34 -0.25 0.00 0.00 175.29 175.77 1ska s ASP 311 N 1.19 -0.71 -0.21 5.90 -1.08 -1.26 -4.88 116.67 115.62 1ska s ASP 311 Ca 0.01 1.14 0.20 0.00 -0.52 0.00 0.00 52.55 53.39 1ska s ASP 311 Cb -0.20 1.08 0.48 0.00 -1.46 0.00 0.00 42.92 42.82 1ska s ASP 311 CO -0.05 -0.39 1.14 0.00 0.52 0.00 0.00 175.17 176.39 1ska n HIS 312 N 1.96 1.19 0.00 -5.34 1.44 -1.26 -4.89 115.22 108.33 1ska n HIS 312 Ca -0.16 -1.79 0.00 0.00 -2.01 0.00 0.00 57.72 53.76 1ska n HIS 312 Cb 0.56 -0.23 0.00 0.00 0.12 0.00 0.00 29.99 30.43 1ska n HIS 312 CO 0.00 0.00 0.00 0.25 -2.81 0.00 0.00 176.34 173.78 1ska n THR 313 N -0.43 0.00 -0.40 0.61 -2.24 -1.26 -4.97 114.28 105.58 1ska n THR 313 Ca 0.14 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.97 1ska n THR 313 Cb 0.89 -0.14 0.11 0.00 -2.10 0.00 0.00 70.33 69.10 1ska n THR 313 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1ska n SER 314 N 0.00 2.65 -4.74 3.42 3.41 -1.26 -4.99 113.62 112.12 1ska n SER 314 Ca 0.00 -2.35 -0.32 0.00 -0.26 0.00 0.00 58.87 55.93 1ska n SER 314 Cb 0.00 -0.23 0.10 0.00 -0.26 0.00 0.00 64.21 63.81 1ska n SER 314 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1ska s THR 315 N -1.62 2.84 -0.31 6.66 -4.23 -1.26 -2.95 115.64 114.77 1ska s THR 315 Ca 0.20 0.33 -0.11 0.00 -1.18 0.00 0.00 61.69 60.92 1ska s THR 315 Cb 0.14 -2.74 -0.02 0.00 1.34 0.00 0.00 72.50 71.22 1ska s THR 315 CO 0.07 -0.30 0.19 0.21 -0.54 0.00 0.00 174.62 174.25 1ska s ASN 316 N -2.77 5.86 0.44 3.99 3.84 -1.26 -4.79 114.94 120.25 1ska s ASN 316 Ca 0.66 -0.34 0.17 0.00 0.21 0.00 0.00 52.86 53.56 1ska s ASN 316 Cb -0.21 -2.08 1.03 0.00 -0.55 0.00 0.00 41.25 39.44 1ska s ASN 316 CO 0.51 -0.17 1.96 0.77 -2.79 0.00 0.00 177.10 177.38 1ska h SER 317 N 8.41 0.00 0.13 -4.21 4.64 -1.96 -1.22 113.55 119.35 1ska h SER 317 Ca -0.33 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.99 1ska h SER 317 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 1ska h SER 317 CO 0.61 0.22 -0.06 0.74 -0.87 0.00 0.00 176.83 177.46 1ska h THR 318 N 0.00 1.03 0.00 2.95 2.02 -2.00 -3.19 112.91 113.73 1ska h THR 318 Ca -0.00 -0.83 -0.05 0.00 0.77 0.00 0.00 66.41 66.30 1ska h THR 318 Cb 0.43 1.54 -0.01 0.00 -1.74 0.00 0.00 68.15 68.37 1ska h THR 318 CO 0.03 0.19 -0.22 -0.07 0.37 0.00 0.00 175.52 175.82 1ska h LEU 319 N -0.59 0.00 -0.00 2.58 3.38 -1.78 -2.78 115.31 116.12 1ska h LEU 319 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1ska h LEU 319 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 1ska h LEU 319 CO 0.03 0.22 -0.04 1.33 0.09 0.00 0.00 178.44 180.06 1ska n VAL 320 N -4.18 0.00 -0.25 1.22 0.24 -0.52 -3.63 118.33 111.21 1ska n VAL 320 Ca -0.02 -0.00 0.07 0.00 -2.04 0.00 0.00 64.34 62.34 1ska n VAL 320 Cb 0.28 -0.43 0.19 0.00 -1.47 0.00 0.00 33.84 32.41 1ska n VAL 320 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 1ska n SER 321 N -1.49 3.17 -4.35 -1.34 3.41 -1.05 -4.75 113.62 107.22 1ska n SER 321 Ca 0.07 -2.05 -0.33 0.00 -0.26 0.00 0.00 58.87 56.30 1ska n SER 321 Cb 0.34 -0.29 -0.15 0.00 -0.26 0.00 0.00 64.21 63.85 1ska n SER 321 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1ska s ASN 322 N -1.04 3.73 0.60 4.04 2.47 -1.24 -5.02 114.94 118.49 1ska s ASN 322 Ca 0.29 -0.37 0.34 0.00 0.42 0.00 0.00 52.86 53.54 1ska s ASN 322 Cb 0.16 -1.33 1.96 0.00 -1.45 0.00 0.00 41.25 40.59 1ska s ASN 322 CO 0.18 0.21 2.26 -0.65 -3.72 0.00 0.00 177.10 175.38 1ska h PRO 323 N 6.36 0.00 -0.74 0.43 0.11 -1.90 0.19 132.00 136.45 1ska h PRO 323 Ca -0.29 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.76 1ska h PRO 323 Cb 1.20 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.28 1ska h PRO 323 CO 0.52 0.02 0.23 0.00 -0.21 0.00 0.00 178.00 178.55 1ska h ALA 324 N 1.98 1.01 0.00 -0.75 0.00 -1.95 -3.01 119.26 116.54 1ska h ALA 324 Ca -0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1ska h ALA 324 Cb 0.07 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.57 1ska h ALA 324 CO 0.00 0.66 -0.80 0.25 0.00 0.00 0.00 179.25 179.37 1ska n THR 325 N -4.25 0.00 -2.86 0.00 -2.24 -0.85 -4.82 114.28 99.27 1ska n THR 325 Ca 0.06 -0.19 -0.12 0.00 -2.27 0.00 0.00 64.05 61.53 1ska n THR 325 Cb 0.23 0.89 0.02 0.00 -2.10 0.00 0.00 70.33 69.37 1ska n THR 325 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 1ska n PHE 326 N -1.42 -2.68 -2.30 4.78 -0.00 -0.00 -4.89 117.46 110.95 1ska n PHE 326 Ca 0.02 -2.16 -0.38 0.00 -0.00 0.00 0.00 57.45 54.92 1ska n