#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ekg n LEU 3 N 0.00 3.87 -4.57 -3.43 7.94 -1.26 -4.92 117.00 114.63 3ekg n LEU 3 Ca 0.00 1.20 -0.43 0.00 -1.11 0.00 0.00 56.01 55.67 3ekg n LEU 3 Cb 0.00 -1.51 -0.04 0.00 0.53 0.00 0.00 43.42 42.40 3ekg n LEU 3 CO 0.00 -0.38 0.79 -0.55 -1.11 0.00 0.00 177.39 176.15 3ekg s SER 4 N -0.31 6.54 -0.15 1.96 0.15 -1.26 -5.01 113.70 115.62 3ekg s SER 4 Ca 0.56 0.23 -0.26 0.00 0.70 0.00 0.00 55.95 57.18 3ekg s SER 4 Cb -0.54 -2.47 -0.02 0.00 -1.71 0.00 0.00 66.02 61.29 3ekg s SER 4 CO 0.62 -1.06 0.85 -0.63 1.20 0.00 0.00 173.24 174.22 3ekg s ILE 5 N 3.83 4.88 0.78 6.45 -1.09 -1.26 -5.05 121.20 129.74 3ekg s ILE 5 Ca 0.39 1.68 -0.11 0.00 -2.23 0.00 0.00 60.65 60.38 3ekg s ILE 5 Cb -0.10 -4.16 0.06 0.00 -1.58 0.00 0.00 42.46 36.68 3ekg s ILE 5 CO 0.26 0.04 1.09 -2.16 -1.23 0.00 0.00 174.94 172.94 3ekg s PRO 6 N 2.04 2.27 0.38 2.79 0.04 -1.26 -4.85 135.00 136.41 3ekg s PRO 6 Ca 0.40 0.69 0.08 0.00 0.04 0.00 0.00 61.00 62.20 3ekg s PRO 6 Cb -0.17 -1.93 -0.02 0.00 0.04 0.00 0.00 34.50 32.42 3ekg s PRO 6 CO 0.14 -1.51 0.37 0.95 0.04 0.00 0.00 177.00 176.99 3ekg s THR 7 N -3.14 3.15 -0.21 1.26 -4.23 -1.26 -1.36 115.64 109.84 3ekg s THR 7 Ca 0.60 -1.29 -0.22 0.00 -1.18 0.00 0.00 61.69 59.60 3ekg s THR 7 Cb -0.14 -3.10 -0.02 0.00 1.34 0.00 0.00 72.50 70.58 3ekg s THR 7 CO 0.54 -0.08 0.68 -0.63 -0.54 0.00 0.00 174.62 174.59 3ekg s ILE 8 N -2.37 4.97 -0.16 2.99 1.01 0.11 -0.35 121.20 127.40 3ekg s ILE 8 Ca 0.46 1.28 -0.26 0.00 0.00 0.00 0.00 60.65 62.12 3ekg s ILE 8 Cb -0.05 -3.99 -0.24 0.00 0.01 0.00 0.00 42.46 38.19 3ekg s ILE 8 CO 0.28 0.05 0.60 0.50 0.00 0.00 0.00 174.94 176.38 3ekg h LYS 9 N 7.60 0.01 -2.32 2.79 3.64 -0.70 0.53 116.57 128.12 3ekg h LYS 9 Ca -0.29 -0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.00 3ekg h LYS 9 Cb 1.13 0.01 -0.20 0.00 -0.41 0.00 0.00 32.23 32.76 3ekg h LYS 9 CO 0.79 1.01 0.03 -1.14 -2.27 0.00 0.00 179.45 177.88 3ekg s GLN 10 N -2.27 0.89 -0.05 1.90 0.74 -1.08 -4.76 119.66 115.03 3ekg s GLN 10 Ca -0.22 0.26 0.03 0.00 0.05 0.00 0.00 55.36 55.49 3ekg s GLN 10 Cb -0.00 0.42 -0.02 0.00 1.10 0.00 0.00 33.01 34.50 3ekg s GLN 10 CO 0.67 -0.24 -0.15 0.54 -0.55 0.00 0.00 175.29 175.56 3ekg s VAL 11 N -0.92 3.03 0.01 1.34 0.11 -1.26 -1.19 120.40 121.51 3ekg s VAL 11 Ca -0.09 -0.73 0.03 0.00 -2.93 0.00 0.00 61.98 58.25 3ekg s VAL 11 Cb -0.02 -2.19 -0.01 0.00 -1.53 0.00 0.00 36.38 32.63 3ekg s VAL 11 CO 0.07 0.59 -0.09 -0.13 -3.33 0.00 0.00 175.10 172.21 3ekg s ARG 12 N -0.64 0.67 -0.09 1.54 0.52 -0.19 -4.96 118.95 115.80 3ekg s ARG 12 Ca 0.10 -0.42 0.03 0.00 -0.52 0.00 0.00 55.73 54.92 3ekg s ARG 12 Cb -0.11 -0.62 -0.01 0.00 0.52 0.00 0.00 34.95 34.73 3ekg s ARG 12 CO 0.01 0.16 -0.20 0.00 0.02 0.00 0.00 175.30 175.29 3ekg s ALA 13 N -0.46 2.34 0.22 2.13 0.00 -1.26 -0.81 121.76 123.92 3ekg s ALA 13 Ca 0.01 -0.97 0.07 0.00 0.00 0.00 0.00 51.96 51.07 3ekg s ALA 13 Cb -0.05 -0.90 -0.05 0.00 0.00 0.00 0.00 23.12 22.12 3ekg s ALA 13 CO 0.00 0.33 -0.11 -0.06 0.00 0.00 0.00 175.76 175.92 3ekg s PHE 14 N 0.12 1.74 -0.05 0.00 0.08 0.11 -4.48 117.98 115.50 3ekg s PHE 14 Ca -0.10 -0.63 0.06 0.00 0.12 0.00 0.00 56.93 56.37 3ekg s PHE 14 Cb -0.16 -0.87 -0.01 0.00 -0.57 0.00 0.00 43.02 41.41 3ekg s PHE 14 CO 0.06 0.30 -0.22 0.08 -0.10 0.00 0.00 175.22 175.34 3ekg s VAL 15 N -3.02 1.84 0.02 -0.44 1.01 -0.11 -0.31 120.40 119.38 3ekg s VAL 15 Ca 0.24 -0.95 0.04 0.00 0.00 0.00 0.00 61.98 61.32 3ekg s VAL 15 Cb 0.01 -1.56 -0.02 0.00 0.00 0.00 0.00 36.38 34.81 3ekg s VAL 15 CO 0.08 0.52 -0.13 -0.22 0.00 0.00 0.00 175.10 175.34 3ekg s LEU 16 N -0.13 2.11 0.10 3.92 2.96 -0.59 -2.85 118.68 124.20 3ekg s LEU 16 Ca -0.03 -0.36 0.09 0.00 -0.22 0.00 0.00 54.13 53.61 3ekg s LEU 16 Cb -0.13 -0.61 -0.04 0.00 0.50 0.00 0.00 46.19 45.92 3ekg s LEU 16 CO 0.03 0.08 -0.23 -0.13 -1.32 0.00 0.00 176.35 174.78 3ekg s ARG 17 N -0.78 1.26 0.00 1.98 1.81 -1.26 -1.11 118.95 120.84 3ekg s ARG 17 Ca 0.03 -1.19 0.00 0.00 -1.72 0.00 0.00 55.73 52.85 3ekg s ARG 17 Cb -0.07 -1.57 0.00 0.00 -0.45 0.00 0.00 34.95 32.86 3ekg s ARG 17 CO 0.00 0.37 0.00 0.41 -0.68 0.00 0.00 175.30 175.41 3ekg n GLY 18 N 1.14 -0.47 7.00 -3.53 0.00 -1.26 -5.01 105.19 103.07 3ekg n GLY 18 Ca -0.19 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.13 3ekg n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ekg n GLY 19 N 0.32 1.21 7.00 -0.02 0.00 0.18 -4.60 105.19 109.27 3ekg n GLY 19 Ca 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.39 3ekg n GLY 19 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ekg n GLY 20 N 0.00 0.03 0.34 -0.02 0.00 -0.16 -3.84 105.19 101.54 3ekg n GLY 20 Ca 0.00 -0.98 0.06 0.00 0.00 0.00 0.00 46.02 45.10 3ekg n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ekg h ALA 21 N -0.22 1.41 -1.10 4.61 0.00 -1.87 -3.30 119.26 118.81 3ekg h ALA 21 Ca 0.00 0.03 -0.61 0.00 0.00 0.00 0.00 54.91 54.33 3ekg h ALA 21 Cb 0.00 -0.16 -0.10 0.00 0.00 0.00 0.00 17.79 17.53 3ekg h ALA 21 CO 0.00 0.15 1.57 0.34 0.00 0.00 0.00 179.25 181.31 3ekg s ASP 22 N -5.63 6.54 0.38 0.00 2.15 -1.25 -4.66 116.67 114.21 3ekg s ASP 22 Ca -0.12 -1.58 0.20 0.00 0.43 0.00 0.00 52.55 51.49 3ekg s ASP 22 Cb 0.22 -2.57 1.20 0.00 -0.30 0.00 0.00 42.92 41.47 3ekg s ASP 22 CO 0.80 -1.46 1.67 1.88 -0.17 0.00 0.00 175.17 177.89 3ekg h TYR 23 N 9.52 0.75 -0.11 -5.34 0.05 -1.84 -0.32 116.97 119.68 3ekg h TYR 23 Ca 0.23 0.03 0.00 0.00 0.05 0.00 0.00 58.73 59.04 3ekg h TYR 23 Cb 0.99 -0.20 0.00 0.00 1.01 0.00 0.00 36.73 38.54 3ekg h TYR 23 CO 1.29 -0.14 0.00 0.72 -1.05 0.00 0.00 178.16 178.98 3ekg n HIS 24 N -4.86 0.13 -1.80 4.88 8.25 -1.26 -4.47 115.22 116.09 3ekg n HIS 24 Ca 0.32 -0.07 -0.40 0.00 -0.26 0.00 0.00 57.72 57.31 3ekg n HIS 24 Cb 1.10 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 32.20 3ekg n HIS 24 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 3ekg n ASP 25 N 0.16 7.04 -4.88 0.41 2.03 -0.13 -4.50 116.55 116.67 3ekg n ASP 25 Ca 0.17 -2.91 -0.25 0.00 0.52 0.00 0.00 54.79 52.32 3ekg n ASP 25 Cb 0.31 -1.49 -0.02 0.00 -0.72 0.00 0.00 41.12 39.20 3ekg n ASP 25 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 3ekg s GLN 26 N 0.87 2.30 0.00 -0.67 -1.52 -1.26 0.48 119.66 119.86 3ekg s GLN 26 Ca 0.55 -1.91 0.00 0.00 -1.95 0.00 0.00 55.36 52.06 3ekg s GLN 26 Cb 0.16 -2.15 0.00 0.00 -0.22 0.00 0.00 33.01 30.80 3ekg s GLN 26 CO -0.06 -0.49 0.00 0.41 -0.25 0.00 0.00 175.29 174.89 3ekg n GLY 27 N -1.68 1.90 3.87 3.09 0.00 -1.26 -4.99 105.19 106.13 3ekg n GLY 27 Ca -0.00 -2.00 -0.31 0.00 0.00 0.00 0.00 46.02 43.71 3ekg n GLY 27 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3ekg s ASP 28 N -1.00 6.02 -0.68 1.61 1.01 -1.26 -4.33 116.67 118.04 3ekg s ASP 28 Ca 0.00 1.35 0.00 0.00 0.71 0.00 0.00 52.55 54.61 3ekg s ASP 28 Cb 0.00 -2.34 0.00 0.00 1.01 0.00 0.00 42.92 41.59 3ekg s ASP 28 CO 0.00 -1.00 0.00 0.61 0.21 0.00 0.00 175.17 174.99 3ekg n GLY 29 N -2.80 0.87 3.83 0.21 0.00 -1.26 -5.03 105.19 101.00 3ekg n GLY 29 Ca 0.06 -0.57 -0.37 0.00 0.00 0.00 0.00 46.02 45.14 3ekg n GLY 29 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3ekg s HIS 30 N -2.18 3.56 0.50 1.61 5.04 -1.26 -4.70 115.29 117.86 3ekg s HIS 30 Ca 0.00 0.52 0.18 0.00 -1.54 0.00 0.00 55.06 54.22 3ekg s HIS 30 Cb 0.00 -2.04 1.23 0.00 0.04 0.00 0.00 32.58 31.81 3ekg s HIS 30 CO 0.00 0.59 2.06 0.11 -2.34 0.00 0.00 174.74 175.16 3ekg h TRP 31 N 5.46 0.13 0.00 3.88 5.08 -1.39 -1.12 115.95 127.98 3ekg h TRP 31 Ca -0.51 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.47 3ekg h TRP 31 Cb 1.21 -0.04 0.00 0.00 -3.00 0.00 0.00 29.16 27.32 3ekg h TRP 31 CO 0.70 0.07 0.00 1.51 -1.28 0.00 0.00 178.44 179.44 3ekg n ILE 32 N -4.47 0.86 -1.28 0.12 3.06 -1.26 -1.63 119.36 114.77 3ekg n ILE 32 Ca 0.04 0.22 0.04 0.00 -2.50 0.00 0.00 62.75 60.55 3ekg n ILE 32 Cb 0.32 -1.04 0.06 0.00 0.54 0.00 0.00 39.64 39.52 3ekg n ILE 32 CO 0.00 0.00 0.00 -0.67 -2.50 0.00 0.00 176.55 173.38 3ekg n ASP 33 N -1.34 1.20 -4.39 9.51 2.03 -0.44 -4.88 116.55 118.24 3ekg n ASP 33 Ca 0.04 -2.34 -0.45 0.00 0.52 0.00 0.00 54.79 52.56 3ekg n ASP 33 Cb 0.10 -0.25 -0.01 0.00 -0.72 0.00 0.00 41.12 40.23 3ekg n ASP 33 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 3ekg s ASP 34 N -1.67 6.97 -1.45 1.67 2.15 -0.65 -4.41 116.67 119.29 3ekg s ASP 34 Ca 0.13 -2.88 -0.10 0.00 0.43 0.00 0.00 52.55 50.13 3ekg s ASP 34 Cb 0.11 -2.30 0.05 0.00 -0.30 0.00 0.00 42.92 40.49 3ekg s ASP 34 CO 0.01 -0.64 1.02 1.57 -0.17 0.00 0.00 175.17 176.96 3ekg n HIS 35 N 4.57 -2.43 -2.30 -5.34 -0.00 0.09 -4.94 115.22 104.87 3ekg n HIS 35 Ca 0.24 0.93 -0.42 0.00 -0.00 0.00 0.00 57.72 58.48 3ekg n HIS 35 Cb 0.44 -4.39 -0.03 0.00 -0.00 0.00 0.00 29.99 26.02 3ekg n HIS 35 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.34 176.76 3ekg s ILE 36 N -3.35 3.53 0.08 3.57 -1.09 -1.26 -4.40 121.20 118.27 3ekg s ILE 36 Ca 0.54 1.18 -0.31 0.00 -2.23 0.00 0.00 60.65 59.83 3ekg s ILE 36 Cb -0.26 -3.75 -0.07 0.00 -1.58 0.00 0.00 42.46 36.79 3ekg s ILE 36 CO 0.79 0.14 1.40 -0.55 -1.23 0.00 0.00 174.94 175.49 3ekg s SER 37 N 0.66 6.83 0.25 3.58 0.15 0.04 -4.88 113.70 120.32 3ekg s SER 37 Ca 0.58 2.26 0.00 0.00 0.70 0.00 0.00 55.95 59.49 3ekg s SER 37 Cb -0.34 -2.58 -0.03 0.00 -1.71 0.00 0.00 66.02 61.36 3ekg s SER 37 CO 0.34 -0.67 0.23 0.42 1.20 0.00 0.00 173.24 174.75 3ekg s THR 38 N 1.54 0.00 0.00 6.45 -4.23 -1.26 -4.46 115.64 113.68 3ekg s THR 38 Ca 0.65 -1.91 -0.00 0.00 -1.18 0.00 0.00 61.69 59.24 3ekg s THR 38 Cb -0.35 -2.48 -0.01 0.00 1.34 0.00 0.00 72.50 71.00 3ekg s THR 38 CO 0.29 0.00 0.37 -2.65 -0.54 0.00 0.00 174.62 172.09 3ekg n PRO 39 N -0.40 0.15 0.00 3.99 -0.02 -1.26 -4.50 135.00 132.96 3ekg n PRO 39 Ca 0.03 -0.02 0.00 0.00 -2.02 0.00 0.00 63.50 61.49 3ekg n PRO 39 Cb 0.64 -1.46 0.00 0.00 -0.02 0.00 0.00 33.50 32.66 3ekg n PRO 39 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ekg n GLY 41 N 2.11 0.89 0.00 -1.23 0.00 -1.26 -4.87 105.19 100.83 3ekg n GLY 41 Ca 0.01 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.09 3ekg n GLY 41 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3ekg n LYS 42 N -1.33 0.03 -3.74 1.61 2.85 -1.26 -4.24 118.16 112.07 3ekg n LYS 42 Ca 0.00 0.26 -0.38 0.00 -1.05 0.00 0.00 58.31 57.14 3ekg n LYS 42 Cb 0.00 -1.50 -0.12 0.00 -0.65 0.00 0.00 35.03 32.76 3ekg n LYS 42 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 3ekg s TYR 43 N -2.94 3.28 0.39 5.58 2.02 -1.26 -4.99 117.35 119.43 3ekg s TYR 43 Ca 0.07 -1.48 0.19 0.00 -0.37 0.00 0.00 57.07 55.48 3ekg s TYR 43 Cb 0.08 -2.38 1.12 0.00 -0.40 0.00 0.00 41.96 40.39 3ekg s TYR 43 CO 0.23 -0.75 1.74 -1.35 -1.57 0.00 0.00 175.55 173.85 3ekg h PRO 44 N 8.23 0.36 0.00 -1.71 0.11 -2.01 -0.06 132.00 136.91 3ekg h PRO 44 Ca -0.23 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.85 3ekg h PRO 44 Cb 1.08 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.11 3ekg h PRO 44 CO 0.62 0.24 -0.07 0.93 -0.21 0.00 0.00 178.00 179.51 3ekg h GLU 45 N 0.37 0.00 -0.13 1.05 3.07 -1.94 -2.78 114.58 114.23 3ekg h GLU 45 Ca 0.64 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.50 3ekg h GLU 45 Cb 1.63 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.54 3ekg h GLU 45 CO -0.35 0.07 0.00 0.66 -1.40 0.00 0.00 179.01 177.99 3ekg n TYR 46 N -3.85 0.39 0.07 4.33 4.01 -0.06 -4.73 117.16 117.32 3ekg n TYR 46 Ca -0.02 -0.86 -0.22 0.00 -0.16 0.00 0.00 57.90 56.64 3ekg n TYR 46 Cb 0.16 -0.19 -0.15 0.00 -0.31 0.00 0.00 39.34 38.85 3ekg n TYR 46 CO 0.00 0.00 