PHE 326 Cb 0.24 1.12 -0.02 0.00 -0.00 0.00 0.00 39.48 40.82 1ska n PHE 326 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.76 175.51 1ska s PRO 327 N 0.27 4.10 0.00 -7.13 0.04 -1.14 -4.46 135.00 126.68 1ska s PRO 327 Ca 0.33 1.85 0.22 0.00 0.04 0.00 0.00 61.00 63.43 1ska s PRO 327 Cb 0.21 -2.72 0.35 0.00 0.04 0.00 0.00 34.50 32.38 1ska s PRO 327 CO -0.21 -0.28 1.33 1.28 0.04 0.00 0.00 177.00 179.15 1ska n LEU 328 N 0.16 3.25 -0.02 -3.56 4.77 -1.26 -4.47 117.00 115.87 1ska n LEU 328 Ca 0.04 -1.41 0.01 0.00 -0.03 0.00 0.00 56.01 54.62 1ska n LEU 328 Cb 0.46 -0.19 0.01 0.00 -2.33 0.00 0.00 43.42 41.38 1ska n LEU 328 CO 0.51 0.68 0.44 -0.46 -1.33 0.00 0.00 177.39 177.22 1ska n ASN 329 N 1.36 1.48 0.00 -1.43 2.04 -1.26 -4.42 115.26 113.02 1ska n ASN 329 Ca 0.17 -1.85 0.13 0.00 -0.44 0.00 0.00 54.58 52.59 1ska n ASN 329 Cb 0.57 -0.04 0.75 0.00 -2.53 0.00 0.00 39.78 38.53 1ska n ASN 329 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1ska n ALA 330 N -0.44 2.44 0.00 -2.53 0.00 -1.26 -4.96 120.51 113.75 1ska n ALA 330 Ca 0.01 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.30 1ska n ALA 330 Cb 0.36 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.39 1ska n ALA 330 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1ska n THR 331 N -1.03 0.00 -4.35 0.00 -2.24 -1.26 -4.71 114.28 100.69 1ska n THR 331 Ca 0.19 0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.71 1ska n THR 331 Cb 0.10 0.00 -0.17 0.00 -2.10 0.00 0.00 70.33 68.16 1ska n THR 331 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 1ska s MET 332 N 0.00 1.61 -0.02 -0.78 -1.94 -1.26 -1.46 119.30 115.45 1ska s MET 332 Ca 0.00 -0.35 0.08 0.00 -1.71 0.00 0.00 55.69 53.70 1ska s MET 332 Cb 0.00 -1.44 -0.02 0.00 2.01 0.00 0.00 34.83 35.38 1ska s MET 332 CO 0.00 -0.07 -0.26 0.71 -0.01 0.00 0.00 175.02 175.39 1ska s TYR 333 N 1.00 2.32 -0.06 -0.03 2.02 -0.12 -0.73 117.35 121.74 1ska s TYR 333 Ca -0.08 -0.47 -0.00 0.00 -0.37 0.00 0.00 57.07 56.14 1ska s TYR 333 Cb -0.15 -1.50 0.03 0.00 -0.40 0.00 0.00 41.96 39.94 1ska s TYR 333 CO -0.00 -0.06 -0.02 0.08 -1.57 0.00 0.00 175.55 173.97 1ska s VAL 334 N -0.55 0.49 -0.06 0.71 1.01 -0.39 -0.17 120.40 121.44 1ska s VAL 334 Ca 0.08 -0.01 0.05 0.00 0.00 0.00 0.00 61.98 62.11 1ska s VAL 334 Cb -0.10 -0.59 -0.01 0.00 0.00 0.00 0.00 36.38 35.68 1ska s VAL 334 CO -0.00 0.26 -0.21 -1.81 0.00 0.00 0.00 175.10 173.33 1ska s ASP 335 N 1.55 2.61 -0.28 3.32 1.01 -0.30 -1.57 116.67 123.01 1ska s ASP 335 Ca -0.01 -0.44 -0.08 0.00 0.71 0.00 0.00 52.55 52.73 1ska s ASP 335 Cb -0.13 -0.79 -0.01 0.00 1.01 0.00 0.00 42.92 42.99 1ska s ASP 335 CO -0.04 0.19 0.10 -0.36 0.21 0.00 0.00 175.17 175.27 1ska s PHE 336 N 0.02 3.13 0.00 4.23 0.08 -0.45 -1.17 117.98 123.81 1ska s PHE 336 Ca -0.06 -0.57 0.00 0.00 0.12 0.00 0.00 56.93 56.42 1ska s PHE 336 Cb -0.13 -2.28 0.00 0.00 -0.57 0.00 0.00 43.02 40.03 1ska s PHE 336 CO 0.04 -0.43 0.00 0.45 -0.10 0.00 0.00 175.22 175.17 1ska n SER 337 N 4.93 0.00 -4.25 1.36 2.88 -0.11 -1.09 113.62 117.34 1ska n SER 337 Ca -0.15 0.00 -0.14 0.00 -1.33 0.00 0.00 58.87 57.25 1ska n SER 337 Cb 0.50 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.86 1ska n SER 337 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 1ska s HIS 338 N 1.94 1.26 0.23 0.66 3.76 -1.25 -4.28 115.29 117.60 1ska s HIS 338 Ca 0.00 -0.75 -0.07 0.00 -0.15 0.00 0.00 55.06 54.09 1ska s HIS 338 Cb 0.00 -0.64 0.34 0.00 1.11 0.00 0.00 32.58 33.39 1ska s HIS 338 CO 0.00 0.08 1.79 0.38 -0.85 0.00 0.00 174.74 176.14 1ska h ASP 339 N 2.82 0.52 -0.10 1.40 2.03 -1.95 -0.52 116.42 120.63 1ska h ASP 339 Ca -0.37 0.05 -0.08 0.00 -0.73 0.00 0.00 57.03 55.91 1ska h ASP 339 Cb 1.19 -0.04 0.00 0.00 -0.83 0.00 0.00 39.33 39.65 1ska h ASP 339 CO 0.63 0.30 -0.26 0.78 -1.03 0.00 0.00 179.24 179.67 1ska h ASN 340 N 0.66 0.39 -0.45 4.15 2.35 -1.98 -1.60 115.58 119.10 1ska h ASN 340 Ca 0.35 -0.59 -0.01 0.00 -0.55 0.00 0.00 56.30 55.50 1ska h ASN 340 Cb 0.34 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.57 1ska h ASN 340 CO -0.25 0.91 0.24 0.28 -1.65 0.00 0.00 177.43 176.96 1ska h SER 341 N -0.11 0.59 -0.55 5.81 0.02 -1.87 -1.76 113.55 115.68 1ska h SER 341 Ca -0.01 -0.05 -0.06 0.00 -0.84 0.00 0.00 61.79 60.84 1ska h SER 341 Cb 0.87 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 63.23 1ska h SER 341 CO 0.06 0.50 0.13 0.24 -1.14 0.00 0.00 176.83 176.61 1ska h MET 342 N 0.67 0.93 -0.25 3.45 2.86 -0.84 0.93 114.93 122.68 1ska h MET 342 Ca 0.17 -0.21 -0.02 0.00 -2.06 0.00 0.00 59.70 57.58 1ska h MET 342 Cb 0.06 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.58 1ska h MET 342 CO -0.02 0.84 0.07 0.28 1.06 0.00 0.00 176.91 179.13 1ska h VAL 343 N 0.88 1.21 -0.77 -2.22 2.07 -0.74 0.74 116.25 117.42 1ska h VAL 343 Ca 0.19 -0.67 0.09 0.00 0.82 0.00 0.00 66.70 67.13 1ska h VAL 343 Cb 0.34 1.18 -0.07 0.00 -1.52 0.00 0.00 31.29 31.22 1ska h VAL 343 CO 0.00 0.22 0.42 0.28 0.02 0.00 0.00 177.57 178.51 1ska h SER 344 N 0.23 0.59 -0.40 0.57 0.02 -0.77 -2.26 113.55 111.52 1ska h SER 344 Ca 0.08 0.05 -0.06 0.00 -0.84 0.00 0.00 61.79 61.02 1ska h SER 344 Cb 0.27 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 62.73 1ska h SER 344 CO -0.00 0.34 0.03 0.40 -1.14 0.00 0.00 176.83 176.45 1ska h ILE 345 N 0.71 1.25 -0.39 3.27 2.04 -0.47 0.69 117.51 124.61 1ska h ILE 345 Ca 0.37 -0.95 -0.05 0.00 1.00 0.00 0.00 64.86 65.24 1ska h ILE 345 Cb 0.36 1.09 -0.02 0.00 -0.74 0.00 0.00 36.82 37.51 1ska h ILE 345 CO -0.25 0.32 0.04 -0.26 0.00 0.00 0.00 178.15 178.00 1ska h PHE 346 N 0.52 0.62 -0.28 1.37 0.04 -0.51 -1.40 116.94 117.31 1ska h PHE 346 Ca 0.12 -0.06 -0.16 0.00 2.80 0.00 0.00 57.97 60.67 1ska h PHE 346 Cb 0.43 -0.18 -0.01 0.00 2.20 0.00 0.00 35.95 38.39 1ska h PHE 346 CO 0.03 0.58 -0.48 0.74 -0.60 0.00 0.00 178.31 178.58 1ska h PHE 347 N 0.58 0.92 -0.19 -0.55 0.04 -1.14 -2.43 116.94 114.19 1ska h PHE 347 Ca 0.13 -0.30 -0.07 0.00 2.80 0.00 0.00 57.97 60.52 1ska h PHE 347 Cb 0.31 -0.18 -0.01 0.00 2.20 0.00 0.00 35.95 38.26 1ska h PHE 347 CO 0.01 1.08 -0.21 0.00 -0.60 0.00 0.00 178.31 178.59 1ska h ALA 348 N 0.87 1.30 0.00 2.45 0.00 -0.51 -1.02 119.26 122.34 1ska h ALA 348 Ca 0.03 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1ska h ALA 348 Cb 1.05 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1ska h ALA 348 CO 0.10 0.47 0.00 1.28 0.00 0.00 0.00 179.25 181.10 1ska n LEU 349 N -4.17 0.00 -0.07 0.00 4.77 -0.56 -4.58 117.00 112.38 1ska n LEU 349 Ca -0.01 0.16 -0.01 0.00 -0.03 0.00 0.00 56.01 56.12 1ska n LEU 349 Cb 0.35 -0.16 -0.00 0.00 -2.33 0.00 0.00 43.42 41.28 1ska n LEU 349 CO 0.40 -0.02 -0.01 0.61 -1.33 0.00 0.00 177.39 177.04 1ska n GLY 350 N 0.89 0.43 0.15 -0.72 0.00 -0.39 -4.71 105.19 100.85 1ska n GLY 350 Ca 0.16 -0.12 0.13 0.00 0.00 0.00 0.00 46.02 46.19 1ska n GLY 350 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1ska h LEU 351 N 0.00 0.00 -3.14 0.99 3.38 -1.66 -2.45 115.31 112.43 1ska h LEU 351 Ca -0.02 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.85 1ska h LEU 351 Cb 0.29 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.96 1ska h LEU 351 CO 0.03 0.00 -0.56 -1.22 0.09 0.00 0.00 178.44 176.78 1ska n TYR 352 N -2.37 0.53 1.20 1.13 4.01 -1.26 -4.67 117.16 115.73 1ska n TYR 352 Ca 0.02 -1.64 0.09 0.00 -0.16 0.00 0.00 57.90 56.21 1ska n TYR 352 Cb 0.25 -0.27 0.51 0.00 -0.31 0.00 0.00 39.34 39.52 1ska n TYR 352 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1ska n ASN 353 N -1.04 0.00 -0.97 7.72 4.13 -0.92 -1.57 115.26 122.61 1ska n ASN 353 Ca 0.24 -0.66 0.12 0.00 1.68 0.00 0.00 54.58 55.96 1ska n ASN 353 Cb 0.74 0.00 0.20 0.00 -1.54 0.00 0.00 39.78 39.18 1ska n ASN 353 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1ska n GLY 354 N 0.19 1.14 3.61 7.41 0.00 -1.26 -4.91 105.19 111.37 1ska n GLY 354 Ca 0.13 -0.67 -0.40 0.00 0.00 0.00 0.00 46.02 45.08 1ska n GLY 354 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ska s THR 355 N -1.80 5.06 0.55 2.61 2.01 -0.61 -4.65 115.64 118.82 1ska s THR 355 Ca 0.33 0.82 -0.15 0.00 0.31 0.00 0.00 61.69 62.99 1ska s THR 355 Cb 0.21 -3.85 -0.07 0.00 0.01 0.00 0.00 72.50 68.81 1ska s THR 355 CO 0.31 0.05 1.00 -1.61 -0.69 0.00 0.00 174.62 173.68 1ska s GLU 356 N 2.33 3.79 0.14 4.92 0.41 -1.26 -4.93 118.70 124.10 1ska s GLU 356 Ca 0.21 0.94 -0.34 0.00 -0.41 0.00 0.00 54.97 55.37 1ska s GLU 356 Cb -0.16 -2.11 -0.16 0.00 -1.78 0.00 0.00 34.13 29.93 1ska s GLU 356 CO 0.10 -0.40 1.33 -2.30 -0.49 0.00 0.00 175.26 173.49 1ska n PRO 357 N -1.88 1.39 -2.40 0.39 -0.02 -1.26 -4.86 135.00 126.36 1ska n PRO 357 Ca 0.07 0.50 -0.40 0.00 -2.02 0.00 0.00 63.50 61.65 1ska n PRO 357 Cb 0.54 -2.12 -0.04 0.00 -0.02 0.00 0.00 33.50 31.86 1ska n PRO 357 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1ska s LEU 358 N 0.56 4.44 0.16 2.45 1.02 -1.26 -4.96 118.68 121.09 1ska s LEU 358 Ca 0.78 2.32 -0.32 0.00 0.02 0.00 0.00 54.13 56.94 1ska s LEU 358 Cb -0.85 -3.74 -0.11 0.00 0.02 0.00 0.00 46.19 41.50 1ska s LEU 358 CO 0.47 -0.31 1.78 -0.24 0.02 0.00 0.00 176.35 178.08 1ska n SER 359 N 0.85 3.99 0.00 2.29 2.88 -1.26 -4.86 113.62 117.51 1ska n SER 359 Ca 0.00 1.02 0.12 0.00 -1.33 0.00 0.00 58.87 58.68 1ska n SER 359 Cb 0.45 -1.55 0.53 0.00 -0.75 0.00 0.00 64.21 62.89 1ska n SER 359 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1ska n ARG 360 N 4.87 0.09 0.00 -1.46 1.74 -1.26 -3.93 116.66 116.71 1ska n ARG 360 Ca 0.17 0.08 0.00 0.00 -0.77 0.00 0.00 57.85 57.34 1ska n ARG 360 Cb 0.36 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.30 1ska n ARG 360 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1ska n THR 361 N -1.44 0.00 -3.93 0.55 -2.24 -1.26 -4.48 114.28 101.47 1ska n THR 361 Ca 0.07 -0.28 -0.15 0.00 -2.27 0.00 0.00 64.05 61.42 1ska n THR 361 Cb 0.25 1.00 -0.15 0.00 -2.10 0.00 0.00 70.33 69.34 1ska n THR 361 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1ska s SER 362 N -0.56 0.25 0.19 3.42 0.01 -1.25 -5.02 113.70 110.74 1ska s SER 362 Ca 0.00 -0.02 -0.32 0.00 1.31 0.00 0.00 55.95 56.92 1ska s SER 362 Cb 0.00 -0.08 -0.11 0.00 0.21 0.00 0.00 66.02 66.03 1ska s SER 362 CO 0.00 -0.03 1.69 -0.69 0.41 0.00 0.00 173.24 174.62 1ska s VAL 363 N 0.39 2.19 -0.06 3.43 1.01 -1.26 -4.54 120.40 121.56 1ska s VAL 363 Ca -0.03 0.13 0.04 0.00 0.00 0.00 0.00 61.98 62.11 1ska s VAL 363 Cb -0.06 -3.08 0.00 0.00 0.00 0.00 0.00 36.38 33.24 1ska s VAL 363 CO -0.01 0.01 -0.18 -1.61 0.00 0.00 0.00 175.10 173.31 1ska s GLU 364 N 1.22 2.10 0.78 2.72 2.02 -1.26 -5.07 118.70 121.20 1ska s GLU 364 Ca 0.74 -0.64 -0.11 0.00 0.02 0.00 0.00 54.97 54.97 1ska s GLU 364 Cb -0.48 -1.73 0.06 0.00 0.10 0.00 0.00 34.13 32.08 1ska s GLU 364 CO 0.32 0.19 1.08 -1.54 0.02 0.00 0.00 175.26 175.33 1ska s SER 365 N 0.24 4.60 0.29 -0.19 1.04 -1.26 -4.85 113.70 113.57 1ska s SER 365 Ca -0.10 1.55 -0.01 0.00 0.48 0.00 0.00 55.95 57.87 1ska s SER 365 Cb -0.14 -2.31 0.47 0.00 0.10 0.00 0.00 66.02 64.13 1ska s SER 365 CO 0.04 -1.93 1.92 0.00 0.98 0.00 0.00 173.24 174.25 1ska h ALA 366 N -1.06 1.45 -0.29 5.32 0.00 -1.95 -0.96 119.26 121.77 1ska h ALA 366 Ca -0.46 -0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.26 1ska h ALA 366 Cb 1.24 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 1ska h ALA 366 CO 0.56 0.43 -0.43 0.87 0.00 0.00 0.00 179.25 180.68 1ska h LYS 367 N 1.11 0.80 -0.93 0.00 1.57 -1.92 0.35 116.57 117.55 1ska h LYS 367 Ca 0.38 -0.48 0.20 0.00 -1.87 0.00 0.00 60.65 58.89 1ska h LYS 367 Cb 0.11 0.04 -0.07 0.00 0.08 0.00 0.00 32.23 32.39 1ska h LYS 367 CO -0.13 1.11 0.61 0.93 -0.57 0.00 0.00 179.45 181.39 1ska h GLU 368 N 0.57 0.46 -0.75 3.15 5.08 -1.80 -0.81 114.58 120.47 1ska h GLU 368 Ca 0.03 -0.03 -0.10 0.00 -1.00 0.00 0.00 59.36 58.26 1ska h GLU 368 Cb 1.03 -0.10 -0.06 0.00 0.50 0.00 0.00 28.75 30.11 1ska h GLU 368 CO 0.10 0.30 0.13 1.28 -1.00 0.00 0.00 179.01 179.82 1ska n LEU 369 N -4.55 5.05 -3.71 1.33 4.77 -0.41 -4.87 117.00 114.60 1ska n LEU 369 Ca 0.20 -2.60 -0.25 0.00 -0.03 0.00 0.00 56.01 53.34 1ska n LEU 369 Cb 0.68 -0.68 0.05 0.00 -2.33 0.00 0.00 43.42 41.15 1ska n LEU 369 CO 0.29 0.64 0.11 -0.67 -1.33 0.00 0.00 177.39 176.43 1ska n ASP 370 N 0.18 -4.03 0.00 -1.43 2.03 -0.31 -2.55 116.55 110.44 1ska n ASP 370 Ca 0.28 -0.70 0.00 0.00 0.52 0.00 0.00 54.79 54.89 1ska n ASP 370 Cb 1.11 -4.43 0.00 0.00 -0.72 0.00 0.00 41.12 37.08 1ska n ASP 370 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1ska n GLY 371 N -1.68 0.68 3.65 0.27 0.00 0.12 -4.86 105.19 103.36 1ska n GLY 371 Ca -0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.54 1ska n GLY 371 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1ska s TYR 372 N -2.57 3.33 0.19 1.61 5.04 -1.06 -4.76 117.35 119.13 1ska s TYR 372 Ca 0.00 0.56 -0.22 0.00 -2.44 0.00 0.00 57.07 54.97 1ska s TYR 372 Cb 0.00 -2.55 0.05 0.00 0.35 0.00 0.00 41.96 39.81 1ska s TYR 372 CO 0.00 -0.09 0.62 -1.54 -1.34 0.00 0.00 175.55 173.20 1ska s SER 373 N 1.23 -0.46 0.25 4.32 1.04 -1.26 -4.31 113.70 114.50 1ska s SER 373 Ca 0.18 -0.19 -0.06 0.00 0.48 0.00 0.00 55.95 56.36 1ska s SER 373 Cb -0.15 0.63 0.26 0.00 0.10 0.00 0.00 66.02 66.86 1ska s SER 373 CO 0.08 -1.07 1.88 0.00 0.98 0.00 0.00 173.24 175.12 1ska h ALA 374 N 2.02 1.21 -0.02 5.32 0.00 -1.85 -0.69 119.26 125.26 1ska h ALA 374 Ca -0.30 