0.00 -0.09 -0.46 0.00 0.00 176.86 176.31 3ekg h ARG 47 N 0.85 0.36 -0.28 -0.72 2.43 -1.19 -3.39 114.38 112.44 3ekg h ARG 47 Ca 0.00 -0.62 -0.16 0.00 -0.81 0.00 0.00 59.98 58.39 3ekg h ARG 47 Cb 1.09 0.23 -0.00 0.00 -0.42 0.00 0.00 29.97 30.86 3ekg h ARG 47 CO 0.08 1.27 -0.48 0.37 -1.51 0.00 0.00 179.97 179.70 3ekg h GLN 48 N 0.10 0.76 -4.42 0.20 5.75 -1.85 -3.39 115.11 112.25 3ekg h GLN 48 Ca -0.32 -0.44 -0.49 0.00 -0.15 0.00 0.00 58.65 57.24 3ekg h GLN 48 Cb 2.08 0.04 -0.34 0.00 1.07 0.00 0.00 27.48 30.33 3ekg h GLN 48 CO 0.18 1.07 -0.81 0.45 -2.65 0.00 0.00 178.83 177.07 3ekg s SER 49 N -6.90 1.62 0.39 -0.69 0.15 -1.26 -0.73 113.70 106.27 3ekg s SER 49 Ca -0.09 -0.26 0.20 0.00 0.70 0.00 0.00 55.95 56.49 3ekg s SER 49 Cb 0.11 -0.75 0.71 0.00 -1.71 0.00 0.00 66.02 64.38 3ekg s SER 49 CO 0.87 0.01 1.74 0.03 1.20 0.00 0.00 173.24 177.09 3ekg h ARG 50 N 7.07 0.00 0.00 5.44 3.08 -1.84 -2.54 114.38 125.59 3ekg h ARG 50 Ca -0.32 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 59.67 3ekg h ARG 50 Cb 1.18 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.22 3ekg h ARG 50 CO 0.47 0.34 -0.26 0.00 -1.07 0.00 0.00 179.97 179.45 3ekg h ARG 51 N 0.00 0.00 -0.15 0.04 3.08 -1.92 -2.49 114.38 112.94 3ekg h ARG 51 Ca -0.00 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.02 3ekg h ARG 51 Cb 0.88 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.92 3ekg h ARG 51 CO 0.04 0.26 -0.03 0.66 -1.07 0.00 0.00 179.97 179.83 3ekg h SER 52 N 0.00 0.21 -0.30 7.04 4.64 -1.82 -0.97 113.55 122.35 3ekg h SER 52 Ca -0.00 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 3ekg h SER 52 Cb 0.52 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 3ekg h SER 52 CO 0.03 0.28 0.00 2.22 -0.87 0.00 0.00 176.83 178.49 3ekg n PHE 53 N -4.37 0.39 -0.82 4.77 1.16 -0.99 -4.96 117.46 112.64 3ekg n PHE 53 Ca -0.01 -0.19 0.00 0.00 -1.87 0.00 0.00 57.45 55.38 3ekg n PHE 53 Cb 0.19 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.06 3ekg n PHE 53 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 3ekg n GLY 54 N 1.33 1.27 0.12 4.97 0.00 -0.37 -4.97 105.19 107.54 3ekg n GLY 54 Ca 0.18 -0.32 0.11 0.00 0.00 0.00 0.00 46.02 45.99 3ekg n GLY 54 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3ekg n ILE 55 N -1.85 0.84 -1.25 -0.61 3.06 -0.97 -2.68 119.36 115.89 3ekg n ILE 55 Ca 0.00 0.22 0.02 0.00 -2.50 0.00 0.00 62.75 60.50 3ekg n ILE 55 Cb 0.19 -1.13 0.21 0.00 0.54 0.00 0.00 39.64 39.45 3ekg n ILE 55 CO 0.00 0.00 0.00 -0.46 -2.50 0.00 0.00 176.55 173.59 3ekg n ASN 56 N -2.16 2.93 0.19 9.51 6.94 -1.26 -4.72 115.26 126.69 3ekg n ASN 56 Ca 0.02 -3.43 0.09 0.00 -0.02 0.00 0.00 54.58 51.23 3ekg n ASN 56 Cb 0.23 -0.58 0.13 0.00 -2.36 0.00 0.00 39.78 37.20 3ekg n ASN 56 CO 0.00 0.00 0.00 1.62 -1.03 0.00 0.00 177.26 177.85 3ekg h VAL 57 N 1.16 0.33 0.00 3.53 3.04 -1.89 -3.39 116.25 119.04 3ekg h VAL 57 Ca 0.11 -1.44 -0.12 0.00 -1.01 0.00 0.00 66.70 64.24 3ekg h VAL 57 Cb 1.48 2.14 -0.02 0.00 -2.01 0.00 0.00 31.29 32.88 3ekg h VAL 57 CO 0.27 0.18 -0.81 -0.07 -1.01 0.00 0.00 177.57 176.14 3ekg h LEU 58 N 0.00 0.00 0.00 3.16 3.38 -1.85 -3.49 115.31 116.51 3ekg h LEU 58 Ca -0.00 -0.37 0.00 0.00 0.09 0.00 0.00 57.88 57.60 3ekg h LEU 58 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 3ekg h LEU 58 CO 0.02 1.15 0.00 0.61 0.09 0.00 0.00 178.44 180.31 3ekg n GLY 59 N 1.53 -1.79 3.83 0.83 0.00 -1.26 -3.63 105.19 104.70 3ekg n GLY 59 Ca -0.20 -1.58 -0.37 0.00 0.00 0.00 0.00 46.02 43.87 3ekg n GLY 59 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ekg s THR 60 N 0.00 5.35 -0.22 2.61 2.01 -0.27 -1.84 115.64 123.28 3ekg s THR 60 Ca 0.00 0.41 -0.10 0.00 0.31 0.00 0.00 61.69 62.31 3ekg s THR 60 Cb 0.00 -3.52 -0.05 0.00 0.01 0.00 0.00 72.50 68.95 3ekg s THR 60 CO 0.00 0.55 0.13 -0.22 -0.69 0.00 0.00 174.62 174.39 3ekg s LEU 61 N -0.64 4.08 -0.17 4.42 2.96 0.05 -1.54 118.68 127.83 3ekg s LEU 61 Ca 0.16 0.13 -0.02 0.00 -0.22 0.00 0.00 54.13 54.19 3ekg s LEU 61 Cb -0.13 -2.07 -0.01 0.00 0.50 0.00 0.00 46.19 44.48 3ekg s LEU 61 CO 0.05 0.12 -0.10 -0.69 -1.32 0.00 0.00 176.35 174.41 3ekg s VAL 62 N 0.74 3.08 -0.12 1.68 1.01 0.57 -2.02 120.40 125.34 3ekg s VAL 62 Ca 0.07 -0.62 0.01 0.00 0.00 0.00 0.00 61.98 61.44 3ekg s VAL 62 Cb -0.13 -2.34 -0.01 0.00 0.00 0.00 0.00 36.38 33.90 3ekg s VAL 62 CO 0.02 0.49 -0.15 -0.69 0.00 0.00 0.00 175.10 174.76 3ekg s VAL 63 N 0.91 2.85 -0.02 2.92 1.01 -0.74 0.05 120.40 127.38 3ekg s VAL 63 Ca -0.02 -0.74 0.08 0.00 0.00 0.00 0.00 61.98 61.30 3ekg s VAL 63 Cb -0.15 -2.17 -0.02 0.00 0.00 0.00 0.00 36.38 34.04 3ekg s VAL 63 CO -0.00 0.54 -0.25 -1.61 0.00 0.00 0.00 175.10 173.77 3ekg s GLU 64 N 0.28 2.14 -0.20 2.72 2.02 0.01 -1.72 118.70 123.95 3ekg s GLU 64 Ca -0.11 -0.92 -0.02 0.00 0.02 0.00 0.00 54.97 53.95 3ekg s GLU 64 Cb -0.16 -2.06 0.06 0.00 0.10 0.00 0.00 34.13 32.06 3ekg s GLU 64 CO 0.06 0.56 -0.00 0.42 0.02 0.00 0.00 175.26 176.32 3ekg s ILE 65 N -0.61 0.86 -0.12 -1.63 1.01 0.89 -1.02 121.20 120.58 3ekg s ILE 65 Ca 0.10 -0.72 -0.16 0.00 0.00 0.00 0.00 60.65 59.87 3ekg s ILE 65 Cb -0.10 -1.25 -0.04 0.00 0.01 0.00 0.00 42.46 41.08 3ekg s ILE 65 CO -0.01 -0.12 0.40 -0.70 0.00 0.00 0.00 174.94 174.51 3ekg s GLU 66 N 1.71 4.27 0.34 2.79 2.12 -0.34 -1.17 118.70 128.41 3ekg s GLU 66 Ca -0.02 0.30 0.07 0.00 0.36 0.00 0.00 54.97 55.68 3ekg s GLU 66 Cb -0.17 -3.41 -0.01 0.00 0.26 0.00 0.00 34.13 30.79 3ekg s GLU 66 CO -0.07 0.24 0.42 0.00 -0.54 0.00 0.00 175.26 175.31 3ekg s ALA 67 N 0.41 4.13 -0.31 6.30 0.00 0.24 -0.00 121.76 132.53 3ekg s ALA 67 Ca 0.22 -1.53 0.23 0.00 0.00 0.00 0.00 51.96 50.87 3ekg s ALA 67 Cb -0.14 -1.51 1.10 0.00 0.00 0.00 0.00 23.12 22.56 3ekg s ALA 67 CO 0.08 -0.04 1.69 -1.13 0.00 0.00 0.00 175.76 176.37 3ekg n SER 68 N -1.57 0.63 -0.90 0.00 3.41 0.53 -1.58 113.62 114.13 3ekg n SER 68 Ca -0.00 0.72 0.12 0.00 -0.26 0.00 0.00 58.87 59.45 3ekg n SER 68 Cb 0.59 -0.83 0.27 0.00 -0.26 0.00 0.00 64.21 63.97 3ekg n SER 68 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3ekg n ASP 69 N -2.27 2.71 0.00 4.04 5.75 -1.26 -4.93 116.55 120.58 3ekg n ASP 69 Ca 0.00 -1.88 0.00 0.00 -0.01 0.00 0.00 54.79 52.90 3ekg n ASP 69 Cb 0.12 -0.16 0.00 0.00 -1.03 0.00 0.00 41.12 40.06 3ekg n ASP 69 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3ekg n GLY 70 N 1.35 2.62 3.76 6.12 0.00 -0.62 -5.05 105.19 113.37 3ekg n GLY 70 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 3ekg n GLY 70 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3ekg s ASN 71 N -1.40 6.08 -0.10 1.61 0.01 -1.26 -4.76 114.94 115.12 3ekg s ASN 71 Ca 0.00 2.55 -0.01 0.00 -0.71 0.00 0.00 52.86 54.69 3ekg s ASN 71 Cb 0.00 -2.63 0.03 0.00 0.41 0.00 0.00 41.25 39.07 3ekg s ASN 71 CO 0.00 -1.00 -0.02 -0.69 -1.51 0.00 0.00 177.10 173.89 3ekg s VAL 72 N -1.36 0.61 0.14 1.60 1.01 -1.26 -0.59 120.40 120.54 3ekg s VAL 72 Ca 0.62 -0.12 0.02 0.00 0.00 0.00 0.00 61.98 62.50 3ekg s VAL 72 Cb -0.35 -0.78 -0.04 0.00 0.00 0.00 0.00 36.38 35.21 3ekg s VAL 72 CO 0.44 0.22 0.28 -0.83 0.00 0.00 0.00 175.10 175.20 3ekg s GLY 73 N 1.87 1.79 0.23 4.51 0.00 -0.32 -4.84 107.32 110.55 3ekg s GLY 73 Ca 0.04 -0.99 -0.14 0.00 0.00 0.00 0.00 44.72 43.62 3ekg s GLY 73 CO -0.07 -0.99 0.49 -0.11 0.00 0.00 0.00 173.10 172.43 3ekg s PHE 74 N -1.71 0.18 0.17 1.90 -0.12 -1.26 -0.08 117.98 117.07 3ekg s PHE 74 Ca 0.35 -0.55 -0.23 0.00 -0.05 0.00 0.00 56.93 56.44 3ekg s PHE 74 Cb -0.11 0.27 0.06 0.00 -0.63 0.00 0.00 43.02 42.61 3ekg s PHE 74 CO 0.28 -0.97 0.65 0.00 -0.05 0.00 0.00 175.22 175.13 3ekg s ALA 75 N -3.96 -1.54 0.03 1.99 0.00 -0.70 -4.35 121.76 113.21 3ekg s ALA 75 Ca 0.17 0.37 0.05 0.00 0.00 0.00 0.00 51.96 52.55 3ekg s ALA 75 Cb -0.01 0.85 -0.02 0.00 0.00 0.00 0.00 23.12 23.94 3ekg s ALA 75 CO 0.05 -0.82 -0.14 0.14 0.00 0.00 0.00 175.76 174.98 3ekg s VAL 76 N -3.73 1.14 0.11 0.00 -7.23 -1.26 -1.79 120.40 107.64 3ekg s VAL 76 Ca 0.03 -0.91 -0.04 0.00 -1.81 0.00 0.00 61.98 59.26 3ekg s VAL 76 Cb -0.02 -1.01 0.01 0.00 0.56 0.00 0.00 36.38 35.93 3ekg s VAL 76 CO -0.09 0.09 0.21 1.07 -0.31 0.00 0.00 175.10 176.07 3ekg n THR 77 N 2.10 0.00 -3.45 5.32 5.66 -0.86 -4.91 114.28 118.14 3ekg n THR 77 Ca -0.17 -0.32 -0.37 0.00 -3.05 0.00 0.00 64.05 60.14 3ekg n THR 77 Cb 0.55 0.29 -0.07 0.00 -1.55 0.00 0.00 70.33 69.55 3ekg n THR 77 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 3ekg s THR 78 N -2.71 5.26 0.00 1.09 2.01 -1.26 -0.77 115.64 119.26 3ekg s THR 78 Ca 0.05 0.70 0.00 0.00 0.31 0.00 0.00 61.69 62.75 3ekg s THR 78 Cb -0.01 -3.70 0.00 0.00 0.01 0.00 0.00 72.50 68.80 3ekg s THR 78 CO 0.04 0.36 0.00 0.61 -0.69 0.00 0.00 174.62 174.94 3ekg n GLY 79 N 3.37 0.61 7.00 4.40 0.00 -0.77 -4.71 105.19 115.09 3ekg n GLY 79 Ca -0.10 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.88 3ekg n GLY 79 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ekg n GLY 80 N 0.00 1.34 0.15 -0.02 0.00 -1.19 -3.12 105.19 102.35 3ekg n GLY 80 Ca 0.00 -0.55 -0.06 0.00 0.00 0.00 0.00 46.02 45.41 3ekg n GLY 80 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3ekg h GLU 81 N 0.00 0.21 -0.40 1.61 4.81 -1.88 -0.26 114.58 118.67 3ekg h GLU 81 Ca 0.00 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.21 3ekg h GLU 81 Cb 0.00 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.31 3ekg h GLU 81 CO 0.00 0.14 0.20 -1.00 -0.73 0.00 0.00 179.01 177.62 3ekg h PRO 82 N 0.22 0.56 -0.32 0.92 0.13 -1.93 -1.06 132.00 130.52 3ekg h PRO 82 Ca 0.16 -0.06 -0.17 0.00 -0.87 0.00 0.00 66.00 65.07 3ekg h PRO 82 Cb 0.17 -0.11 -0.00 0.00 0.13 0.00 0.00 31.00 31.18 3ekg h PRO 82 CO -0.20 0.43 -0.46 0.00 -0.23 0.00 0.00 178.00 177.54 3ekg h ALA 83 N 1.66 0.58 -0.72 -0.56 0.00 -1.36 -2.81 119.26 116.05 3ekg h ALA 83 Ca 0.14 -0.48 -0.00 0.00 0.00 0.00 0.00 54.91 54.57 3ekg h ALA 83 Cb 0.05 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 3ekg h ALA 83 CO -0.02 0.68 0.44 0.00 0.00 0.00 0.00 179.25 180.35 3ekg h ALA 84 N 0.80 1.43 -0.25 0.00 0.00 -0.23 -0.61 119.26 120.41 3ekg h ALA 84 Ca 0.04 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.88 3ekg h ALA 84 Cb 1.05 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 3ekg h ALA 84 CO 0.10 0.50 0.14 -0.92 0.00 0.00 0.00 179.25 179.08 3ekg h TYR 85 N 0.98 0.26 -0.59 0.00 3.20 -1.05 -0.54 116.97 119.23 3ekg h TYR 85 Ca 0.26 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.12 3ekg h TYR 85 Cb -0.06 -0.08 -0.03 0.00 1.54 0.00 0.00 36.73 38.10 3ekg h TYR 85 CO 0.00 0.16 0.31 0.82 -1.64 0.00 0.00 178.16 177.81 3ekg h ILE 86 N 0.29 1.20 0.26 1.81 2.04 -1.11 0.38 117.51 122.38 3ekg h ILE 86 Ca 0.10 -0.53 -0.01 0.00 1.00 0.00 0.00 64.86 65.41 3ekg h ILE 86 Cb -0.00 0.46 0.00 0.00 -0.74 0.00 0.00 36.82 36.55 3ekg h ILE 86 CO -0.05 0.22 -0.12 0.58 0.00 0.00 0.00 178.15 178.78 3ekg h VAL 87 N 0.81 0.78 -0.10 1.67 2.07 -0.76 -0.75 116.25 119.96 3ekg h VAL 87 Ca 0.21 -0.22 -0.05 0.00 0.82 0.00 0.00 66.70 67.46 3ekg h VAL 87 Cb 0.08 0.91 -0.00 0.00 -1.52 0.00 0.00 31.29 30.75 3ekg h VAL 87 CO -0.03 0.05 -0.11 -0.33 0.02 0.00 0.00 177.57 177.16 3ekg h GLU 88 N -0.46 0.26 0.00 1.57 4.39 -1.06 -0.58 114.58 118.70 3ekg h GLU 88 Ca -0.04 -0.14 -0.14 0.00 0.34 0.00 0.00 59.36 59.38 3ekg h GLU 88 Cb 0.34 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.98 3ekg h GLU 88 CO 0.06 0.69 -0.73 0.87 -1.16 0.00 0.00 179.01 178.73 3ekg h LYS 89 N -0.15 0.00 0.00 2.33 1.79 -1.01 -3.40 116.57 116.12 3ekg h LYS 89 Ca 0.01 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.48 3ekg h LYS 89 Cb 0.64 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.29 3ekg h LYS 89 CO 0.03 0.60 -0.28 1.58 -1.08 0.00 0.00 179.45 180.30 3ekg n HIS 90 N -3.22 0.00 0.10 -1.35 -0.00 -0.39 -4.87 115.22 105.49 3ekg n HIS 90 Ca 0.00 0.00 -0.02 0.00 0.46 0.00 0.00 57.72 58.16 3ekg n HIS 90 Cb 0.80 -0.08 0.22 0.00 -0.12 0.00 0.00 29.99 30.82 3ekg n HIS 90 CO 0.00 0.00 0.00 -0.07 0.46 0.00 0.00 176.34 176.73 3ekg h LEU 91 N -0.14 0.22 -1.00 0.27 3.38 -1.19 -3.29 115.31 113.56 3ekg h LEU 91 Ca -0.01 -0.10 0.28 0.00 0.09 0.00 0.00 57.88 58.14 3ekg h LEU 91 Cb 0.26 -0.06 -0.13 0.00 0.09 0.00 0.00 40.66 40.82 3ekg h LEU 91 CO -0.01 0.63 0.58 0.00 0.09 0.00 0.00 178.44 179.73 3ekg h ALA 92 N 1.38 1.85 -0.12 1.53 0.00 -1.32 -1.48 119.26 121.10 3ekg h ALA 92 Ca 0.01 0.15 0.03 0.00 0.00 0.00 0.00 54.91 55.11 3ekg h ALA 92 Cb 0.83 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 3ekg h ALA 92 CO 0.07 -0.39 0.11 0.07 0.00 0.00 0.00 179.25 179.10 3ekg h ARG 93 N 0.47 0.00 0.00 0.00 0.11 -1.87 -1.71 114.38 111.39 3ekg h ARG 93 Ca 0.68 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.76 3ekg h ARG 93 Cb 1.41 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.49 3ekg h ARG 93 CO -0.53 0.00 -0.34 0.74 0.10 0.00 0.00 179.97 179.94 3ekg h PHE 94 N 0.00 0.00 0.00 4.08 0.04 -1.51 -3.38 116.94 116.17 3ekg h PHE 94 Ca 0.06 0.00 -0.42 0.00 2.80 0.00 0.00 57.97 60.40 3ekg h PHE 94 Cb 0.27 0.00 -0.07 0.00 2.20 0.00 0.00 35.95 38.35 3ekg h PHE 94 CO 0.00 0.00 -2.42 1.28 -0.60 0.00 0.00 178.31 176.57 3ekg n LEU 95 N -2.54 2.28 -4.66 1.54 4.32 -0.71 -4.76 117.00 112.48 3ekg n LEU 95 Ca 0.04 0.20 -0.42 0.00 -0.02 0.00 0.00 56.01 55.80 3ekg n LEU 95 Cb 0.48 -0.87 -0.03 0.00 -1.62 0.00 0.00 43.42 41.38 3ekg n LEU 95 CO 0.35 0.68 1.60 -1.61 -1.22 0.00 0.00 177.39 177.18 3ekg s GLU 96 N -2.50 4.10 0.00 3.23 2.02 -0.77 -1.04 118.70 123.73 3ekg s GLU 96 Ca -0.36 2.56 0.00 0.00 0.02 0.00 0.00 54.97 57.19 3ekg s GLU 96 Cb 0.12 -4.16 0.00 0.00 0.10 0.00 0.00 34.13 30.19 3ekg s GLU 96 CO 0.54 -1.00 0.00 0.41 0.02 0.00 0.00 175.26 175.23 3ekg n GLY 97 N 4.57 2.42 3.85 -1.39 0.00 0.18 -4.97 105.19 109.85 3ekg n GLY 97 Ca 0.20 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.90 3ekg n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ekg s ALA 98 N -2.58 3.08 0.38 4.61 0.00 -0.20 -4.63 121.76 122.42 3ekg s ALA 98 Ca 0.00 0.08 -0.25 0.00 0.00 0.00 0.00 51.96 51.80 3ekg s ALA 98 Cb 0.00 -3.11 -0.09 0.00 0.00 0.00 0.00 23.12 19.92 3ekg s ALA 98 CO 0.00 -0.41 1.04 1.03 0.00 0.00 0.00 175.76 177.43 3ekg s ARG 99 N -4.48 4.26 0.53 0.00 0.52 -1.26 0.05 118.95 118.56 3ekg s ARG 99 Ca 0.57 1.52 0.35 0.00 -0.52 0.00 0.00 55.73 57.66 3ekg s ARG 99 Cb -0.10 -2.63 1.90 0.00 0.52 0.00 0.00 34.95 34.63 3ekg s ARG 99 CO 0.40 -0.06 2.08 -0.39 0.02 0.00 0.00 175.30 177.35 3ekg h VAL 100 N 2.33 0.00 -0.01 3.52 -1.51 -1.53 -1.73 116.25 117.32 3ekg h VAL 100 Ca -0.48 -0.02 0.00 0.00 -1.23 0.00 0.00 66.70 64.97 3ekg h VAL 100 Cb 1.21 0.82 0.00 0.00 -2.13 0.00 0.00 31.29 31.19 3ekg h VAL 100 CO 0.63 0.00 -0.18 0.35 -1.23 0.00 0.00 177.57 177.14 3ekg n THR 101 N -2.75 0.00 -0.71 7.19 -2.24 -1.26 -4.40 114.28 110.11 3ekg n THR 101 Ca -0.02 -0.11 -0.07 0.00 -2.27 0.00 0.00 64.05 61.58 3ekg n THR 101 Cb 0.07 0.20 -0.09 0.00 -2.10 0.00 0.00 70.33 68.41 3ekg n THR 101 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3ekg n ASP 102 N -0.72 4.57 0.12 3.42 8.00 -0.65 -4.61 116.55 126.67 3ekg n ASP 102 Ca 0.14 -2.30 -0.13 0.00 0.71 0.00 0.00 54.79 53.20 3ekg n ASP 102 Cb 0.32 -1.14 -0.08 0.00 -0.02 0.00 0.00 41.12 40.20 3ekg n ASP 102 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 3ekg h ILE 103 N 1.77 0.87 -0.89 0.53 2.04 -1.85 -1.61 117.51 118.38 3ekg h ILE 103 Ca 0.10 -0.21 0.00 0.00 1.00 0.00 0.00 64.86 65.75 3ekg h ILE 103 Cb 1.15 1.00 -0.04 0.00 -0.74 0.00 0.00 36.82 38.19 3ekg h ILE 103 CO 0.17 0.05 0.56 -0.33 0.00 0.00 0.00 178.15 178.60 3ekg h GLU 104 N -0.34 1.19 -0.27 2.37 4.39 -1.99 -1.35 114.58 118.58 3ekg h GLU 104 Ca -0.02 -0.09 -0.08 0.00 0.34 0.00 0.00 59.36 59.50 3ekg h GLU 104 Cb 0.27 -0.26 -0.01 0.00 -0.10 0.00 0.00 28.75 28.65 3ekg h GLU 104 CO 0.04 0.81 -0.14 -0.09 -1.16 0.00 0.00 179.01 178.48 3ekg h ARG 105 N 1.21 0.57 -0.76 2.33 1.12 -1.92 -2.32 114.38 114.61 3ekg h ARG 105 Ca 0.32 -0.25 -0.01 0.00 -1.11 0.00 0.00 59.98 58.92 3ekg h ARG 105 Cb -0.09 -0.01 -0.04 0.00 -0.01 0.00 0.00 29.97 29.82 3ekg h ARG 105 CO -0.06 0.82 0.43 0.82 -3.11 0.00 0.00 179.97 178.86 3ekg h ILE 106 N 0.31 1.23 -0.05 1.20 2.04 -1.11 -1.59 117.51 119.53 3ekg h ILE 106 Ca 0.06 -0.56 -0.00 0.00 1.00 0.00 0.00 64.86 65.36 3ekg h ILE 106 Cb 0.65 0.20 -0.00 0.00 -0.74 0.00 0.00 36.82 36.94 3ekg h ILE 106 CO 0.04 0.25 0.03 -0.25 0.00 0.00 0.00 178.15 178.22 3ekg h TRP 107 N 1.06 0.07 -0.85 1.37 7.01 -1.18 -2.80 115.95 120.63 3ekg h TRP 107 Ca 0.27 -0.00 0.08 0.00 2.11 0.00 0.00 58.89 61.34 3ekg h TRP 107 Cb 0.02 -0.02 -0.07 0.00 -2.10 0.00 0.00 29.16 26.99 3ekg h TRP 107 CO -0.00 0.13 0.51 0.22 -2.79 0.00 0.00 178.44 176.51 3ekg h ASP 108 N -0.01 0.78 0.00 2.65 3.58 -1.22 -0.65 116.42 121.55 3ekg h ASP 108 Ca 0.02 0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.50 3ekg h ASP 108 Cb 0.08 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 41.00 3ekg h ASP 108 CO -0.00 0.47 0.00 0.00 -2.88 0.00 0.00 179.24 176.83 3ekg n GLN 109 N -4.67 0.48 0.00 0.28 6.02 -0.62 -1.00 117.38 117.87 3ekg n GLN 109 Ca 0.13 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.12 3ekg n GLN 109 Cb 0.22 -1.26 0.00 0.00 1.02 0.00 0.00 30.24 30.22 3ekg n GLN 109 CO 0.00 0.00 0.00 0.98 -1.01 0.00 0.00 177.06 177.03 3ekg n TYR 111 N 0.71 0.00 0.22 1.08 4.19 -0.25 -1.45 117.16 121.66 3ekg n TYR 111 Ca 0.00 0.00 0.09 0.00 3.31 0.00 0.00 57.90 61.30 3ekg n TYR 111 Cb 0.23 0.00 0.50 0.00 0.49 0.00 0.00 39.34 40.56 3ekg n TYR 111 CO 0.00 0.00 0.00 -0.91 0.91 0.00 0.00 176.86 176.86 3ekg h ASN 112 N 0.00 0.00 1.52 2.98 2.35 -1.31 -1.84 115.58 119.28 3ekg h ASN 112 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3ekg h ASN 112 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 3ekg h ASN 112 CO 0.00 0.24 -0.27 0.28 -1.65 0.00 0.00 177.43 176.03 3ekg h SER 113 N 0.00 0.00 -0.03 5.81 0.02 -1.46 -3.30 113.55 114.58 3ekg h SER 113 Ca -0.00 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.92 3ekg h SER 113 Cb 0.65 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.19 3ekg h SER 113 CO 0.03 0.02 0.00 0.35 -1.14 0.00 0.00 176.83 176.09 3ekg n THR 114 N -2.67 0.04 -0.33 -2.27 -2.24 -1.06 -4.65 114.28 101.10 3ekg n THR 114 Ca 0.04 -0.52 0.14 0.00 -2.27 0.00 0.00 64.05 61.43 3ekg n THR 114 Cb 0.50 1.25 0.33 0.00 -2.10 0.00 0.00 70.33 70.31 3ekg n THR 114 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 3ekg h LEU 115 N 2.67 0.55 -1.21 3.22 3.38 -1.42 0.19 115.31 122.70 3ekg h LEU 115 Ca 0.00 0.13 0.00 0.00 0.09 0.00 0.00 57.88 58.10 3ekg h LEU 115 Cb 0.58 0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.38 3ekg h LEU 115 CO 0.00 0.11 0.00 0.00 0.09 0.00 0.00 178.44 178.64 3ekg n TYR 116 N -4.92 0.63 -1.87 1.13 0.18 -1.26 -2.48 117.16 108.56 3ekg n TYR 116 Ca 0.23 0.32 0.00 0.00 1.88 0.00 0.00 57.90 60.34 3ekg n TYR 116 Cb 0.65 -1.02 0.00 0.00 -0.38 0.00 0.00 39.34 38.59 3ekg n TYR 116 CO 0.00 0.00 0.00 2.48 -2.08 0.00 0.00 176.86 177.26 3ekg n TYR 117 N -2.14 0.00 0.00 -3.48 0.18 -0.25 -5.08 117.16 106.39 3ekg n TYR 117 Ca -0.01 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.77 3ekg n TYR 117 Cb 0.03 0.01 0.00 0.00 -0.38 0.00 0.00 39.34 39.00 3ekg n TYR 117 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 3ekg n GLY 118 N 0.00 1.43 4.93 -7.48 0.00 0.51 -4.81 105.19 99.77 3ekg n GLY 118 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3ekg n GLY 118 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ekg n ARG 119 N 0.00 0.00 -4.04 1.61 1.74 -1.26 -4.77 116.66 109.93 3ekg n ARG 119 Ca 0.00 0.00 -0.14 0.00 -0.77 0.00 0.00 57.85 56.94 3ekg n ARG 119 Cb 0.00 -0.01 -0.03 0.00 -1.02 0.00 0.00 32.46 31.40 3ekg n ARG 119 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 3ekg s LYS 120 N 0.00 1.95 3.22 5.56 1.02 -1.26 -4.78 119.74 125.46 3ekg s LYS 120 Ca 0.00 -1.70 0.00 0.00 0.02 0.00 0.00 55.97 54.29 3ekg s LYS 120 Cb 0.00 0.47 0.00 0.00 -0.52 0.00 0.00 37.83 37.78 3ekg s LYS 120 CO 0.00 -0.83 0.00 0.41 -0.92 0.00 0.00 175.35 174.01 3ekg n GLY 121 N -0.55 0.10 0.32 -3.33 0.00 -1.26 -4.14 105.19 96.32 3ekg n GLY 121 Ca -0.01 -0.93 0.14 0.00 0.00 0.00 0.00 46.02 45.23 3ekg n GLY 121 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3ekg h LEU 122 N 0.00 -0.11 -1.09 0.99 5.85 -1.96 -0.68 115.31 118.32 3ekg h LEU 122 Ca 0.00 0.22 -0.02 0.00 0.84 0.00 0.00 57.88 58.92 3ekg h LEU 122 Cb 0.00 0.32 -0.04 0.00 0.37 0.00 0.00 40.66 41.32 3ekg h LEU 122 CO 0.00 -0.23 0.39 0.58 -0.34 0.00 0.00 178.44 178.84 3ekg h VAL 123 N 0.14 1.22 -0.07 1.05 2.07 -1.88 -1.21 116.25 117.57 3ekg h VAL 123 Ca 0.58 -0.57 -0.16 0.00 0.82 0.00 0.00 66.70 67.37 3ekg h VAL 123 Cb 1.21 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 31.21 3ekg h VAL 123 CO -0.73 0.25 -0.65 0.40 0.02 0.00 0.00 177.57 176.86 3ekg h ILE 124 N 1.03 1.39 -0.55 4.57 1.08 -1.32 -1.55 117.51 122.15 3ekg h ILE 124 Ca 0.26 -2.07 0.01 0.00 -0.39 0.00 0.00 64.86 62.67 3ekg h ILE 124 Cb 0.04 2.06 -0.03 0.00 -3.07 0.00 0.00 36.82 35.82 3ekg h ILE 124 CO -0.04 0.61 0.36 0.78 -0.69 0.00 0.00 178.15 179.17 3ekg h ASN 125 N 0.21 0.62 -0.15 1.72 4.21 -0.86 0.79 115.58 122.11 3ekg h ASN 125 Ca -0.01 -0.01 -0.01 0.00 1.21 0.00 0.00 56.30 57.48 3ekg h ASN 125 Cb 1.19 -0.15 -0.01 0.00 -1.12 0.00 0.00 38.32 38.23 3ekg h ASN 125 CO 0.11 0.44 0.07 0.74 -1.29 0.00 0.00 177.43 177.50 3ekg h THR 126 N 0.73 1.13 -1.00 2.81 2.02 -0.96 -1.13 112.91 116.51 3ekg h THR 126 Ca 0.21 -0.37 0.02 0.00 0.77 0.00 0.00 66.41 67.03 3ekg h THR 126 Cb -0.06 1.10 -0.05 0.00 -1.74 0.00 0.00 68.15 67.39 3ekg h THR 126 CO -0.06 0.12 0.66 0.40 0.37 0.00 0.00 175.52 177.02 3ekg h ILE 127 N 0.12 1.24 -0.72 3.11 2.04 -1.01 -2.25 117.51 120.03 3ekg h ILE 127 Ca 0.05 -0.46 -0.02 0.00 1.00 0.00 0.00 64.86 65.44 3ekg h ILE 127 Cb 0.13 -0.22 -0.03 0.00 -0.74 0.00 0.00 36.82 35.96 3ekg h ILE 127 CO -0.01 0.24 0.39 0.28 0.00 0.00 0.00 178.15 179.05 3ekg h SER 128 N 1.34 0.91 -0.61 1.72 0.02 -0.41 -0.63 113.55 115.88 3ekg h SER 128 Ca 0.37 -0.11 -0.04 0.00 -0.84 0.00 0.00 61.79 61.18 3ekg h SER 128 Cb -0.12 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 62.16 3ekg h SER 128 CO -0.09 0.76 0.24 1.23 -1.14 0.00 0.00 176.83 177.82 3ekg h GLY 129 N 1.00 0.99 0.94 -3.77 0.00 -0.66 0.12 103.07 101.69 3ekg h GLY 129 Ca 0.25 -0.55 -0.04 0.00 0.00 0.00 0.00 47.33 47.00 3ekg h GLY 129 CO -0.04 0.51 0.10 -2.08 0.00 0.00 0.00 176.54 175.03 3ekg h VAL 130 N 0.85 1.23 -0.68 4.60 2.07 -1.20 -1.70 116.25 121.42 3ekg h VAL 130 Ca 0.20 -0.80 0.01 0.00 0.82 0.00 0.00 66.70 66.93 3ekg h VAL 130 Cb 0.22 0.97 -0.03 0.00 -1.52 0.00 0.00 31.29 30.92 3ekg h VAL 130 CO -0.01 0.28 0.45 -0.78 0.02 0.00 0.00 177.57 177.52 3ekg h ASP 131 N 0.52 0.78 -0.72 0.57 3.58 -0.84 -0.72 116.42 119.60 3ekg h ASP 131 Ca 0.13 -0.02 -0.03 0.00 0.42 0.00 0.00 57.03 57.53 3ekg h ASP 131 Cb 0.32 -0.19 -0.03 0.00 1.72 0.00 0.00 39.33 41.14 3ekg h ASP 131 CO 0.00 0.57 0.33 -0.07 -2.88 0.00 0.00 179.24 177.19 3ekg h LEU 132 N 0.92 0.95 -1.30 2.28 3.38 -0.75 -1.60 115.31 119.19 3ekg h LEU 132 Ca 0.25 -0.14 -0.05 0.00 0.09 0.00 0.00 57.88 58.02 