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.37 1ska h ALA 374 Cb 1.29 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 1ska h ALA 374 CO 0.35 0.64 -0.55 0.66 0.00 0.00 0.00 179.25 180.35 1ska h SER 375 N 1.22 0.05 1.81 0.00 4.64 -1.88 0.13 113.55 119.53 1ska h SER 375 Ca 0.31 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.60 1ska h SER 375 Cb 0.01 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 1ska h SER 375 CO -0.05 0.59 -0.14 -0.50 -0.87 0.00 0.00 176.83 175.86 1ska h TRP 376 N 0.04 0.00 0.00 4.77 4.06 -1.79 -3.36 115.95 119.66 1ska h TRP 376 Ca -0.00 0.00 -0.21 0.00 2.06 0.00 0.00 58.89 60.73 1ska h TRP 376 Cb 0.99 0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 29.11 1ska h TRP 376 CO 0.00 0.00 -1.79 0.28 -3.56 0.00 0.00 178.44 173.38 1ska n VAL 377 N -2.97 0.79 -2.87 1.49 0.31 -0.30 -4.67 118.33 110.12 1ska n VAL 377 Ca 0.04 -0.29 -0.15 0.00 -0.01 0.00 0.00 64.34 63.93 1ska n VAL 377 Cb 0.52 -1.09 -0.00 0.00 -0.91 0.00 0.00 33.84 32.36 1ska n VAL 377 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 1ska n VAL 378 N -3.01 0.82 -0.88 2.52 0.24 0.03 -4.79 118.33 113.26 1ska n VAL 378 Ca -0.25 -3.99 -0.30 0.00 -2.04 0.00 0.00 64.34 57.76 1ska n VAL 378 Cb 0.75 -0.00 0.17 0.00 -1.47 0.00 0.00 33.84 33.29 1ska n VAL 378 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 1ska s PRO 379 N -2.92 0.79 0.05 7.34 0.04 -1.19 -4.29 135.00 134.83 1ska s PRO 379 Ca 0.35 1.14 -0.36 0.00 0.04 0.00 0.00 61.00 62.16 1ska s PRO 379 Cb 0.40 -1.73 -0.16 0.00 0.04 0.00 0.00 34.50 33.05 1ska s PRO 379 CO -0.04 -2.65 1.46 1.19 0.04 0.00 0.00 177.00 177.00 1ska n PHE 380 N -4.21 1.77 -0.87 0.56 3.72 0.29 -0.91 117.46 117.80 1ska n PHE 380 Ca 0.08 0.52 0.00 0.00 -0.05 0.00 0.00 57.45 58.00 1ska n PHE 380 Cb 0.54 -2.40 0.00 0.00 -0.94 0.00 0.00 39.48 36.67 1ska n PHE 380 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ska n GLY 381 N 2.97 0.54 3.68 1.37 0.00 0.05 -0.89 105.19 112.90 1ska n GLY 381 Ca 0.19 -0.26 -0.40 0.00 0.00 0.00 0.00 46.02 45.55 1ska n GLY 381 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ska n ALA 382 N 0.61 1.00 -3.05 4.61 0.00 -0.09 -4.74 120.51 118.84 1ska n ALA 382 Ca 0.00 0.21 -0.10 0.00 0.00 0.00 0.00 53.44 53.54 1ska n ALA 382 Cb 0.00 -2.23 -0.10 0.00 0.00 0.00 0.00 19.45 17.12 1ska n ALA 382 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 1ska s ARG 383 N -2.33 0.43 0.06 0.00 3.03 -1.26 -1.35 118.95 117.53 1ska s ARG 383 Ca 0.65 -0.49 0.07 0.00 2.03 0.00 0.00 55.73 57.99 1ska s ARG 383 Cb -0.49 0.17 -0.03 0.00 -1.03 0.00 0.00 34.95 33.57 1ska s ARG 383 CO 0.55 -0.09 -0.20 0.00 -1.13 0.00 0.00 175.30 174.43 1ska s ALA 384 N -1.46 1.73 -0.07 7.88 0.00 0.24 -0.23 121.76 129.85 1ska s ALA 384 Ca -0.15 -1.11 0.05 0.00 0.00 0.00 0.00 51.96 50.75 1ska s ALA 384 Cb -0.08 -0.29 -0.00 0.00 0.00 0.00 0.00 23.12 22.74 1ska s ALA 384 CO 0.00 0.37 -0.22 0.71 0.00 0.00 0.00 175.76 176.62 1ska s TYR 385 N -0.94 2.27 -0.19 0.00 2.02 0.36 -1.35 117.35 119.53 1ska s TYR 385 Ca 0.07 -0.79 0.00 0.00 -0.37 0.00 0.00 57.07 55.98 1ska s TYR 385 Cb -0.09 -1.52 0.01 0.00 -0.40 0.00 0.00 41.96 39.97 1ska s TYR 385 CO 0.03 -0.29 -0.17 -0.06 -1.57 0.00 0.00 175.55 173.49 1ska s PHE 386 N 0.13 2.81 -0.02 2.71 0.08 0.26 -0.64 117.98 123.31 1ska s PHE 386 Ca -0.10 -1.51 0.03 0.00 0.12 0.00 0.00 56.93 55.47 1ska s PHE 386 Cb -0.15 -1.96 -0.03 0.00 -0.57 0.00 0.00 43.02 40.31 1ska s PHE 386 CO 0.05 -0.76 -0.09 -1.21 -0.10 0.00 0.00 175.22 173.12 1ska s GLU 387 N 1.32 2.55 -0.08 0.44 2.02 0.43 -1.01 118.70 124.37 1ska s GLU 387 Ca 0.05 -0.70 -0.00 0.00 0.02 0.00 0.00 54.97 54.34 1ska s GLU 387 Cb -0.13 -2.48 -0.03 0.00 0.10 0.00 0.00 34.13 31.59 1ska s GLU 387 CO -0.11 0.62 -0.05 0.99 0.02 0.00 0.00 175.26 176.72 1ska s THR 388 N -0.91 3.85 0.08 3.63 2.01 -0.45 -1.33 115.64 122.52 1ska s THR 388 Ca 0.15 -0.42 0.04 0.00 0.31 0.00 0.00 61.69 61.77 1ska s THR 388 Cb -0.11 -2.60 -0.03 0.00 0.01 0.00 0.00 72.50 69.77 1ska s THR 388 CO 0.05 0.59 -0.11 0.00 -0.69 0.00 0.00 174.62 174.46 1ska s MET 389 N -0.68 0.76 -0.15 4.92 0.23 0.36 -0.50 119.30 124.24 1ska s MET 389 Ca 0.10 -1.00 0.00 0.00 -1.03 0.00 0.00 55.69 53.77 1ska s MET 389 Cb -0.11 -0.57 -0.01 0.00 -1.53 0.00 0.00 34.83 32.61 1ska s MET 389 CO 0.02 0.11 -0.14 -1.14 -2.03 0.00 0.00 175.02 171.83 1ska s GLN 390 N -2.17 3.27 0.12 3.16 2.00 -0.16 -1.14 119.66 124.74 1ska s GLN 390 Ca -0.01 -0.73 0.06 