3ekg h LEU 132 Cb -0.11 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.39 3ekg h LEU 132 CO -0.06 0.83 -0.09 0.00 0.09 0.00 0.00 178.44 179.21 3ekg h ALA 133 N 1.16 1.43 -0.45 1.53 0.00 -0.74 -1.02 119.26 121.16 3ekg h ALA 133 Ca 0.24 -0.21 -0.10 0.00 0.00 0.00 0.00 54.91 54.84 3ekg h ALA 133 Cb 0.14 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3ekg h ALA 133 CO -0.03 0.40 -0.11 -0.07 0.00 0.00 0.00 179.25 179.44 3ekg h LEU 134 N 0.34 0.88 -0.77 0.00 3.38 -0.46 -0.89 115.31 117.79 3ekg h LEU 134 Ca 0.07 -0.36 -0.12 0.00 0.09 0.00 0.00 57.88 57.56 3ekg h LEU 134 Cb 0.38 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 3ekg h LEU 134 CO 0.02 1.04 -0.39 -0.50 0.09 0.00 0.00 178.44 178.70 3ekg h TRP 135 N 0.71 0.56 -0.41 1.13 4.06 -0.94 -0.25 115.95 120.80 3ekg h TRP 135 Ca 0.12 -0.15 -0.04 0.00 2.06 0.00 0.00 58.89 60.87 3ekg h TRP 135 Cb 0.65 -0.12 -0.02 0.00 -1.00 0.00 0.00 29.16 28.67 3ekg h TRP 135 CO 0.05 0.79 0.10 0.22 -3.56 0.00 0.00 178.44 176.05 3ekg h ASP 136 N 0.39 0.62 -0.54 -3.49 3.58 -1.00 -1.16 116.42 114.83 3ekg h ASP 136 Ca 0.04 -0.23 -0.02 0.00 0.42 0.00 0.00 57.03 57.24 3ekg h ASP 136 Cb 0.86 -0.16 -0.02 0.00 1.72 0.00 0.00 39.33 41.72 3ekg h ASP 136 CO 0.07 0.69 0.24 0.25 -2.88 0.00 0.00 179.24 177.61 3ekg h LEU 137 N 0.53 0.72 -0.99 2.28 5.85 -0.90 -1.20 115.31 121.59 3ekg h LEU 137 Ca 0.13 -0.14 -0.05 0.00 0.84 0.00 0.00 57.88 58.65 3ekg h LEU 137 Cb 0.31 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.13 3ekg h LEU 137 CO 0.00 0.66 0.12 0.25 -0.34 0.00 0.00 178.44 179.14 3ekg h LEU 138 N 0.73 0.80 -0.71 2.25 5.85 -0.87 0.15 115.31 123.51 3ekg h LEU 138 Ca 0.18 -0.15 -0.09 0.00 0.84 0.00 0.00 57.88 58.66 3ekg h LEU 138 Cb 0.15 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 3ekg h LEU 138 CO -0.02 0.79 -0.01 1.23 -0.34 0.00 0.00 178.44 180.09 3ekg h GLY 139 N 0.98 1.06 1.48 3.75 0.00 -0.85 -0.67 103.07 108.83 3ekg h GLY 139 Ca 0.18 -0.77 -0.13 0.00 0.00 0.00 0.00 47.33 46.62 3ekg h GLY 139 CO 0.00 0.71 -0.36 0.50 0.00 0.00 0.00 176.54 177.39 3ekg h LYS 140 N 0.90 0.58 -0.47 4.80 1.57 -0.60 0.33 116.57 123.69 3ekg h LYS 140 Ca 0.16 -0.27 -0.12 0.00 -1.87 0.00 0.00 60.65 58.55 3ekg h LYS 140 Cb 0.54 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.83 3ekg h LYS 140 CO 0.03 0.85 -0.18 0.28 -0.57 0.00 0.00 179.45 179.86 3ekg h VAL 141 N 0.48 1.27 0.00 0.50 2.07 -0.74 -2.79 116.25 117.04 3ekg h VAL 141 Ca 0.05 -1.33 0.00 0.00 0.82 0.00 0.00 66.70 66.24 3ekg h VAL 141 Cb 0.85 1.14 0.00 0.00 -1.52 0.00 0.00 31.29 31.76 3ekg h VAL 141 CO 0.07 0.46 -0.04 0.54 0.02 0.00 0.00 177.57 178.62 3ekg n ARG 142 N -4.17 0.16 -3.55 1.57 5.12 -0.28 -4.93 116.66 110.58 3ekg n ARG 142 Ca -0.00 0.13 -0.22 0.00 -1.93 0.00 0.00 57.85 55.83 3ekg n ARG 142 Cb 0.43 -1.68 0.08 0.00 -1.16 0.00 0.00 32.46 30.13 3ekg n ARG 142 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 3ekg n ARG 143 N -1.97 -7.62 -3.96 5.56 1.74 0.10 -5.01 116.66 105.50 3ekg n ARG 143 Ca 0.06 0.84 -0.09 0.00 -0.77 0.00 0.00 57.85 57.88 3ekg n ARG 143 Cb 0.40 -5.88 -0.11 0.00 -1.02 0.00 0.00 32.46 25.85 3ekg n ARG 143 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 3ekg s GLU 144 N -6.05 0.38 0.52 5.56 2.02 -0.24 -4.75 118.70 116.13 3ekg s GLU 144 Ca 0.42 -0.61 -0.21 0.00 0.02 0.00 0.00 54.97 54.59 3ekg s GLU 144 Cb -0.19 0.14 -0.06 0.00 0.10 0.00 0.00 34.13 34.12 3ekg s GLU 144 CO 0.73 -0.07 1.17 -1.25 0.02 0.00 0.00 175.26 175.86 3ekg s PRO 145 N -1.66 3.44 0.38 0.39 0.04 -1.21 -1.31 135.00 135.07 3ekg s PRO 145 Ca -0.14 1.76 0.13 0.00 0.04 0.00 0.00 61.00 62.79 3ekg s PRO 145 Cb -0.08 -2.17 0.94 0.00 0.04 0.00 0.00 34.50 33.23 3ekg s PRO 145 CO -0.01 -0.81 1.86 0.28 0.04 0.00 0.00 177.00 178.35 3ekg h VAL 146 N 1.44 0.75 -0.08 -0.36 2.07 -1.47 -1.15 116.25 117.46 3ekg h VAL 146 Ca -0.50 -0.19 0.02 0.00 0.82 0.00 0.00 66.70 66.86 3ekg h VAL 146 Cb 1.26 0.15 -0.00 0.00 -1.52 0.00 0.00 31.29 31.18 3ekg h VAL 146 CO 0.58 0.10 0.07 1.12 0.02 0.00 0.00 177.57 179.46 3ekg h HIS 147 N 0.55 0.00 0.00 1.57 2.07 -1.87 0.68 115.15 118.15 3ekg h HIS 147 Ca 0.46 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.98 3ekg h HIS 147 Cb 0.94 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.92 3ekg h HIS 147 CO -0.00 0.00 0.00 1.96 -3.07 0.00 0.00 177.93 176.82 3ekg h GLN 148 N 0.00 0.00 0.00 5.12 4.20 -1.55 -1.07 115.11 121.81 3ekg h GLN 148 Ca 0.04 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.75 3ekg h GLN 148 Cb 0.18 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.96 3ekg h GLN 148 CO -0.00 0.00 -0.67 -0.07 -0.67 0.00 0.00 178.83 177.42 3ekg h LEU 149 N 0.00 0.00 -3.89 1.46 3.38 -0.94 -3.36 115.31 111.97 3ekg h LEU 149 Ca 0.00 -0.22 -0.59 0.00 0.09 0.00 0.00 57.88 57.16 3ekg h LEU 149 Cb 0.74 0.00 -0.31 0.00 0.09 0.00 0.00 40.66 41.18 3ekg h LEU 149 CO 0.00 0.11 0.39 0.18 0.09 0.00 0.00 178.44 179.21 3ekg n LEU 150 N -2.12 6.66 0.00 1.67 4.77 -0.88 -4.88 117.00 122.22 3ekg n LEU 150 Ca 0.03 -4.26 0.00 0.00 -0.03 0.00 0.00 56.01 51.75 3ekg n LEU 150 Cb 0.44 -0.79 0.00 0.00 -2.33 0.00 0.00 43.42 40.74 3ekg n LEU 150 CO 0.37 1.54 0.00 0.61 -1.33 0.00 0.00 177.39 178.58 3ekg n GLY 151 N -0.92 1.10 0.00 -0.72 0.00 -1.25 -4.85 105.19 98.54 3ekg n GLY 151 Ca 0.56 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.58 3ekg n GLY 151 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ekg n GLY 152 N -2.00 -1.48 3.76 -0.02 0.00 -0.43 -4.95 105.19 100.07 3ekg n GLY 152 Ca 0.00 -1.47 -0.36 0.00 0.00 0.00 0.00 46.02 44.19 3ekg n GLY 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ekg s ALA 153 N -3.31 2.69 -0.88 4.61 0.00 -1.26 -4.28 121.76 119.32 3ekg s ALA 153 Ca 0.00 0.96 0.08 0.00 0.00 0.00 0.00 51.96 53.00 3ekg s ALA 153 Cb 0.00 -3.42 0.14 0.00 0.00 0.00 0.00 23.12 19.84 3ekg s ALA 153 CO 0.00 -0.96 0.95 1.33 0.00 0.00 0.00 175.76 177.08 3ekg n VAL 154 N -1.27 0.44 -3.91 0.00 0.24 0.23 -4.90 118.33 109.16 3ekg n VAL 154 Ca 0.12 -0.72 -0.10 0.00 -2.04 0.00 0.00 64.34 61.60 3ekg n VAL 154 Cb 0.49 0.87 -0.10 0.00 -1.47 0.00 0.00 33.84 33.64 3ekg n VAL 154 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3ekg s ARG 155 N -0.83 0.52 0.26 7.34 1.70 -1.25 -5.04 118.95 121.66 3ekg s ARG 155 Ca 0.13 -0.60 0.25 0.00 -0.47 0.00 0.00 55.73 55.04 3ekg s ARG 155 Cb 0.08 0.21 0.72 0.00 -0.57 0.00 0.00 34.95 35.38 3ekg s ARG 155 CO 0.11 -0.13 1.74 -0.44 -1.08 0.00 0.00 175.30 175.51 3ekg h ASP 156 N 3.98 0.00 -5.01 -2.89 3.32 -1.94 -3.46 116.42 110.42 3ekg h ASP 156 Ca -0.32 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.70 3ekg h ASP 156 Cb 1.19 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 40.60 3ekg h ASP 156 CO 0.46 0.00 0.14 -1.83 -1.72 0.00 0.00 179.24 176.29 3ekg s GLU 157 N -3.13 1.19 0.00 3.56 -1.05 -1.26 -1.17 118.70 116.84 3ekg s GLU 157 Ca 0.10 -0.38 -0.05 0.00 -0.15 0.00 0.00 54.97 54.48 3ekg s GLU 157 Cb 0.11 0.54 -0.04 0.00 -0.44 0.00 0.00 34.13 34.30 3ekg s GLU 157 CO 0.61 -0.48 0.24 -0.51 0.95 0.00 0.00 175.26 176.06 3ekg s LEU 158 N -2.46 4.37 -0.06 1.83 1.43 -1.26 -4.93 118.68 117.60 3ekg s LEU 158 Ca -0.01 0.49 0.05 0.00 -1.03 0.00 0.00 54.13 53.63 3ekg s LEU 158 Cb -0.00 -2.65 -0.01 0.00 0.03 0.00 0.00 46.19 43.55 3ekg s LEU 158 CO -0.08 0.25 -0.23 0.00 0.23 0.00 0.00 176.35 176.52 3ekg s GLN 159 N -1.82 2.62 0.14 1.70 -2.07 -1.26 -4.36 119.66 114.60 3ekg s GLN 159 Ca 0.27 -0.87 0.09 0.00 -1.82 0.00 0.00 55.36 53.03 3ekg s GLN 159 Cb -0.13 -2.22 -0.04 0.00 -1.09 0.00 0.00 33.01 29.53 3ekg s GLN 159 CO 0.17 0.39 -0.16 -0.06 -1.32 0.00 0.00 175.29 174.30 3ekg s PHE 160 N -0.17 2.56 0.14 9.60 0.08 -0.69 -0.51 117.98 128.99 3ekg s PHE 160 Ca -0.03 -0.25 0.06 0.00 0.12 0.00 0.00 56.93 56.83 3ekg s PHE 160 Cb -0.14 -1.32 -0.04 0.00 -0.57 0.00 0.00 43.02 40.95 3ekg s PHE 160 CO 0.04 0.43 0.02 1.52 -0.10 0.00 0.00 175.22 177.12 3ekg s TYR 161 N -1.31 2.95 -0.09 0.36 -0.85 -0.53 -1.01 117.35 116.88 3ekg s TYR 161 Ca 0.20 -0.07 -0.01 0.00 -0.52 0.00 0.00 57.07 56.67 3ekg s TYR 161 Cb -0.10 -1.47 -0.03 0.00 0.38 0.00 0.00 41.96 40.74 3ekg s TYR 161 CO 0.12 0.50 -0.05 0.00 -1.52 0.00 0.00 175.55 174.60 3ekg s ALA 162 N -1.55 3.04 -0.23 9.51 0.00 0.34 -1.69 121.76 131.19 3ekg s ALA 162 Ca 0.27 -0.86 -0.08 0.00 0.00 0.00 0.00 51.96 51.30 3ekg s ALA 162 Cb -0.10 -1.34 -0.04 0.00 0.00 0.00 0.00 23.12 21.64 3ekg s ALA 162 CO 0.19 0.50 0.08 0.99 0.00 0.00 0.00 175.76 177.52 3ekg s THR 163 N -0.59 4.58 0.00 0.00 2.01 -0.34 -0.69 115.64 120.61 3ekg s THR 163 Ca 0.09 -0.09 0.00 0.00 0.31 0.00 0.00 61.69 62.00 3ekg s THR 163 Cb -0.12 -3.11 0.00 0.00 0.01 0.00 0.00 72.50 69.28 3ekg s THR 163 CO 0.02 0.38 0.00 0.61 -0.69 0.00 0.00 174.62 174.94 3ekg n GLY 164 N 4.40 -0.21 0.00 4.40 0.00 -0.46 -4.66 105.19 108.67 3ekg n GLY 164 Ca -0.16 -1.17 0.12 0.00 0.00 0.00 0.00 46.02 44.81 3ekg n GLY 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ekg n ALA 165 N -0.72 2.53 -3.27 4.61 0.00 -1.26 -4.27 120.51 118.13 3ekg n ALA 165 Ca 0.00 -0.15 -0.25 0.00 0.00 0.00 0.00 53.44 53.03 3ekg n ALA 165 Cb 0.00 -1.40 -0.07 0.00 0.00 0.00 0.00 19.45 17.98 3ekg n ALA 165 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3ekg n ARG 166 N -0.94 1.83 0.28 0.00 5.12 -1.26 -4.90 116.66 116.80 3ekg n ARG 166 Ca 0.18 -4.07 0.13 0.00 -1.93 0.00 0.00 57.85 52.16 3ekg n ARG 166 Cb 0.08 -1.84 0.83 0.00 -1.16 0.00 0.00 32.46 30.37 3ekg n ARG 166 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 3ekg h PRO 167 N 3.88 0.00 -0.51 5.56 0.13 -1.90 -1.53 132.00 137.62 3ekg h PRO 167 Ca 0.14 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.21 3ekg h PRO 167 Cb 0.75 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.86 3ekg h PRO 167 CO 0.67 0.01 0.09 0.38 -0.23 0.00 0.00 178.00 178.92 3ekg h ASP 168 N 0.00 0.81 0.40 1.44 -0.00 -1.97 -1.77 116.42 115.34 3ekg h ASP 168 Ca -0.00 -0.26 -0.13 0.00 -0.00 0.00 0.00 57.03 56.64 3ekg h ASP 168 Cb 0.03 -0.22 -0.01 0.00 -0.00 0.00 0.00 39.33 39.13 3ekg h ASP 168 CO 0.00 0.86 -0.56 -0.07 -0.00 0.00 0.00 179.24 179.48 3ekg h LEU 169 N 0.73 0.18 -1.04 0.15 3.38 -1.66 -2.80 115.31 114.25 3ekg h LEU 169 Ca 0.16 -0.10 -0.05 0.00 0.09 0.00 0.00 57.88 57.98 3ekg h LEU 169 Cb 0.40 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 3ekg h LEU 169 CO 0.01 0.70 0.16 0.00 0.09 0.00 0.00 178.44 179.40 3ekg h ALA 170 N 1.30 1.23 -0.69 1.53 0.00 -1.05 -2.44 119.26 119.15 3ekg h ALA 170 Ca -0.00 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 3ekg h ALA 170 Cb 1.02 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.55 3ekg h ALA 170 CO 0.08 0.54 0.37 0.37 0.00 0.00 0.00 179.25 180.61 3ekg h GLN 171 N 0.82 0.96 -2.21 0.00 4.15 -1.06 -2.64 115.11 115.14 3ekg h GLN 171 Ca 0.18 -0.11 -0.02 0.00 0.77 0.00 0.00 58.65 59.47 3ekg h GLN 171 Cb 0.26 -0.19 -0.01 0.00 0.21 0.00 0.00 27.48 27.76 3ekg h GLN 171 CO -0.01 0.72 0.06 1.63 -1.93 0.00 0.00 178.83 179.31 3ekg n LYS 172 N -4.50 0.45 0.00 1.69 5.02 -0.92 -4.30 118.16 115.60 3ekg n LYS 172 Ca 0.06 -0.11 0.00 0.00 -2.02 0.00 0.00 58.31 56.24 3ekg n LYS 172 Cb 0.09 -1.44 0.00 0.00 -0.02 0.00 0.00 35.03 33.67 3ekg n LYS 172 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3ekg n GLY 174 N 2.14 -0.47 3.76 0.72 0.00 -1.16 -5.11 105.19 105.08 3ekg n GLY 174 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 3ekg n GLY 174 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3ekg s PHE 175 N -0.08 2.55 -0.74 1.61 0.08 -1.00 -4.14 117.98 116.26 3ekg s PHE 175 Ca 0.00 1.56 0.26 0.00 0.12 0.00 0.00 56.93 58.86 3ekg s PHE 175 Cb 0.00 -3.23 0.69 0.00 -0.57 0.00 0.00 43.02 39.92 3ekg s PHE 175 CO 0.00 -1.80 1.64 0.44 -0.10 0.00 0.00 175.22 175.40 3ekg n ILE 176 N -2.31 0.45 -3.77 0.64 -5.35 -0.18 -4.66 119.36 104.19 3ekg n ILE 176 Ca 0.11 -0.25 -0.03 0.00 -0.27 0.00 0.00 62.75 62.31 3ekg n ILE 176 Cb 0.52 -0.41 -0.01 0.00 -1.74 0.00 0.00 39.64 38.00 3ekg n ILE 176 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 3ekg s GLY 177 N -3.53 -0.19 -0.09 3.28 0.00 -1.26 -3.33 107.32 102.20 3ekg s GLY 177 Ca 0.10 0.09 -0.02 0.00 0.00 0.00 0.00 44.72 44.88 3ekg s GLY 177 CO 0.63 0.37 0.03 -0.32 0.00 0.00 0.00 173.10 173.82 3ekg s GLY 178 N -3.02 0.43 0.51 0.20 0.00 0.39 -0.50 107.32 105.33 3ekg s GLY 178 Ca 0.14 -0.15 0.06 0.00 0.00 0.00 0.00 44.72 44.77 3ekg s GLY 178 CO 0.02 1.32 0.70 1.25 0.00 0.00 0.00 173.10 176.39 3ekg s LYS 179 N 2.02 2.54 -0.03 2.90 2.20 0.13 -4.25 119.74 125.26 3ekg s LYS 179 Ca 0.04 -1.24 0.07 0.00 -0.36 0.00 0.00 55.97 54.48 3ekg s LYS 179 Cb -0.13 -2.64 -0.02 0.00 -1.51 0.00 0.00 37.83 33.53 3ekg s LYS 179 CO -0.06 -0.60 -0.25 -1.25 -0.36 0.00 0.00 175.35 172.83 3ekg s PRO 181 N -4.58 2.20 0.09 4.03 0.04 -1.26 -1.35 135.00 134.17 3ekg s PRO 181 Ca 0.58 -0.90 -0.30 0.00 0.04 0.00 0.00 61.00 60.42 3ekg s PRO 181 Cb -0.09 -2.03 -0.05 0.00 0.04 0.00 0.00 34.50 32.37 3ekg s PRO 181 CO 0.36 0.48 1.01 -1.17 0.04 0.00 0.00 177.00 177.73 3ekg s LEU 182 N -0.44 4.45 -0.00 -3.56 2.96 0.06 -4.86 118.68 117.28 3ekg s LEU 182 Ca 0.05 1.83 0.19 0.00 -0.22 0.00 0.00 54.13 55.98 3ekg s LEU 182 Cb -0.11 -3.59 -0.22 0.00 0.50 0.00 0.00 46.19 42.77 3ekg s LEU 182 CO 0.01 -0.17 0.77 1.41 -1.32 0.00 0.00 176.35 177.04 3ekg n HIS 183 N 3.10 0.00 -4.41 5.38 8.25 -1.26 -0.78 115.22 125.49 3ekg n HIS 183 Ca 0.04 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.29 3ekg n HIS 183 Cb 0.49 -0.06 -0.16 0.00 1.12 0.00 0.00 29.99 31.38 3ekg n HIS 183 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 3ekg s HIS 184 N -2.90 1.05 0.44 4.41 3.76 -1.26 -4.16 115.29 116.63 3ekg s HIS 184 Ca 0.05 -0.30 0.05 0.00 -0.15 0.00 0.00 55.06 54.71 3ekg s HIS 184 Cb 0.14 -0.77 0.05 0.00 1.11 0.00 0.00 32.58 33.11 3ekg s HIS 184 CO 0.80 -0.15 0.40 0.41 -0.85 0.00 0.00 174.74 175.35 3ekg n GLY 185 N 3.51 2.60 0.36 -2.22 0.00 -1.26 -4.88 105.19 103.30 3ekg n GLY 185 Ca -0.20 -2.26 0.17 0.00 0.00 0.00 0.00 46.02 43.73 3ekg n GLY 185 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3ekg h PRO 186 N 0.00 0.58 0.00 1.61 0.11 -1.93 -1.04 132.00 131.33 3ekg h PRO 186 Ca -0.26 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.81 3ekg h PRO 186 Cb 1.00 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.98 3ekg h PRO 186 CO 0.40 0.38 0.00 0.66 -0.21 0.00 0.00 178.00 179.23 3ekg h SER 187 N 0.59 0.00 -0.18 -2.05 4.64 -1.94 -1.00 113.55 113.62 3ekg h SER 187 Ca 0.61 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.93 3ekg h SER 187 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 3ekg h SER 187 CO -0.41 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 174.93 3ekg n GLU 188 N -2.57 1.72 0.00 4.77 1.02 -0.39 -5.03 120.64 120.16 3ekg n GLU 188 Ca -0.00 -1.08 0.00 0.00 -0.02 0.00 0.00 57.16 56.05 3ekg n GLU 188 Cb 0.15 -1.38 0.00 0.00 -0.02 0.00 0.00 31.44 30.19 3ekg n GLU 188 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3ekg n GLY 189 N 1.11 0.94 0.27 0.62 0.00 -0.38 -2.03 105.19 105.73 3ekg n GLY 189 Ca 0.16 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.53 3ekg n GLY 189 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3ekg h GLU 190 N 0.00 0.50 -0.65 1.61 4.39 -1.95 -1.84 114.58 116.64 3ekg h GLU 190 Ca 0.00 -0.10 -0.05 0.00 0.34 0.00 0.00 59.36 59.55 3ekg h GLU 190 Cb 0.00 -0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 28.55 3ekg h GLU 190 CO 0.00 0.52 0.20 1.49 -1.16 0.00 0.00 179.01 180.06 3ekg h GLU 191 N 0.48 1.01 -0.45 2.33 4.57 -2.00 -0.66 114.58 119.86 3ekg h GLU 191 Ca 0.11 -0.22 -0.12 0.00 -1.18 0.00 0.00 59.36 57.95 3ekg h GLU 191 Cb 0.29 -0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 28.72 3ekg h GLU 191 CO 0.01 0.88 -0.18 0.78 -1.18 0.00 0.00 179.01 179.31 3ekg h GLY 192 N 0.94 0.95 0.97 1.92 0.00 -0.99 -1.45 103.07 105.41 3ekg h GLY 192 Ca 0.21 -0.80 -0.03 0.00 0.00 0.00 0.00 47.33 46.72 3ekg h GLY 192 CO -0.01 0.73 0.20 -2.00 0.00 0.00 0.00 176.54 175.46 3ekg h LEU 193 N 0.77 0.68 -0.88 3.11 5.85 -0.99 -0.26 115.31 123.59 3ekg h LEU 193 Ca 0.11 -0.17 -0.04 0.00 0.84 0.00 0.00 57.88 58.63 3ekg h LEU 193 Cb 0.72 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.53 3ekg h LEU 193 CO 0.06 0.66 0.36 0.11 -0.34 0.00 0.00 178.44 179.28 3ekg h LYS 194 N 0.66 1.17 -0.70 1.25 1.57 -0.95 -1.69 116.57 117.88 3ekg h LYS 194 Ca 0.17 -0.19 -0.06 0.00 -1.87 0.00 0.00 60.65 58.70 3ekg h LYS 194 Cb 0.19 -0.20 -0.03 0.00 0.08 0.00 0.00 32.23 32.27 3ekg h LYS 194 CO -0.01 0.92 0.21 0.87 -0.57 0.00 0.00 179.45 180.86 3ekg h LYS 195 N 1.15 1.10 -0.26 3.15 1.57 -0.76 0.04 116.57 122.56 3ekg h LYS 195 Ca 0.27 -0.24 -0.00 0.00 -1.87 0.00 0.00 60.65 58.81 3ekg h LYS 195 Cb 0.16 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 3ekg h LYS 195 CO -0.03 0.95 0.16 -0.91 -0.57 0.00 0.00 179.45 179.05 3ekg h ASN 196 N 1.04 0.31 0.47 0.86 2.35 -0.60 -1.58 115.58 118.42 3ekg h ASN 196 Ca 0.22 -0.05 -0.08 0.00 -0.55 0.00 0.00 56.30 55.84 3ekg h ASN 196 Cb 0.32 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.60 3ekg h ASN 196 CO -0.00 0.26 -0.40 -0.07 -1.65 0.00 0.00 177.43 175.57 3ekg h LEU 197 N 0.32 0.00 -0.47 1.61 3.38 -1.12 -2.47 115.31 116.57 3ekg h LEU 197 Ca 0.09 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.93 3ekg h LEU 197 Cb 0.01 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 3ekg h LEU 197 CO -0.02 0.40 -0.21 -0.33 0.09 0.00 0.00 178.44 178.37 3ekg h GLU 198 N 0.00 0.96 -0.70 1.13 5.08 -0.57 0.11 114.58 120.58 3ekg h GLU 198 Ca -0.00 -0.42 -0.06 0.00 -1.00 0.00 0.00 59.36 57.88 3ekg h GLU 198 Cb 0.74 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.93 3ekg h GLU 198 CO 0.05 1.08 0.20 0.93 -1.00 0.00 0.00 179.01 180.28 3ekg h GLU 199 N 0.81 1.11 -0.33 2.33 5.08 -1.03 -0.49 114.58 122.05 3ekg h GLU 199 Ca 0.11 -0.25 -0.05 0.00 -1.00 0.00 0.00 59.36 58.17 3ekg h GLU 199 Cb 0.79 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.87 3ekg h GLU 199 CO 0.07 0.96 0.02 1.25 -1.00 0.00 0.00 179.01 180.31 3ekg h LEU 200 N 1.05 0.55 -0.46 1.33 5.85 -1.28 -3.04 115.31 119.31 3ekg h LEU 200 Ca 0.22 -0.29 0.03 0.00 0.84 0.00 0.00 57.88 58.69 3ekg h LEU 200 Cb 0.33 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.18 3ekg h LEU 200 CO -0.00 0.70 0.25 0.00 -0.34 0.00 0.00 178.44 179.05 3ekg h ALA 201 N 0.87 0.59 0.00 1.25 0.00 -0.69 0.26 119.26 121.54 3ekg h ALA 201 Ca 0.10 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3ekg h ALA 201 Cb 0.40 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3ekg h ALA 201 CO 0.01 -0.09 0.00 2.41 0.00 0.00 0.00 179.25 181.59 3ekg n THR 202 N -4.87 0.00 0.00 0.00 -1.04 -0.22 -1.32 114.28 106.83 3ekg n THR 202 Ca 0.03 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.04 3ekg n THR 202 Cb 0.10 -0.01 0.00 0.00 -1.82 0.00 0.00 70.33 68.60 3ekg n THR 202 CO 0.00 0.00 0.00 -1.14 -0.64 0.00 0.00 175.07 173.29 3ekg n ARG 204 N 0.46 0.00 -0.18 -2.82 3.00 0.08 -2.15 116.66 115.05 3ekg n ARG 204 Ca 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 57.85 57.79 3ekg n ARG 204 Cb 0.00 0.00 0.11 0.00 0.00 0.00 0.00 32.46 32.57 3ekg n ARG 204 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.63 179.12 3ekg h GLU 205 N 0.00 0.97 -0.06 -0.14 4.81 -1.45 -1.83 114.58 116.88 3ekg h GLU 205 Ca 0.00 -0.24 -0.19 0.00 -0.13 0.00 0.00 59.36 58.80 3ekg h GLU 205 Cb 0.00 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.25 3ekg h GLU 205 CO 0.00 0.90 -0.78 0.00 -0.73 0.00 0.00 179.01 178.39 3ekg h ARG 206 N 0.91 0.41 0.00 1.92 3.08 -1.70 -3.33 114.38 115.66 3ekg h ARG 206 Ca 0.18 -0.36 0.00 0.00 0.07 0.00 0.00 59.98 59.88 3ekg h ARG 206 Cb 0.40 0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.53 3ekg h ARG 206 CO 0.01 1.00 -0.83 1.33 -1.07 0.00 0.00 179.97 180.42 3ekg n VAL 207 N -3.81 0.05 0.00 2.04 0.24 -1.18 -5.05 118.33 110.61 3ekg n VAL 207 Ca -0.05 -0.08 0.00 0.00 -2.04 0.00 0.00 64.34 62.18 3ekg n VAL 207 Cb 0.74 0.48 0.00 0.00 -1.47 0.00 0.00 33.84 33.58 3ekg n VAL 207 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3ekg n GLY 208 N 1.46 0.00 0.09 7.63 0.00 -0.69 -4.44 105.19 109.24 3ekg n GLY 208 Ca 0.04 -1.86 0.12 0.00 0.00 0.00 0.00 46.02 44.32 3ekg n GLY 208 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3ekg n PRO 209 N 0.05 0.19 -0.09 1.61 -0.04 -1.26 -4.23 135.00 131.21 3ekg n PRO 209 Ca 0.00 0.24 -0.17 0.00 -0.04 0.00 0.00 63.50 63.53 3ekg n PRO 209 Cb 0.00 -1.76 -0.13 0.00 -0.04 0.00 0.00 33.50 31.57 3ekg n PRO 209 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3ekg n ASP 210 N -2.09 1.68 -4.61 3.54 8.00 -1.26 -4.97 116.55 116.84 3ekg n ASP 210 Ca 0.05 -0.03 -0.48 0.00 0.71 0.00 0.00 54.79 55.04 3ekg n ASP 210 Cb 0.35 -0.28 -0.04 0.00 -0.02 0.00 0.00 41.12 41.13 3ekg n ASP 210 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 3ekg n PHE 211 N -3.22 1.63 -2.32 1.24 7.35 -1.26 -4.89 117.46 115.99 3ekg n PHE 211 Ca -0.40 0.58 -0.41 0.00 -0.76 0.00 0.00 57.45 56.45 3ekg n PHE 211 Cb 1.03 -2.36 -0.03 0.00 0.35 0.00 0.00 39.48 38.47 3ekg n PHE 211 CO 0.00 0.00 0.00 -1.58 -0.76 0.00 0.00 176.76 174.42 3ekg s TRP 212 N 0.04 3.36 0.27 -5.13 0.51 -1.21 -4.96 118.94 111.82 3ekg s TRP 212 Ca 0.74 1.31 0.04 0.00 -2.12 0.00 0.00 56.10 56.08 3ekg s TRP 212 Cb -0.80 -3.50 -0.06 0.00 -0.81 0.00 0.00 33.47 28.30 3ekg s TRP 212 CO 0.49 -1.51 0.00 -0.51 -0.51 0.00 0.00 176.95 174.92 3ekg s LEU 213 N 0.06 2.25 -0.13 2.99 1.43 -1.26 -0.46 118.68 123.56 3ekg s LEU 213 Ca 0.56 -1.26 -0.07 0.00 -1.03 0.00 0.00 54.13 52.33 3ekg s LEU 213 Cb -0.34 -0.39 0.05 0.00 0.03 0.00 0.00 46.19 45.54 3ekg s LEU 213 CO 0.36 -0.50 0.31 -0.36 0.23 0.00 0.00 176.35 176.39 3ekg s PHE 215 N -3.29 -0.42 -0.21 0.29 2.99 -0.99 -0.89 117.98 115.46 3ekg s PHE 215 Ca 0.31 0.96 -0.06 0.00 0.00 0.00 0.00 56.93 58.14 3ekg s PHE 215 Cb 0.06 0.13 -0.03 0.00 0.00 0.00 0.00 43.02 43.18 3ekg s PHE 215 CO 0.11 -0.26 0.03 0.34 -0.00 0.00 0.00 175.22 175.45 3ekg s ASP 216 N 1.18 5.12 0.00 1.36 -1.08 -1.26 -0.29 116.67 121.70 3ekg s ASP 216 Ca -0.08 -0.13 0.15 0.00 -0.52 0.00 0.00 52.55 51.97 3ekg s ASP 216 Cb -0.09 -1.89 0.16 0.00 -1.46 0.00 0.00 42.92 39.65 3ekg s ASP 216 CO -0.09 0.07 1.03 0.00 0.52 0.00 0.00 175.17 176.71 3ekg n TRP 218 N 0.86 0.00 0.00 0.00 -0.00 -1.23 -4.53 117.44 112.55 3ekg n TRP 218 Ca 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.60 3ekg n TRP 218 Cb 0.40 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.71 3ekg n TRP 218 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 177.69 176.56 3ekg n SER 220 N 0.00 0.00 -4.95 5.87 3.41 -1.25 -4.34 113.62 112.36 3ekg n SER 220 Ca 0.00 0.00 -0.24 0.00 -0.26 0.00 0.00 58.87 58.37 3ekg n SER 220 Cb 0.00 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 63.97 3ekg n SER 220 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3ekg s LEU 221 N 0.00 2.82 0.34 1.04 1.43 0.16 -4.48 118.68 119.99 3ekg s LEU 221 Ca 0.00 -1.12 0.09 0.00 -1.03 0.00 0.00 54.13 52.07 3ekg s LEU 221 Cb 0.00 -1.31 -0.06 0.00 0.03 0.00 0.00 46.19 44.84 3ekg s LEU 221 CO 0.00 -1.21 -0.08 1.51 0.23 0.00 0.00 176.35 176.80 3ekg s ASP 222 N -4.43 3.82 0.15 2.29 1.47 -1.26 -4.57 116.67 114.14 3ekg s ASP 222 Ca 0.44 -1.15 -0.18 0.00 1.18 0.00 0.00 52.55 52.84 3ekg s ASP 222 Cb -0.03 -0.39 0.06 0.00 -0.34 0.00 0.00 42.92 42.22 3ekg s ASP 222 CO 0.27 -0.20 1.68 0.25 0.68 0.00 0.00 175.17 177.85 3ekg h LEU 223 N 1.99 -0.30 -0.35 2.11 5.85 -1.94 -0.86 115.31 121.81 3ekg h LEU 223 Ca -0.42 0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.38 3ekg h LEU 223 Cb 1.25 0.20 -0.02 0.00 0.37 0.00 0.00 40.66 42.47 3ekg h LEU 223 CO 0.69 -0.10 0.13 -1.13 -0.34 0.00 0.00 178.44 177.69 3ekg h ASN 224 N 0.01 0.49 -0.57 1.25 -0.73 -1.99 -0.28 115.58 113.76 3ekg h ASN 224 Ca 0.16 -0.18 -0.01 0.00 1.87 0.00 0.00 56.30 58.14 3ekg h ASN 224 Cb 0.25 -0.13 -0.03 0.00 0.27 0.00 0.00 38.32 38.68 3ekg h ASN 224 CO -0.34 0.54 0.30 0.22 -0.37 0.00 0.00 177.43 177.78 3ekg h TYR 225 N 0.42 0.79 -0.80 0.67 3.20 -1.92 -0.51 116.97 118.82 3ekg h TYR 225 Ca 0.11 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.93 3ekg h TYR 225 Cb 0.21 -0.25 -0.04 0.00 1.54 0.00 0.00 36.73 38.19 3ekg h TYR 225 CO 0.00 0.59 0.36 0.00 -1.64 0.00 0.00 178.16 177.47 3ekg h ALA 226 N 1.13 1.13 -0.42 1.82 0.00 -1.02 0.16 119.26 122.07 3ekg h ALA 226 Ca 0.20 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 3ekg h ALA 226 Cb 0.06 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 3ekg h ALA 226 CO -0.03 0.64 0.23 1.15 0.00 0.00 0.00 179.25 181.24 3ekg h THR 227 N 1.15 1.16 -0.16 0.00 2.02 -0.46 -1.00 112.91 115.63 3ekg h THR 227 Ca 0.27 -0.40 -0.15 0.00 0.77 0.00 0.00 66.41 66.90 3ekg h THR 227 Cb 0.15 0.66 -0.01 0.00 -1.74 0.00 0.00 68.15 67.21 3ekg h THR 227 CO -0.03 0.16 -0.54 0.03 0.37 0.00 0.00 175.52 175.52 3ekg h ARG 228 N 0.55 0.45 -0.26 6.66 3.08 -0.72 -2.02 114.38 122.12 3ekg h ARG 228 Ca 0.15 -0.28 -0.03 0.00 0.07 0.00 0.00 59.98 59.89 3ekg h ARG 228 Cb 0.06 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 3ekg h ARG 228 CO -0.02 0.87 0.04 1.25 -1.07 0.00 0.00 179.97 181.04 3ekg h LEU 229 N 0.35 0.42 -0.58 3.04 5.85 -0.49 -0.80 115.31 123.09 3ekg h LEU 229 Ca 0.01 -0.26 -0.01 0.00 0.84 0.00 0.00 57.88 58.46 3ekg h LEU 229 Cb 1.05 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.95 3ekg h LEU 229 CO 0.10 0.57 0.33 0.00 -0.34 0.00 0.00 178.44 179.10 3ekg h ALA 230 N 0.86 0.74 -0.55 1.25 0.00 -1.14 -0.59 119.26 119.83 3ekg h ALA 230 Ca 0.08 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 3ekg h ALA 230 Cb 0.34 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 3ekg h ALA 230 CO 0.01 0.25 0.18 -0.09 0.00 0.00 0.00 179.25 179.59 3ekg h ARG 231 N 0.78 0.85 0.00 0.00 2.43 -1.24 -2.42 114.38 114.78 3ekg h ARG 231 Ca 0.21 -0.18 -0.05 0.00 -0.81 0.00 0.00 59.98 59.15 3ekg h ARG 231 Cb 0.02 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.44 3ekg h ARG 231 CO -0.03 0.76 -0.25 0.78 -1.51 0.00 0.00 179.97 179.72 3ekg h GLY 232 N 0.76 0.00 1.75 2.80 0.00 -0.85 -2.71 103.07 104.82 3ekg h GLY 232 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.51 3ekg h GLY 232 CO -0.01 0.00 -0.15 0.00 0.00 0.00 0.00 176.54 176.38 3ekg n ALA 233 N -2.38 2.58 -0.19 3.60 0.00 -0.25 -3.80 120.51 120.06 3ekg n ALA 233 Ca -0.02 -0.14 0.01 0.00 0.00 0.00 0.00 53.44 53.29 3ekg n ALA 233 Cb 0.34 -1.38 0.26 0.00 0.00 0.00 0.00 19.45 18.66 3ekg n ALA 233 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 3ekg h ARG 234 N 0.00 0.94 -0.03 0.00 2.43 -1.11 -1.08 114.38 115.53 3ekg h ARG 234 Ca 0.00 -0.07 0.01 0.00 -0.81 0.00 0.00 59.98 59.11 3ekg h ARG 234 Cb 0.59 -0.21 -0.00 0.00 -0.42 0.00 0.00 29.97 29.94 3ekg h ARG 234 CO 0.00 0.64 0.06 1.49 -1.51 0.00 0.00 179.97 180.65 3ekg h GLU 235 N 0.96 0.00 -0.43 0.20 4.81 -1.75 -0.30 114.58 118.07 3ekg h GLU 235 Ca 0.26 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.49 3ekg h GLU 235 Cb -0.08 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.30 3ekg h GLU 235 CO -0.05 0.00 0.00 0.66 -0.73 0.00 0.00 179.01 178.89 3ekg n TYR 236 N -3.41 0.86 -3.28 0.92 4.01 -0.43 -4.99 117.16 110.85 3ekg n TYR 236 Ca -0.02 -0.61 -0.24 0.00 -0.16 0.00 0.00 57.90 56.87 3ekg n TYR 236 Cb 0.14 -0.14 0.04 0.00 -0.31 0.00 0.00 39.34 39.06 3ekg n TYR 236 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3ekg n GLY 237 N 0.51 -0.52 3.68 2.72 0.00 -0.12 -4.90 105.19 106.56 3ekg n GLY 237 Ca 0.18 0.15 -0.45 0.00 0.00 0.00 0.00 46.02 45.90 3ekg n GLY 237 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3ekg n LEU 238 N -4.23 3.21 -0.03 0.99 7.94 -1.13 -4.72 117.00 119.03 3ekg n LEU 238 Ca -0.06 1.09 -0.15 0.00 -1.11 0.00 0.00 56.01 55.78 3ekg n LEU 238 Cb 0.59 -1.45 -0.09 0.00 0.53 0.00 0.00 43.42 43.00 3ekg n LEU 238 CO 0.54 -0.25 0.41 0.50 -1.11 0.00 0.00 177.39 177.47 3ekg h LYS 239 N 5.79 0.40 -2.97 1.96 3.64 -1.36 -3.48 116.57 120.54 3ekg h LYS 239 Ca -0.45 -0.33 -0.04 0.00 -1.27 0.00 0.00 60.65 58.56 3ekg h LYS 239 Cb 1.25 0.07 -0.14 0.00 -0.41 0.00 0.00 32.23 33.00 3ekg h LYS 239 CO 0.88 0.97 0.08 1.67 -2.27 0.00 0.00 179.45 180.77 3ekg s TRP 240 N -3.63 -0.42 -0.18 1.91 -2.14 -1.26 -4.85 118.94 108.37 3ekg s TRP 240 Ca -0.14 0.30 -0.00 0.00 2.66 0.00 0.00 56.10 58.92 3ekg s TRP 240 Cb 0.04 0.40 0.00 0.00 -3.10 0.00 0.00 33.47 30.82 3ekg s TRP 240 CO 0.79 -0.73 -0.14 -1.50 -2.66 0.00 0.00 176.95 172.71 3ekg s ILE 241 N -3.19 2.60 -0.11 0.66 2.07 -1.26 -2.34 121.20 119.64 3ekg s ILE 241 Ca -0.01 -0.77 -0.05 0.00 -1.41 0.00 0.00 60.65 58.41 3ekg s ILE 241 Cb -0.00 -2.12 -0.04 0.00 0.13 0.00 0.00 42.46 40.43 3ekg s ILE 241 CO -0.08 0.50 0.07 -0.70 -1.91 0.00 0.00 174.94 172.82 3ekg s GLU 242 N 1.16 3.28 -1.41 3.50 2.12 0.60 -1.87 118.70 126.08 3ekg s GLU 242 Ca 0.01 -0.28 -0.11 0.00 0.36 0.00 0.00 54.97 54.95 3ekg s GLU 242 Cb -0.14 -3.00 0.01 0.00 0.26 0.00 0.00 34.13 31.26 3ekg s GLU 242 CO -0.06 0.69 0.30 -1.91 -0.54 0.00 0.00 175.26 173.75 3ekg n GLU 243 N 2.21 -1.13 -0.08 4.30 2.13 0.02 -0.74 120.64 127.37 3ekg n GLU 243 Ca -0.19 0.15 -0.00 0.00 0.66 0.00 0.00 57.16 57.78 3ekg n GLU 243 Cb 0.54 -3.46 0.28 0.00 0.27 0.00 0.00 31.44 29.07 3ekg n GLU 243 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3ekg h ALA 244 N 1.05 1.39 -2.03 4.31 0.00 -1.83 -3.25 119.26 118.90 3ekg h ALA 244 Ca -0.67 -0.15 -0.58 0.00 0.00 0.00 0.00 54.91 53.51 3ekg h ALA 244 Cb 1.40 -0.20 -0.14 0.00 0.00 0.00 0.00 17.79 18.85 3ekg h ALA 244 CO 0.63 0.45 -0.69 -0.51 0.00 0.00 0.00 179.25 179.13 3ekg s LEU 245 N -9.35 2.64 0.55 0.00 1.43 -1.26 -0.66 118.68 112.02 3ekg s LEU 245 Ca -0.09 -1.16 -0.22 0.00 -1.03 0.00 0.00 54.13 51.63 3ekg s LEU 245 Cb 0.16 -0.91 -0.05 0.00 0.03 0.00 0.00 46.19 45.43 3ekg s LEU 245 CO 0.77 -0.20 1.36 -2.84 0.23 0.00 0.00 176.35 175.67 3ekg s PRO 246 N -3.63 3.13 0.52 1.29 0.02 -1.26 -4.80 135.00 130.27 3ekg s PRO 246 Ca 0.31 2.24 0.27 0.00 0.02 0.00 0.00 61.00 63.85 3ekg s PRO 246 Cb 0.01 -2.25 1.40 0.00 0.02 0.00 0.00 34.50 33.68 3ekg s PRO 246 CO 0.15 -1.20 1.93 -1.35 -0.33 0.00 0.00 177.00 176.20 3ekg h PRO 247 N 1.45 0.05 0.00 5.54 0.11 -1.97 -1.82 132.00 135.35 3ekg h PRO 247 Ca -0.51 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3ekg h PRO 247 Cb 1.30 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.40 3ekg h PRO 247 CO 0.57 0.03 0.00 -0.25 -0.21 0.00 0.00 178.00 178.14 3ekg n ASP 248 N -4.34 0.23 -3.76 -2.05 8.00 -1.26 -4.33 116.55 109.03 3ekg n ASP 248 Ca 0.15 0.53 -0.42 0.00 0.71 0.00 0.00 54.79 55.76 3ekg n ASP 248 Cb 0.78 -0.59 0.00 0.00 -0.02 0.00 0.00 41.12 41.30 3ekg n ASP 248 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 3ekg n ASP 249 N -1.72 5.96 -0.24 -2.24 2.03 -0.69 -4.75 116.55 114.90 3ekg n ASP 249 Ca 0.06 -3.14 -0.04 0.00 0.52 0.00 0.00 54.79 52.19 3ekg n ASP 249 Cb 0.32 -1.44 0.07 0.00 -0.72 0.00 0.00 41.12 39.36 3ekg n ASP 249 CO 0.00 0.00 0.00 1.88 -1.92 0.00 0.00 177.20 177.16 3ekg h TYR 250 N 5.41 0.81 -0.70 -0.67 0.05 -1.85 -2.23 116.97 117.79 3ekg h TYR 250 Ca 0.47 0.02 0.01 0.00 0.05 0.00 0.00 58.73 59.28 3ekg h TYR 250 Cb 0.54 -0.27 -0.03 0.00 1.01 0.00 0.00 36.73 37.97 3ekg h TYR 250 CO 1.34 0.47 0.46 -1.49 -1.05 0.00 0.00 178.16 177.89 3ekg h TRP 251 N 0.85 0.89 -0.67 4.88 6.55 -1.97 -2.18 115.95 124.30 3ekg h TRP 251 Ca 0.27 0.02 -0.05 0.00 0.95 0.00 0.00 58.89 60.08 3ekg h TRP 251 Cb -0.00 -0.30 -0.03 0.00 -0.86 0.00 0.00 29.16 27.97 3ekg h TRP 251 CO -0.04 0.57 0.22 0.78 -1.05 0.00 0.00 178.44 178.91 3ekg h GLY 252 N 0.95 1.12 0.99 1.49 0.00 -1.84 -2.24 103.07 103.55 3ekg h GLY 252 Ca 0.26 -0.65 -0.00 0.00 0.00 0.00 0.00 47.33 46.93 3ekg h GLY 252 CO -0.05 0.61 0.34 -0.97 0.00 0.00 0.00 176.54 176.46 3ekg h TYR 253 N 0.98 0.75 -0.84 5.60 -1.99 -1.06 0.72 116.97 121.12 3ekg h TYR 253 Ca 0.22 -0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.94 3ekg h TYR 253 Cb 0.29 -0.24 -0.04 0.00 2.00 0.00 0.00 36.73 38.73 3ekg h TYR 253 CO 0.02 0.52 0.52 0.00 -0.00 0.00 0.00 178.16 179.22 3ekg h ALA 254 N 1.16 1.07 -0.42 3.88 0.00 -1.19 0.14 119.26 123.90 3ekg h ALA 254 Ca 0.20 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 3ekg h ALA 254 Cb -0.01 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 3ekg h ALA 254 CO -0.04 0.52 -0.03 0.93 0.00 0.00 0.00 179.25 180.64 3ekg h GLU 255 N 1.15 0.76 -0.48 0.00 5.08 -0.99 -2.34 114.58 117.75 3ekg h GLU 255 Ca 0.30 -0.26 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 3ekg h GLU 255 Cb -0.07 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.10 3ekg h GLU 255 CO -0.06 0.85 0.27 1.25 -1.00 0.00 0.00 179.01 180.32 3ekg h LEU 256 N 0.59 0.59 -1.40 1.33 5.85 -0.41 -1.11 115.31 120.75 3ekg h LEU 256 Ca 0.12 -0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 3ekg h LEU 256 Cb 0.52 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.38 3ekg h LEU 256 CO 0.03 0.50 0.21 -0.09 -0.34 0.00 0.00 178.44 178.75 3ekg h ARG 257 N 0.64 0.62 -0.10 1.25 2.43 -0.89 0.14 114.38 118.47 3ekg h ARG 257 Ca 0.17 -0.07 -0.15 0.00 -0.81 0.00 0.00 59.98 59.12 3ekg h ARG 257 Cb 0.03 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.45 3ekg h ARG 257 CO -0.03 0.48 -0.61 0.00 -1.51 0.00 0.00 179.97 178.31 3ekg h ARG 258 N 0.62 0.34 -0.02 0.20 3.08 -0.85 -3.16 114.38 114.60 3ekg h ARG 258 Ca 0.16 -0.23 0.00 0.00 0.07 0.00 0.00 59.98 59.97 3ekg h ARG 258 Cb 0.07 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.15 3ekg h ARG 258 CO -0.02 0.84 -0.01 0.09 -1.07 0.00 0.00 179.97 179.80 3ekg n ASN 259 N -3.89 1.94 -4.78 7.04 5.03 -0.47 -4.95 115.26 115.17 3ekg n ASN 259 Ca -0.03 -1.64 -0.34 0.00 0.87 0.00 0.00 54.58 53.45 3ekg n ASN 259 Cb 0.63 0.01 -0.00 0.00 -1.02 0.00 0.00 39.78 39.39 3ekg n ASN 259 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3ekg s ALA 260 N -2.01 2.72 0.28 5.41 0.00 -0.02 -4.95 121.76 123.18 3ekg s ALA 260 Ca 0.35 0.66 -0.30 0.00 0.00 0.00 0.00 51.96 52.67 3ekg s ALA 260 Cb 0.21 -3.31 -0.13 0.00 0.00 0.00 0.00 23.12 19.89 3ekg s ALA 260 CO 0.33 -0.72 1.44 -2.30 0.00 0.00 0.00 175.76 174.51 3ekg n PRO 261 N -1.47 2.27 -1.68 0.00 -0.02 -1.26 -4.83 135.00 128.01 3ekg n PRO 261 Ca 0.10 0.80 -0.50 0.00 -2.02 0.00 0.00 63.50 61.89 3ekg n PRO 261 Cb 0.52 -2.49 -0.05 0.00 -0.02 0.00 0.00 33.50 31.46 3ekg n PRO 261 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 3ekg n THR 262 N 1.60 0.37 0.00 3.45 -1.04 -1.26 -5.10 114.28 112.30 3ekg n THR 262 Ca 0.09 -0.07 0.00 0.00 -2.04 0.00 0.00 64.05 62.03 3ekg n THR 262 Cb 0.34 -1.62 0.00 0.00 -1.82 0.00 0.00 70.33 67.23 3ekg n THR 262 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3ekg