0.00 -2.00 0.00 0.00 55.36 52.69 1ska s GLN 390 Cb -0.07 -2.64 -0.04 0.00 0.80 0.00 0.00 33.01 31.06 1ska s GLN 390 CO 0.01 0.07 -0.04 0.00 -0.50 0.00 0.00 175.29 174.82 1ska h LYS 392 N 3.32 0.46 0.00 0.00 3.64 -0.80 -3.36 116.57 119.83 1ska h LYS 392 Ca -0.48 -0.27 0.00 0.00 -1.27 0.00 0.00 60.65 58.63 1ska h LYS 392 Cb 1.18 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.02 1ska h LYS 392 CO 0.56 0.85 0.00 0.45 -2.27 0.00 0.00 179.45 179.05 1ska n SER 393 N -4.43 0.00 -2.04 4.20 2.88 -1.26 -4.85 113.62 108.13 1ska n SER 393 Ca -0.06 0.17 0.00 0.00 -1.33 0.00 0.00 58.87 57.65 1ska n SER 393 Cb 0.43 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.89 1ska n SER 393 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 1ska n GLU 394 N -0.40 0.34 0.00 -1.46 0.00 -1.26 -5.14 120.64 112.73 1ska n GLU 394 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 1ska n GLU 394 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.44 1ska n GLU 394 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1ska n LYS 395 N -0.90 0.00 -2.04 5.31 5.02 -1.26 -4.28 118.16 120.02 1ska n LYS 395 Ca 0.00 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 55.92 1ska n LYS 395 Cb 0.00 0.00 0.02 0.00 -0.02 0.00 0.00 35.03 35.03 1ska n LYS 395 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1ska s GLU 396 N 0.00 3.40 0.82 1.97 0.41 -1.26 -5.02 118.70 119.02 1ska s GLU 396 Ca 0.00 1.96 -0.12 0.00 -0.41 0.00 0.00 54.97 56.40 1ska s GLU 396 Cb 0.00 -2.27 0.09 0.00 -1.78 0.00 0.00 34.13 30.17 1ska s GLU 396 CO 0.00 -0.90 1.15 -2.14 -0.49 0.00 0.00 175.26 172.88 1ska s PRO 397 N -2.88 1.69 0.10 0.39 0.02 -1.26 -4.79 135.00 128.27 1ska s PRO 397 Ca 0.69 1.51 0.10 0.00 0.02 0.00 0.00 61.00 63.32 1ska s PRO 397 Cb -0.33 -1.81 -0.04 0.00 0.02 0.00 0.00 34.50 32.34 1ska s PRO 397 CO 0.39 -2.13 -0.23 -0.51 -0.33 0.00 0.00 177.00 174.20 1ska s LEU 398 N -5.97 2.46 0.06 -5.54 1.43 -0.29 -1.44 118.68 109.38 1ska s LEU 398 Ca 0.68 -0.62 0.06 0.00 -1.03 0.00 0.00 54.13 53.22 1ska s LEU 398 Cb -0.23 -1.38 -0.04 0.00 0.03 0.00 0.00 46.19 44.58 1ska s LEU 398 CO 0.53 0.20 -0.13 -0.69 0.23 0.00 0.00 176.35 176.50 1ska s VAL 399 N -1.03 3.18 0.01 -1.59 1.01 -0.39 -0.49 120.40 121.11 1ska s VAL 399 Ca 0.15 -1.14 -0.03 0.00 0.00 0.00 0.00 61.98 60.96 1ska s VAL 399 Cb -0.10 -2.41 -0.01 0.00 0.00 0.00 0.00 36.38 33.86 1ska s VAL 399 CO 0.07 0.26 0.05 -0.60 0.00 0.00 0.00 175.10 174.88 1ska s ARG 400 N -1.73 0.36 -0.08 2.72 3.52 -0.44 -2.33 118.95 120.97 1ska s ARG 400 Ca 0.18 -0.46 0.02 0.00 -0.13 0.00 0.00 55.73 55.34 1ska s ARG 400 Cb -0.11 0.14 0.01 0.00 -1.56 0.00 0.00 34.95 33.44 1ska s ARG 400 CO 0.09 -0.07 -0.14 0.00 -0.81 0.00 0.00 175.30 174.36 1ska s ALA 401 N -1.30 1.45 -0.15 6.12 0.00 -1.26 -0.43 121.76 126.19 1ska s ALA 401 Ca -0.14 -0.54 0.01 0.00 0.00 0.00 0.00 51.96 51.29 1ska s ALA 401 Cb -0.08 -0.65 0.00 0.00 0.00 0.00 0.00 23.12 22.39 1ska s ALA 401 CO 0.00 0.09 -0.18 -0.51 0.00 0.00 0.00 175.76 175.15 1ska s LEU 402 N 0.72 2.30 -0.22 0.00 2.01 0.19 -1.24 118.68 122.43 1ska s LEU 402 Ca -0.13 -0.54 -0.00 0.00 0.01 0.00 0.00 54.13 53.46 1ska s LEU 402 Cb -0.16 -1.51 0.02 0.00 0.01 0.00 0.00 46.19 44.55 1ska s LEU 402 CO 0.03 0.07 -0.11 -0.63 1.01 0.00 0.00 176.35 176.72 1ska s ILE 403 N 0.87 2.57 -1.62 -0.59 1.01 -0.22 -0.49 121.20 122.73 1ska s ILE 403 Ca -0.05 -0.99 -0.09 0.00 0.00 0.00 0.00 60.65 59.52 1ska s ILE 403 Cb -0.15 -2.24 0.08 0.00 0.01 0.00 0.00 42.46 40.16 1ska s ILE 403 CO -0.02 0.32 0.37 0.59 0.00 0.00 0.00 174.94 176.21 1ska n ASN 404 N 4.64 -0.74 0.00 3.58 5.03 0.68 -1.62 115.26 126.83 1ska n ASN 404 Ca -0.18 -1.16 0.00 0.00 0.87 0.00 0.00 54.58 54.11 1ska n ASN 404 Cb 0.48 -2.15 0.00 0.00 -1.02 0.00 0.00 39.78 37.09 1ska n ASN 404 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 1ska n ASP 405 N -2.78 0.00 -4.73 6.41 8.00 -1.26 -0.54 116.55 121.65 1ska n ASP 405 Ca -0.15 0.00 -0.40 0.00 0.71 0.00 0.00 54.79 54.95 1ska n ASP 405 Cb 0.60 0.00 -0.05 0.00 -0.02 0.00 0.00 41.12 41.66 1ska n ASP 405 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 1ska s ARG 406 N -0.05 4.47 -0.31 -1.24 3.52 -0.64 -3.72 118.95 120.96 1ska s ARG 406 Ca 0.00 1.00 -0.29 0.00 -0.13 0.00 0.00 55.73 56.31 1ska s ARG 406 Cb 0.00 -3.42 -0.00 0.00 -1.56 0.00 0.00 34.95 29.97 1ska s ARG 406 CO 0.00 0.13 1.39 0.08 -0.81 0.00 0.00 175.30 176.09 1ska s VAL 407 N 0.52 4.00 -0.38 7.11 1.01 -1.26 -1.06 120.40 130.33 1ska s VAL 407 Ca 0.39 1.10 -0.14 0.00 0.00 0.00 0.00 61.98 63.33 1ska s VAL 407 Cb -0.19 -4.08 0.01 0.00 0.00 0.00 0.00 36.38 32.11 1ska s VAL 407 CO 0.21 -0.51 0.28 -0.69 0.00 0.00 0.00 175.10 174.38 1ska s VAL 408 N 4.81 5.26 0.28 2.92 1.01 -0.38 -4.66 120.40 129.64 1ska s VAL 408 Ca 0.60 -0.50 -0.30 0.00 0.00 0.00 0.00 61.98 61.78 1ska s VAL 408 Cb -0.17 -3.85 -0.12 0.00 0.00 0.00 0.00 36.38 32.24 1ska s VAL 408 CO 0.27 -0.20 1.63 -2.65 0.00 0.00 0.00 175.10 174.14 1ska n PRO 409 N 5.14 2.73 -2.50 2.72 -0.02 -1.26 -4.47 135.00 137.34 1ska n PRO 409 Ca -0.12 0.97 -0.34 0.00 -2.02 0.00 0.00 63.50 62.00 1ska n PRO 409 Cb 0.48 -2.77 -0.03 0.00 -0.02 0.00 0.00 33.50 31.16 1ska n PRO 409 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1ska s LEU 410 N -0.15 3.83 0.23 2.45 1.43 -1.26 -4.86 118.68 120.36 1ska s LEU 410 Ca 0.66 1.97 0.09 0.00 -1.03 0.00 0.00 54.13 55.83 1ska s LEU 410 Cb -0.50 -4.56 -0.04 0.00 0.03 0.00 0.00 46.19 41.12 1ska s LEU 410 CO 0.45 -0.85 -0.05 -1.00 0.23 0.00 0.00 176.35 175.13 1ska s HIS 411 N -1.94 2.66 0.00 0.29 3.76 -1.26 -4.72 115.29 114.07 1ska s HIS 411 Ca 0.68 -0.22 0.00 0.00 -0.15 0.00 0.00 55.06 55.37 1ska s HIS 411 Cb -0.18 -1.23 0.00 0.00 1.11 0.00 0.00 32.58 32.28 1ska s HIS 411 CO 0.21 0.58 0.00 0.41 -0.85 0.00 0.00 174.74 175.09 1ska n GLY 412 N -0.45 0.81 3.21 -2.22 0.00 -1.26 -4.82 105.19 100.47 1ska n GLY 412 Ca -0.08 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.83 1ska n GLY 412 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ska s ASP 414 N -2.26 6.62 0.24 0.00 3.84 -1.26 -4.95 116.67 118.91 1ska s ASP 414 Ca -0.03 0.49 -0.23 0.00 -0.00 0.00 0.00 52.55 52.79 1ska s ASP 414 Cb 0.00 -2.43 -0.09 0.00 -1.38 0.00 0.00 42.92 39.03 1ska s ASP 414 CO -0.05 -0.78 0.80 0.54 -0.00 0.00 0.00 175.17 175.67 1ska s VAL 415 N 3.26 4.42 0.70 2.11 0.11 -1.26 -4.62 120.40 125.12 1ska s VAL 415 Ca 0.35 1.53 -0.12 0.00 -2.93 0.00 0.00 61.98 60.80 1ska s VAL 415 Cb -0.13 -3.96 0.16 0.00 -1.53 0.00 0.00 36.38 30.92 1ska s VAL 415 CO 0.17 0.26 0.93 -0.90 -3.33 0.00 0.00 175.10 172.23 1ska n ASP 416 N 0.86 -0.01 0.00 3.54 5.68 0.29 -4.89 116.55 122.03 1ska n ASP 416 Ca -0.02 -1.32 0.13 0.00 -0.50 0.00 0.00 54.79 53.07 1ska n ASP 416 Cb 0.50 -0.72 0.66 0.00 -1.14 0.00 0.00 41.12 40.43 1ska n ASP 416 CO 0.00 0.00 0.00 2.29 -1.33 0.00 0.00 177.20 178.16 1ska n LYS 417 N -3.03 0.44 -0.22 0.11 2.85 -1.26 -1.42 118.16 115.63 1ska n LYS 417 Ca 0.12 0.04 0.11 0.00 -1.05 0.00 0.00 58.31 57.52 1ska n LYS 417 Cb 0.41 -1.50 0.22 0.00 -0.65 0.00 0.00 35.03 33.51 1ska n LYS 417 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 1ska n LEU 418 N -1.23 3.43 -0.09 -5.58 4.77 -1.26 -4.90 117.00 112.14 1ska n LEU 418 Ca 0.13 -1.63 -0.01 0.00 -0.03 0.00 0.00 56.01 54.47 1ska n LEU 418 Cb 0.18 -0.28 -0.00 0.00 -2.33 0.00 0.00 43.42 40.98 1ska n LEU 418 CO 0.19 0.78 -0.01 0.61 -1.33 0.00 0.00 177.39 177.62 1ska n GLY 419 N 1.38 0.47 3.81 -0.72 0.00 -0.51 -4.97 105.19 104.64 1ska n GLY 419 Ca 0.19 -1.03 -0.28 0.00 0.00 0.00 0.00 46.02 44.90 1ska n GLY 419 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ska s ARG 420 N -2.19 2.96 0.29 1.61 0.52 -1.26 -4.02 118.95 116.85 1ska s ARG 420 Ca 0.00 -0.78 0.11 0.00 -0.52 0.00 0.00 55.73 54.55 1ska s ARG 420 Cb 0.00 -2.71 -0.05 0.00 0.52 0.00 0.00 34.95 32.71 1ska s ARG 420 CO 0.00 0.52 -0.18 0.00 0.02 0.00 0.00 175.30 175.66 1ska s LYS 422 N -3.54 3.51 0.17 0.00 1.02 -1.26 -1.26 119.74 118.38 1ska s LYS 422 Ca 0.30 2.26 -0.14 0.00 0.02 0.00 0.00 55.97 58.41 1ska s LYS 422 Cb -0.03 -2.49 0.05 0.00 -0.52 0.00 0.00 37.83 34.84 1ska s LYS 422 CO 0.15 -0.90 1.79 1.25 -0.92 0.00 0.00 175.35 176.72 1ska h LEU 423 N 2.01 0.63 -0.65 3.17 5.85 -1.58 0.38 115.31 125.12 1ska h LEU 423 Ca -0.51 -0.07 -0.00 0.00 0.84 0.00 0.00 57.88 58.14 1ska h LEU 423 Cb 1.28 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 42.11 1ska h LEU 423 CO 0.60 0.52 0.40 0.78 -0.34 0.00 0.00 178.44 180.40 1ska h ASN 424 N 0.69 0.77 -0.45 1.25 2.35 -1.90 -1.36 115.58 116.92 1ska h ASN 424 Ca 0.18 -0.05 -0.09 0.00 -0.55 0.00 0.00 56.30 55.79 1ska h ASN 424 Cb 0.01 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.17 1ska h ASN 424 CO -0.03 0.59 -0.05 -0.78 -1.65 0.00 0.00 177.43 175.51 1ska h ASP 425 N 0.88 0.87 -0.05 5.81 1.82 -1.82 -0.83 116.42 123.10 1ska h ASP 425 Ca 0.23 -0.24 0.03 0.00 -0.39 0.00 0.00 57.03 56.66 1ska h ASP 425 Cb -0.05 -0.23 -0.04 0.00 0.68 0.00 0.00 39.33 39.69 1ska h ASP 425 CO -0.05 0.96 -0.20 0.15 -1.61 0.00 0.00 179.24 178.50 1ska h PHE 426 N 0.81 -0.51 -0.49 0.28 3.57 -0.45 0.64 116.94 120.80 1ska h PHE 426 Ca 0.14 0.02 -0.11 0.00 3.53 0.00 0.00 57.97 61.55 1ska h PHE 426 Cb 0.55 0.24 -0.02 0.00 2.79 0.00 0.00 35.95 39.51 1ska h PHE 426 CO 0.03 -0.28 -0.14 0.28 -2.23 0.00 0.00 178.31 175.98 1ska h VAL 427 N -0.29 1.27 -0.55 1.41 2.07 -1.16 -2.01 116.25 116.98 1ska h VAL 427 Ca 0.07 -1.27 -0.04 0.00 0.82 0.00 0.00 66.70 66.28 1ska h VAL 427 Cb 0.39 1.03 -0.03 0.00 -1.52 0.00 0.00 31.29 31.17 1ska h VAL 427 CO -0.22 0.44 0.17 0.50 0.02 0.00 0.00 177.57 178.48 1ska h LYS 428 N 0.83 0.82 0.00 1.57 3.64 -0.95 -2.33 116.57 120.14 1ska h LYS 428 Ca 0.13 -0.15 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1ska h LYS 428 Cb 0.68 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.36 1ska h LYS 428 CO 0.05 0.72 0.00 0.41 -2.27 0.00 0.00 179.45 178.36 1ska n GLY 429 N -0.93 -1.25 1.41 5.01 0.00 0.20 -2.90 105.19 106.73 1ska n GLY 429 Ca 0.04 -0.06 -0.04 0.00 0.00 0.00 0.00 46.02 45.96 1ska n GLY 429 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ska n LEU 430 N -1.56 4.70 -0.31 0.99 4.77 -0.81 -4.53 117.00 120.25 1ska n LEU 430 Ca 0.05 -2.27 0.04 0.00 -0.03 0.00 0.00 56.01 53.81 1ska n LEU 430 Cb 0.25 -0.86 0.24 0.00 -2.33 0.00 0.00 43.42 40.72 1ska n LEU 430 CO 0.20 0.85 1.25 0.77 -1.33 0.00 0.00 177.39 179.13 1ska h SER 431 N 0.69 0.91 0.24 -1.43 4.64 -1.71 0.12 113.55 117.00 1ska h SER 431 Ca 0.08 0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.40 1ska h SER 431 Cb 1.09 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 63.00 1ska h SER 431 CO 0.18 0.57 -0.11 -0.25 -0.87 0.00 0.00 176.83 176.35 1ska h TRP 432 N 1.03 -0.29 -0.54 4.77 7.01 -1.91 -1.01 115.95 125.00 1ska h TRP 432 Ca 0.41 -0.01 -0.09 0.00 2.11 0.00 0.00 58.89 61.30 1ska h TRP 432 Cb 0.24 0.10 -0.02 0.00 -2.10 0.00 0.00 29.16 27.38 1ska h TRP 432 CO -0.00 -0.14 -0.03 0.00 -2.79 0.00 0.00 178.44 175.48 1ska h ALA 433 N 0.37 0.92 -0.08 2.65 0.00 -1.71 -2.22 119.26 119.18 1ska h ALA 433 Ca -0.03 -0.31 0.02 0.00 0.00 0.00 0.00 54.91 54.59 1ska h ALA 433 Cb 0.29 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1ska h ALA 433 CO 0.05 0.64 0.06 0.00 0.00 0.00 0.00 179.25 180.01 1ska h ARG 434 N 0.87 0.00 0.00 0.00 3.08 -0.56 -1.65 114.38 116.13 1ska h ARG 434 Ca 0.15 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.20 1ska h ARG 434 Cb 0.56 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.61 1ska h ARG 434 CO 0.03 0.00 -0.12 -1.13 -1.07 0.00 0.00 179.97 177.69 1ska n SER 435 N -4.28 0.66 0.00 7.04 3.41 -0.40 -4.91 113.62 115.14 1ska n SER 435 Ca -0.01 0.47 0.00 0.00 -0.26 0.00 0.00 58.87 59.06 1ska n SER 435 Cb 0.17 -0.57 0.00 0.00 -0.26 0.00 0.00 64.21 63.56 1ska n SER 435 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ska n GLY 436 N 1.35 0.73 6.12 5.00 0.00 -0.62 -4.94 105.19 112.83 1ska n GLY 436 Ca 0.05 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1ska n GLY 436 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ska n GLY 437 N -2.54 2.17 1.72 -0.02 0.00 -0.89 -1.30 105.19 104.33 1ska n GLY 437 Ca 0.00 0.06 -0.15 0.00 0.00 0.00 0.00 46.02 45.94 1ska n GLY 437 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ska n ASN 438 N 1.03 3.21 -0.18 1.61 2.04 -1.26 -4.68 115.26 117.02 1ska n ASN 438 Ca 0.00 -3.71 0.24 0.00 -0.44 0.00 0.00 54.58 50.67 1ska n ASN 438 Cb 0.00 -0.74 0.64 0.00 -2.53 0.00 0.00 39.78 37.15 1ska n ASN 438 CO 0.00 0.00 0.00 -0.25 -0.44 0.00 0.00 177.26 176.57 1ska h TRP 439 N 1.03 0.22 0.00 -2.53 2.91 -1.57 -0.97 115.95 115.04 1ska h TRP 439 Ca 0.44 0.01 -0.01 0.00 1.13 0.00 0.00 58.89 60.45 1ska h TRP 439 Cb 2.23 -0.07 -0.00 0.00 -0.51 0.00 0.00 29.16 30.81 1ska h TRP 439 CO 1.32 0.05 -0.06 0.78 -1.03 0.00 0.00 178.44 179.51 1ska h GLY 440 N 0.16 0.00 2.00 2.65 0.00 -1.83 -0.72 103.07 105.33 1ska h GLY 440 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.76 1ska h GLY 440 CO -0.08 0.00 0.00 0.83 0.00 0.00 0.00 176.54 177.29 1ska h GLU 441 N 0.00 0.00 -0.26 4.80 4.39 -1.57 -2.39 114.58 119.55 1ska h GLU 441 Ca -0.00 0.00 0.06 0.00 0.34 0.00 0.00 59.36 59.76 1ska h GLU 441 Cb 0.23 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 1ska h GLU 441 CO 0.01 0.00 0.18 0.00 -1.16 0.00 0.00 179.01 178.04