n GLY 263 N 4.02 0.57 3.55 3.41 0.00 -1.26 -5.21 105.19 110.27 3ekg n GLY 263 Ca 0.22 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.23 3ekg n GLY 263 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ekg s VAL 266 N -1.11 -0.32 0.20 1.61 1.01 -1.26 -5.01 120.40 115.52 3ekg s VAL 266 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 61.98 62.06 3ekg s VAL 266 Cb 0.00 -1.00 -0.05 0.00 0.00 0.00 0.00 36.38 35.33 3ekg s VAL 266 CO 0.00 0.00 -0.16 0.42 0.00 0.00 0.00 175.10 175.36 3ekg s THR 267 N 2.00 1.79 0.04 3.92 -4.23 -0.78 -0.06 115.64 118.31 3ekg s THR 267 Ca -0.06 -2.14 -0.27 0.00 -1.18 0.00 0.00 61.69 58.03 3ekg s THR 267 Cb -0.06 -2.00 0.10 0.00 1.34 0.00 0.00 72.50 71.88 3ekg s THR 267 CO -0.17 -0.51 1.21 0.28 -0.54 0.00 0.00 174.62 174.89 3ekg s THR 268 N -2.70 0.00 0.00 3.99 -1.32 -1.11 -0.80 115.64 113.70 3ekg s THR 268 Ca 0.21 -0.30 0.00 0.00 -1.21 0.00 0.00 61.69 60.39 3ekg s THR 268 Cb -0.02 -2.66 0.00 0.00 -1.51 0.00 0.00 72.50 68.31 3ekg s THR 268 CO 0.07 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.09 3ekg n GLY 269 N -0.73 1.51 0.29 6.08 0.00 -1.26 -0.72 105.19 110.36 3ekg n GLY 269 Ca -0.01 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.18 3ekg n GLY 269 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 3ekg h GLU 270 N 0.00 0.00 -0.49 1.61 4.11 -1.69 -1.73 114.58 116.39 3ekg h GLU 270 Ca 0.00 0.00 -0.23 0.00 0.07 0.00 0.00 59.36 59.20 3ekg h GLU 270 Cb 0.00 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 29.11 3ekg h GLU 270 CO 0.00 0.05 0.09 0.72 0.07 0.00 0.00 179.01 179.93 3ekg n HIS 271 N -3.38 1.53 -4.31 2.06 8.25 -1.26 -4.41 115.22 113.70 3ekg n HIS 271 Ca -0.02 -1.57 -0.28 0.00 -0.26 0.00 0.00 57.72 55.59 3ekg n HIS 271 Cb 0.18 -0.58 -0.10 0.00 1.12 0.00 0.00 29.99 30.61 3ekg n HIS 271 CO 0.00 0.00 0.00 -2.00 0.64 0.00 0.00 176.34 174.98 3ekg s GLU 272 N -3.21 1.89 0.02 -0.41 2.56 -0.65 -4.89 118.70 114.00 3ekg s GLU 272 Ca 0.47 -1.24 -0.01 0.00 0.00 0.00 0.00 54.97 54.19 3ekg s GLU 272 Cb 0.42 -2.11 -0.02 0.00 2.00 0.00 0.00 34.13 34.41 3ekg s GLU 272 CO 0.03 0.45 -0.01 0.00 -0.56 0.00 0.00 175.26 175.17 3ekg s ALA 273 N -1.43 0.08 0.29 6.30 0.00 -1.26 -4.49 121.76 121.25 3ekg s ALA 273 Ca 0.21 -0.56 0.00 0.00 0.00 0.00 0.00 51.96 51.62 3ekg s ALA 273 Cb -0.10 0.15 0.00 0.00 0.00 0.00 0.00 23.12 23.17 3ekg s ALA 273 CO 0.12 -0.17 0.00 0.25 0.00 0.00 0.00 175.76 175.96 3ekg n THR 274 N 1.56 -0.30 0.09 0.00 -2.24 -0.76 -3.17 114.28 109.46 3ekg n THR 274 Ca -0.24 0.40 0.07 0.00 -2.27 0.00 0.00 64.05 62.01 3ekg n THR 274 Cb 0.55 -0.64 0.52 0.00 -2.10 0.00 0.00 70.33 68.66 3ekg n THR 274 CO 0.00 0.00 0.00 0.08 -0.57 0.00 0.00 175.07 174.58 3ekg h ARG 275 N -0.72 0.30 -0.00 -0.78 0.11 -1.87 -2.41 114.38 109.01 3ekg h ARG 275 Ca -0.08 -0.02 -0.21 0.00 0.10 0.00 0.00 59.98 59.77 3ekg h ARG 275 Cb 0.70 -0.07 -0.00 0.00 1.11 0.00 0.00 29.97 31.71 3ekg h ARG 275 CO 0.03 0.20 -0.90 -1.49 0.10 0.00 0.00 179.97 177.91 3ekg h TRP 276 N 0.31 0.45 -0.35 4.08 6.55 -1.99 -0.59 115.95 124.41 3ekg h TRP 276 Ca 0.11 -0.25 -0.08 0.00 0.95 0.00 0.00 58.89 59.62 3ekg h TRP 276 Cb 0.05 -0.05 -0.01 0.00 -0.86 0.00 0.00 29.16 28.29 3ekg h TRP 276 CO -0.00 1.06 -0.10 0.78 -1.05 0.00 0.00 178.44 179.13 3ekg h GLY 277 N 1.53 0.75 2.00 1.49 0.00 -1.40 -2.99 103.07 104.44 3ekg h GLY 277 Ca -0.06 -0.63 -0.08 0.00 0.00 0.00 0.00 47.33 46.57 3ekg h GLY 277 CO 0.15 0.57 -0.36 0.74 0.00 0.00 0.00 176.54 177.64 3ekg h PHE 278 N 0.48 0.00 0.00 5.60 0.04 -1.45 -2.67 116.94 118.94 3ekg h PHE 278 Ca 0.09 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.86 3ekg h PHE 278 Cb 0.61 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.76 3ekg h PHE 278 CO 0.05 0.36 0.00 -2.13 -0.60 0.00 0.00 178.31 175.99 3ekg n ARG 279 N -3.42 0.30 0.00 1.51 0.63 -0.23 -1.27 116.66 114.18 3ekg n ARG 279 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 3ekg n ARG 279 Cb 0.54 -1.31 0.00 0.00 0.45 0.00 0.00 32.46 32.14 3ekg n ARG 279 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 3ekg n LEU 281 N 0.75 0.00 -0.04 6.15 4.77 -1.01 -0.59 117.00 127.03 3ekg n LEU 281 Ca 0.00 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.84 3ekg n LEU 281 Cb 0.13 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.14 3ekg n LEU 281 CO 0.00 0.00 0.51 -0.07 -1.33 0.00 0.00 177.39 176.50 3ekg h LEU 282 N 0.00 0.38 -2.60 2.23 3.38 -1.48 -0.76 115.31 116.45 3ekg h LEU 282 Ca 0.00 -0.58 0.00 0.00 0.09 0.00 0.00 57.88 57.39 3ekg h LEU 282 Cb 0.00 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.64 3ekg h LEU 282 CO 0.00 0.89 0.00 -0.62 0.09 0.00 0.00 178.44 178.80 3ekg n GLU 283 N -4.49 0.36 -2.46 1.13 1.02 0.25 -4.59 120.64 111.86 3ekg n GLU 283 Ca -0.07 0.00 -0.03 0.00 -0.02 0.00 0.00 57.16 57.04 3ekg n GLU 283 Cb 0.44 -1.32 0.09 0.00 -0.02 0.00 0.00 31.44 30.63 3ekg n GLU 283 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3ekg n GLY 285 N 1.19 1.13 0.17 0.62 0.00 -1.12 -5.18 105.19 102.00 3ekg n GLY 285 Ca 0.00 -0.12 0.05 0.00 0.00 0.00 0.00 46.02 45.95 3ekg n GLY 285 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ekg n ASP 288 N -0.40 0.33 -3.83 0.00 8.00 0.91 -4.88 116.55 116.67 3ekg n ASP 288 Ca -0.09 0.14 -0.18 0.00 0.71 0.00 0.00 54.79 55.37 3ekg n ASP 288 Cb 0.62 1.01 -0.16 0.00 -0.02 0.00 0.00 41.12 42.57 3ekg n ASP 288 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3ekg s ILE 289 N -3.01 0.27 -0.09 0.53 1.01 -1.22 -3.70 121.20 114.99 3ekg s ILE 289 Ca -0.07 0.05 -0.10 0.00 0.00 0.00 0.00 60.65 60.54 3ekg s ILE 289 Cb 0.10 -0.35 -0.05 0.00 0.01 0.00 0.00 42.46 42.17 3ekg s ILE 289 CO 0.85 0.17 0.23 0.27 0.00 0.00 0.00 174.94 176.46 3ekg s ILE 290 N 1.10 5.34 -0.53 2.92 -4.36 -0.92 -2.76 121.20 121.98 3ekg s ILE 290 Ca -0.09 0.43 0.07 0.00 -0.26 0.00 0.00 60.65 60.80 3ekg s ILE 290 Cb -0.14 -3.51 0.34 0.00 1.25 0.00 0.00 42.46 40.40 3ekg s ILE 290 CO -0.02 0.59 0.88 0.00 0.24 0.00 0.00 174.94 176.64 3ekg n GLN 291 N 2.07 2.63 -2.02 0.37 6.02 0.11 -2.16 117.38 124.39 3ekg n GLN 291 Ca -0.17 -4.47 -0.36 0.00 -0.01 0.00 0.00 57.00 51.99 3ekg n GLN 291 Cb 0.54 -2.10 0.03 0.00 1.02 0.00 0.00 30.24 29.74 3ekg n GLN 291 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 3ekg s PRO 292 N -3.15 2.99 -0.23 -1.09 0.04 -1.25 -1.77 135.00 130.54 3ekg s PRO 292 Ca 0.46 1.81 -0.09 0.00 0.04 0.00 0.00 61.00 63.22 3ekg s PRO 292 Cb 0.29 -1.93 -0.04 0.00 0.04 0.00 0.00 34.50 32.86 3ekg s PRO 292 CO -0.12 -1.19 0.10 0.34 0.04 0.00 0.00 177.00 176.17 3ekg s ASP 293 N -1.62 5.65 0.57 6.66 -1.08 -1.26 -0.94 116.67 124.64 3ekg s ASP 293 Ca 0.77 -0.01 0.25 0.00 -0.52 0.00 0.00 52.55 53.05 3ekg s ASP 293 Cb -0.30 -2.00 1.58 0.00 -1.46 0.00 0.00 42.92 40.74 3ekg s ASP 293 CO 0.33 0.06 2.15 1.62 0.52 0.00 0.00 175.17 179.85 3ekg h VAL 294 N 5.16 0.65 -0.01 1.11 3.04 -1.91 0.24 116.25 124.53 3ekg h VAL 294 Ca -0.37 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.32 3ekg h VAL 294 Cb 1.17 0.92 0.00 0.00 -2.01 0.00 0.00 31.29 31.37 3ekg h VAL 294 CO 0.64 0.00 -0.14 0.61 -1.01 0.00 0.00 177.57 177.67 3ekg n GLY 295 N -1.44 -0.51 0.00 3.17 0.00 -1.26 -1.63 105.19 103.52 3ekg n GLY 295 Ca -0.00 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.64 3ekg n GLY 295 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3ekg n TRP 296 N -0.48 0.00 1.13 1.61 8.01 -0.34 -4.45 117.44 122.92 3ekg n TRP 296 Ca 0.15 0.00 0.13 0.00 -1.31 0.00 0.00 57.50 56.48 3ekg n TRP 296 Cb 0.32 0.00 0.48 0.00 -2.01 0.00 0.00 31.31 30.10 3ekg n TRP 296 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 3ekg n GLY 298 N 1.43 -0.01 0.87 0.00 0.00 -1.26 -1.83 105.19 104.39 3ekg n GLY 298 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 3ekg n GLY 298 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ekg n GLY 299 N 0.00 -3.00 0.27 -0.02 0.00 -0.64 -4.04 105.19 97.76 3ekg n GLY 299 Ca 0.00 -1.90 -0.07 0.00 0.00 0.00 0.00 46.02 44.05 3ekg n GLY 299 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3ekg h VAL 300 N 0.00 1.22 -0.46 1.61 2.07 -1.86 -0.21 116.25 118.61 3ekg h VAL 300 Ca 0.00 -0.64 0.05 0.00 0.82 0.00 0.00 66.70 66.93 3ekg h VAL 300 Cb 0.00 0.50 -0.05 0.00 -1.52 0.00 0.00 31.29 30.22 3ekg h VAL 300 CO 0.00 0.26 0.20 0.74 0.02 0.00 0.00 177.57 178.79 3ekg h THR 301 N 0.85 0.91 0.02 2.57 2.02 -1.92 -0.23 112.91 117.13 3ekg h THR 301 Ca 0.21 -0.14 -0.21 0.00 0.77 0.00 0.00 66.41 67.05 3ekg h THR 301 Cb 0.14 0.47 -0.01 0.00 -1.74 0.00 0.00 68.15 67.01 3ekg h THR 301 CO -0.02 0.07 -0.94 -0.08 0.37 0.00 0.00 175.52 174.92 3ekg h GLU 302 N 0.40 0.15 0.00 6.66 4.57 -1.68 -3.16 114.58 121.52 3ekg h GLU 302 Ca 0.21 -0.19 -0.06 0.00 -1.18 0.00 0.00 59.36 58.15 3ekg h GLU 302 Cb 0.17 0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 28.81 3ekg h GLU 302 CO -0.18 0.98 -0.28 1.25 -1.18 0.00 0.00 179.01 179.60 3ekg h LEU 303 N 0.07 0.00 -0.75 1.64 5.85 -0.49 -0.56 115.31 121.06 3ekg h LEU 303 Ca -0.05 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.65 3ekg h LEU 303 Cb 1.61 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 42.60 3ekg h LEU 303 CO 0.14 0.28 0.39 -0.07 -0.34 0.00 0.00 178.44 178.84 3ekg h LEU 304 N 0.00 0.96 -0.36 2.25 3.38 -1.02 0.22 115.31 120.74 3ekg h LEU 304 Ca -0.00 -0.11 -0.19 0.00 0.09 0.00 0.00 57.88 57.67 3ekg h LEU 304 Cb 0.53 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.04 3ekg h LEU 304 CO 0.04 0.80 -0.63 0.11 0.09 0.00 0.00 178.44 178.84 3ekg h LYS 305 N 1.05 0.66 -0.59 1.13 1.57 -1.39 -1.39 116.57 117.62 3ekg h LYS 305 Ca 0.26 -0.47 -0.05 0.00 -1.87 0.00 0.00 60.65 58.53 3ekg h LYS 305 Cb 0.07 0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.43 3ekg h LYS 305 CO -0.04 1.09 0.17 0.82 -0.57 0.00 0.00 179.45 180.92 3ekg h ILE 306 N 0.49 1.24 -0.75 1.86 2.04 -0.86 -1.61 117.51 119.93 3ekg h ILE 306 Ca -0.01 -0.84 -0.06 0.00 1.00 0.00 0.00 64.86 64.95 3ekg h ILE 306 Cb 1.22 0.68 -0.03 0.00 -0.74 0.00 0.00 36.82 37.94 3ekg h ILE 306 CO 0.12 0.32 0.23 -1.28 0.00 0.00 0.00 178.15 177.54 3ekg h SER 307 N 0.83 1.09 -0.41 1.72 0.87 -0.46 -1.46 113.55 115.73 3ekg h SER 307 Ca 0.19 -0.21 -0.08 0.00 -1.23 0.00 0.00 61.79 60.46 3ekg h SER 307 Cb 0.30 -0.29 -0.02 0.00 -0.44 0.00 0.00 62.40 61.96 3ekg h SER 307 CO -0.00 1.01 -0.02 0.00 -0.53 0.00 0.00 176.83 177.29 3ekg h ALA 308 N 1.12 1.06 -0.37 6.23 0.00 -0.97 -0.19 119.26 126.14 3ekg h ALA 308 Ca 0.24 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 3ekg h ALA 308 Cb 0.31 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 3ekg h ALA 308 CO -0.01 0.59 0.19 1.25 0.00 0.00 0.00 179.25 181.27 3ekg h LEU 309 N 0.76 0.47 -1.19 0.00 5.85 -0.91 -1.91 115.31 118.38 3ekg h LEU 309 Ca 0.14 -0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 3ekg h LEU 309 Cb 0.48 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.36 3ekg h LEU 309 CO 0.02 0.44 0.43 0.00 -0.34 0.00 0.00 178.44 179.00 3ekg h ALA 310 N 1.05 1.39 -0.53 1.25 0.00 -0.75 -2.17 119.26 119.51 3ekg h ALA 310 Ca 0.13 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 54.99 3ekg h ALA 310 Cb 0.08 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 17.54 3ekg h ALA 310 CO -0.02 0.52 0.30 -0.44 0.00 0.00 0.00 179.25 179.61 3ekg h ASP 311 N 1.01 0.46 0.24 0.00 3.45 -0.36 0.12 116.42 121.34 3ekg h ASP 311 Ca 0.26 0.01 -0.05 0.00 0.43 0.00 0.00 57.03 57.69 3ekg h ASP 311 Cb -0.03 -0.08 -0.01 0.00 -0.56 0.00 0.00 39.33 38.65 3ekg h ASP 311 CO -0.05 0.32 -0.23 0.00 -1.57 0.00 0.00 179.24 177.72 3ekg h ALA 312 N 1.25 1.60 -0.11 3.45 0.00 -0.79 -1.39 119.26 123.27 3ekg h ALA 312 Ca 0.22 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3ekg h ALA 312 Cb 0.07 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3ekg h ALA 312 CO -0.12 0.28 0.00 0.72 0.00 0.00 0.00 179.25 180.13 3ekg n HIS 313 N -4.23 0.13 -4.00 0.00 8.25 -0.55 -4.93 115.22 109.89 3ekg n HIS 313 Ca -0.02 -0.06 -0.32 0.00 -0.26 0.00 0.00 57.72 57.06 3ekg n HIS 313 Cb 0.29 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.41 3ekg n HIS 313 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 3ekg n ASN 314 N 0.44 -4.16 -4.82 0.41 3.02 0.26 -4.95 115.26 105.45 3ekg n ASN 314 Ca 0.17 -0.85 -0.28 0.00 -0.03 0.00 0.00 54.58 53.59 3ekg n ASN 314 Cb 0.38 -3.55 -0.05 0.00 -0.61 0.00 0.00 39.78 35.95 3ekg n ASN 314 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3ekg s ALA 315 N -3.33 3.66 0.24 5.41 0.00 -0.24 -5.03 121.76 122.47 3ekg s ALA 315 Ca 0.65 -1.09 -0.27 0.00 0.00 0.00 0.00 51.96 51.25 3ekg s ALA 315 Cb -0.33 -1.49 -0.09 0.00 0.00 0.00 0.00 23.12 21.21 3ekg s ALA 315 CO 0.86 0.62 0.89 -0.51 0.00 0.00 0.00 175.76 177.62 3ekg s LEU 316 N -2.83 4.56 -0.22 0.00 1.43 -1.24 -4.59 118.68 115.78 3ekg s LEU 316 Ca 0.31 1.82 0.01 0.00 -1.03 0.00 0.00 54.13 55.24 3ekg s LEU 316 Cb -0.11 -3.61 0.06 0.00 0.03 0.00 0.00 46.19 42.55 3ekg s LEU 316 CO 0.24 0.12 -0.06 -0.69 0.23 0.00 0.00 176.35 176.19 3ekg s VAL 317 N -1.28 1.55 -0.57 -1.59 1.01 -0.48 -2.17 120.40 116.87 3ekg s VAL 317 Ca 0.42 -1.16 0.04 0.00 0.00 0.00 0.00 61.98 61.27 3ekg s VAL 317 Cb -0.23 -1.77 0.15 0.00 0.00 0.00 0.00 36.38 34.53 3ekg s VAL 317 CO 0.28 -0.04 0.35 -0.69 0.00 0.00 0.00 175.10 175.01 3ekg s VAL 318 N 1.40 2.27 0.36 2.92 1.01 -0.92 -4.07 120.40 123.37 3ekg s VAL 318 Ca -0.05 -3.48 -0.25 0.00 0.00 0.00 0.00 61.98 58.20 3ekg s VAL 318 Cb -0.18 -2.54 -0.13 0.00 0.00 0.00 0.00 36.38 33.54 3ekg s VAL 318 CO -0.07 -0.94 0.83 -2.65 0.00 0.00 0.00 175.10 172.27 3ekg n PRO 319 N 2.73 1.00 -1.78 2.72 -0.02 -1.26 -4.40 135.00 133.99 3ekg n PRO 319 Ca 0.14 0.36 -0.42 0.00 -2.02 0.00 0.00 63.50 61.56 3ekg n PRO 319 Cb 0.35 -1.74 -0.02 0.00 -0.02 0.00 0.00 33.50 32.07 3ekg n PRO 319 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 3ekg s HIS 320 N -1.25 2.86 -0.05 6.00 5.65 -0.12 -4.35 115.29 124.03 3ekg s HIS 320 Ca 0.62 0.59 -0.37 0.00 0.25 0.00 0.00 55.06 56.14 3ekg s HIS 320 Cb -0.64 -4.08 -0.15 0.00 -1.18 0.00 0.00 32.58 26.53 3ekg s HIS 320 CO 0.58 -3.85 1.57 0.41 -0.65 0.00 0.00 174.74 172.80 3ekg n GLY 321 N 3.09 0.80 2.45 1.59 0.00 -1.26 -4.57 105.19 107.28 3ekg n GLY 321 Ca 0.12 0.79 -0.06 0.00 0.00 0.00 0.00 46.02 46.88 3ekg n GLY 321 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3ekg n SER 322 N 4.10 2.40 0.00 1.61 7.64 -1.26 -4.95 113.62 123.16 3ekg n SER 322 Ca 0.21 -2.53 0.00 0.00 1.01 0.00 0.00 58.87 57.57 3ekg n SER 322 Cb 0.19 -0.43 0.00 0.00 -1.01 0.00 0.00 64.21 62.96 3ekg n SER 322 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 3ekg n SER 323 N -0.56 0.00 0.12 6.43 2.88 -1.26 -1.89 113.62 119.34 3ekg n SER 323 Ca 0.17 0.00 0.19 0.00 -1.33 0.00 0.00 58.87 57.90 3ekg n SER 323 Cb 0.87 0.00 0.77 0.00 -0.75 0.00 0.00 64.21 65.09 3ekg n SER 323 CO 0.00 0.00 0.00 -0.37 -1.23 0.00 0.00 175.04 173.44 3ekg h VAL 324 N 0.00 0.48 -0.02 2.46 -1.51 -1.92 -0.47 116.25 115.26 3ekg h VAL 324 Ca 0.00 0.00 -0.08 0.00 -1.23 0.00 0.00 66.70 65.39 3ekg h VAL 324 Cb 0.00 0.74 -0.01 0.00 -2.13 0.00 0.00 31.29 29.88 3ekg h VAL 324 CO 0.00 0.00 -0.34 1.88 -1.23 0.00 0.00 177.57 177.88 3ekg h TYR 325 N 0.00 0.04 0.06 5.19 0.05 -1.74 -2.27 116.97 118.31 3ekg h TYR 325 Ca 0.16 -0.01 -0.34 0.00 0.05 0.00 0.00 58.73 58.59 3ekg h TYR 325 Cb 0.84 -0.01 -0.04 0.00 1.01 0.00 0.00 36.73 38.53 3ekg h TYR 325 CO 0.00 0.38 -1.97 -1.13 -1.05 0.00 0.00 178.16 174.39 3ekg n SER 326 N -4.12 1.49 -0.08 3.88 3.41 -0.28 -3.99 113.62 113.93 3ekg n SER 326 Ca -0.02 0.24 -0.07 0.00 -0.26 0.00 0.00 58.87 58.76 3ekg n SER 326 Cb 0.39 -0.39 0.00 0.00 -0.26 0.00 0.00 64.21 63.96 3ekg n SER 326 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 3ekg h TYR 327 N 0.03 0.11 -0.30 7.33 0.05 -1.17 0.03 116.97 123.06 3ekg h TYR 327 Ca -0.40 0.02 -0.04 0.00 0.05 0.00 0.00 58.73 58.36 3ekg h TYR 327 Cb 2.03 -0.01 -0.02 0.00 1.01 0.00 0.00 36.73 39.75 3ekg h TYR 327 CO 0.04 0.03 -0.00 0.45 -1.05 0.00 0.00 178.16 177.63 3ekg h HIS 328 N 0.18 0.47 0.08 4.88 3.86 -1.61 -2.72 115.15 120.29 3ekg h HIS 328 Ca 0.14 -0.04 -0.00 0.00 -1.16 0.00 0.00 60.37 59.31 3ekg h HIS 328 Cb 0.15 -0.14 0.00 0.00 1.06 0.00 0.00 27.41 28.48 3ekg h HIS 328 CO -0.17 0.47 -0.04 0.35 0.86 0.00 0.00 177.93 179.41 3ekg h PHE 329 N 0.44 -0.10 0.00 2.45 3.04 -1.54 -3.34 116.94 117.90 3ekg h PHE 329 Ca 0.10 -0.00 -0.00 0.00 3.98 0.00 0.00 57.97 62.04 3ekg h PHE 329 Cb 0.30 0.03 -0.00 0.00 2.56 0.00 0.00 35.95 38.84 3ekg h PHE 329 CO 0.01 0.37 -0.01 -0.39 -2.02 0.00 0.00 178.31 176.27 3ekg h VAL 330 N -0.95 0.59 0.00 1.41 -1.51 -1.06 -1.75 116.25 112.99 3ekg h VAL 330 Ca -0.01 -0.03 -0.01 0.00 -1.23 0.00 0.00 66.70 65.42 3ekg h VAL 330 Cb 0.51 1.02 -0.00 0.00 -2.13 0.00 0.00 31.29 30.69 3ekg h VAL 330 CO 0.02 0.01 -0.05 0.00 -1.23 0.00 0.00 177.57 176.32 3ekg h ALA 331 N 1.99 1.50 -0.02 5.19 0.00 -1.60 -2.44 119.26 123.88 3ekg h ALA 331 Ca -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3ekg h ALA 331 Cb 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3ekg h ALA 331 CO 0.00 0.06 -0.09 0.25 0.00 0.00 0.00 179.25 179.47 3ekg n THR 332 N -3.87 0.00 -3.76 0.00 -2.24 -0.66 -0.60 114.28 103.15 3ekg n THR 332 Ca -0.03 -0.38 -0.37 0.00 -2.27 0.00 0.00 64.05 61.01 3ekg n THR 332 Cb 0.14 1.15 -0.12 0.00 -2.10 0.00 0.00 70.33 69.40 3ekg n THR 332 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3ekg s ARG 333 N -2.11 3.77 0.49 -0.78 1.81 -0.92 -4.59 118.95 116.62 3ekg s ARG 333 Ca 0.29 -0.42 0.16 0.00 -1.72 0.00 0.00 55.73 54.04 3ekg s ARG 333 Cb 0.20 -3.39 1.17 0.00 -0.45 0.00 0.00 34.95 32.48 3ekg s ARG 333 CO 0.37 -0.12 2.07 1.96 -0.68 0.00 0.00 175.30 178.90 3ekg h GLN 334 N 8.04 0.00 -0.12 3.54 1.08 -1.91 -2.35 115.11 123.39 3ekg h GLN 334 Ca -0.37 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.83 3ekg h GLN 334 Cb 1.18 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.61 3ekg h GLN 334 CO 0.59 0.09 0.00 0.27 -0.95 0.00 0.00 178.83 178.83 3ekg n ASN 335 N -4.37 0.80 -3.43 1.46 0.23 -1.26 -4.36 115.26 104.32 3ekg n ASN 335 Ca -0.03 -1.80 -0.26 0.00 -0.53 0.00 0.00 54.58 51.96 3ekg n ASN 335 Cb 0.17 -0.08 -0.09 0.00 -2.08 0.00 0.00 39.78 37.70 3ekg n ASN 335 CO 0.00 0.00 0.00 -0.24 -0.93 0.00 0.00 177.26 176.09 3ekg n SER 336 N -0.15 1.90 0.28 0.53 2.88 -0.88 -1.38 113.62 116.80 3ekg n SER 336 Ca 0.09 -3.01 0.15 0.00 -1.33 0.00 0.00 58.87 54.77 3ekg n SER 336 Cb 0.15 -0.66 0.82 0.00 -0.75 0.00 0.00 64.21 63.77 3ekg n SER 336 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 3ekg h PRO 337 N 4.56 0.00 -3.93 -1.46 0.13 -1.79 -3.45 132.00 126.06 3ekg h PRO 337 Ca 0.16 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.19 3ekg h PRO 337 Cb 0.78 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 31.77 3ekg h PRO 337 CO 0.63 0.07 -0.43 -0.59 -0.23 0.00 0.00 178.00 177.45 3ekg s PHE 338 N -4.14 0.29 0.20 1.56 -0.12 -1.26 -4.62 117.98 109.89 3ekg s PHE 338 Ca -0.03 -0.73 0.07 0.00 -0.05 0.00 0.00 56.93 56.19 3ekg s PHE 338 Cb 0.13 -0.14 -0.05 0.00 -0.63 0.00 0.00 43.02 42.33 3ekg s PHE 338 CO 0.55 -0.54 -0.14 0.00 -0.05 0.00 0.00 175.22 175.04 3ekg s ALA 339 N -3.90 1.96 -0.02 1.99 0.00 0.33 -4.83 121.76 117.30 3ekg s ALA 339 Ca 0.08 -1.64 -0.16 0.00 0.00 0.00 0.00 51.96 50.25 3ekg s ALA 339 Cb 0.05 -0.07 -0.06 0.00 0.00 0.00 0.00 23.12 23.04 3ekg s ALA 339 CO -0.08 0.05 0.44 -2.00 0.00 0.00 0.00 175.76 174.17 3ekg s GLU 340 N -3.63 4.05 -0.14 0.00 2.12 -1.26 -1.45 118.70 118.39 3ekg s GLU 340 Ca 0.22 0.45 -0.00 0.00 0.36 0.00 0.00 54.97 55.99 3ekg s GLU 340 Cb -0.01 -3.27 0.03 0.00 0.26 0.00 0.00 34.13 31.15 3ekg s GLU 340 CO 0.06 0.57 -0.07 0.12 -0.54 0.00 0.00 175.26 175.40 3ekg s PHE 341 N -0.71 1.64 0.00 5.30 5.36 -0.68 -4.33 117.98 124.55 3ekg s PHE 341 Ca 0.25 -0.94 0.00 0.00 -0.96 0.00 0.00 56.93 55.27 3ekg s PHE 341 Cb -0.17 -1.30 0.00 0.00 -0.34 0.00 0.00 43.02 41.22 3ekg s PHE 341 CO 0.13 -0.57 0.00 1.28 -1.46 0.00 0.00 175.22 174.60 3ekg n LEU 342 N 4.90 0.00 0.00 6.12 7.99 -1.26 -1.20 117.00 133.55 3ekg n LEU 342 Ca -0.12 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 55.88 3ekg n LEU 342 Cb 0.49 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.80 3ekg n LEU 342 CO 0.17 0.00 0.00 0.00 -1.51 0.00 0.00 177.39 176.05 3ekg n ALA 345 N -3.00 -1.13 -0.33 -1.18 0.00 -1.26 -4.89 120.51 108.71 3ekg n ALA 345 Ca 0.00 0.00 0.21 0.00 0.00 0.00 0.00 53.44 53.65 3ekg n ALA 345 Cb 0.00 -0.27 0.44 0.00 0.00 0.00 0.00 19.45 19.61 3ekg n ALA 345 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3ekg h PRO 346 N 0.00 0.36 -0.38 0.00 0.11 -1.95 -0.12 132.00 130.02 3ekg h PRO 346 Ca 0.00 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.09 3ekg h PRO 346 Cb 0.00 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.03 3ekg h PRO 346 CO 0.00 0.24 0.00 1.63 -0.21 0.00 0.00 178.00 179.66 3ekg n LYS 347 N -5.03 3.20 -4.09 1.05 5.02 -1.26 -1.04 118.16 116.01 3ekg n LYS 347 Ca 0.30 -2.65 -0.34 0.00 -2.02 0.00 0.00 58.31 53.59 3ekg n LYS 347 Cb 0.90 -1.72 -0.04 0.00 -0.02 0.00 0.00 35.03 34.15 3ekg n LYS 347 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3ekg n ALA 348 N 0.16 -1.19 -0.30 7.82 0.00 -0.06 -4.81 120.51 122.12 3ekg n ALA 348 Ca 0.20 -0.05 0.07 0.00 0.00 0.00 0.00 53.44 53.65 3ekg n ALA 348 Cb 0.78 -2.90 0.19 0.00 0.00 0.00 0.00 19.45 17.52 3ekg n ALA 348 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3ekg n ASP 349 N -2.46 3.19 -3.50 0.00 3.85 -1.26 -4.66 116.55 111.71 3ekg n ASP 349 Ca 0.07 -2.14 -0.10 0.00 -0.71 0.00 0.00 54.79 51.92 3ekg n ASP 349 Cb 0.48 -0.30 -0.03 0.00 -1.35 0.00 0.00 41.12 39.93 3ekg n ASP 349 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3ekg s GLN 350 N -1.24 0.90 -0.03 0.11 -2.07 -1.26 -5.09 119.66 110.97 3ekg s GLN 350 Ca 0.29 -0.25 -0.22 0.00 -1.82 0.00 0.00 55.36 53.35 3ekg s GLN 350 Cb 0.17 0.41 -0.05 0.00 -1.09 0.00 0.00 33.01 32.45 3ekg s GLN 350 CO 0.17 -0.38 0.66 0.08 -1.32 0.00 0.00 175.29 174.50 3ekg s VAL 351 N -2.90 4.96 0.05 3.63 1.01 -1.26 -4.51 120.40 121.39 3ekg s VAL 351 Ca 0.02 1.38 -0.01 0.00 0.00 0.00 0.00 61.98 63.38 3ekg s VAL 351 Cb -0.01 -4.00 -0.04 0.00 0.00 0.00 0.00 36.38 32.33 3ekg s VAL 351 CO -0.07 0.33 -0.03 0.68 0.00 0.00 0.00 175.10 176.00 3ekg s VAL 352 N 0.32 0.25 0.00 2.92 -7.23 -1.26 -5.05 120.40 110.34 3ekg s VAL 352 Ca 0.35 -1.76 0.00 0.00 -1.81 0.00 0.00 61.98 58.76 3ekg s VAL 352 Cb -0.18 -1.45 0.00 0.00 0.56 0.00 0.00 36.38 35.31 3ekg s VAL 352 CO 0.18 -0.96 0.00 -2.65 -0.31 0.00 0.00 175.10 171.36 3ekg n PRO 353 N 0.20 1.67 0.00 4.82 -0.02 -1.26 -4.91 135.00 135.50 3ekg n PRO 353 Ca -0.15 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.33 3ekg n PRO 353 Cb 0.61 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.09 3ekg n PRO 353 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3ekg n PHE 355 N -0.51 0.00 -1.97 6.00 3.01 -1.26 -4.90 117.46 117.82 3ekg n PHE 355 Ca 0.00 0.00 -0.39 0.00 1.01 0.00 0.00 57.45 58.07 3ekg n PHE 355 Cb 0.00 0.00 0.01 0.00 -0.01 0.00 0.00 39.48 39.48 3ekg n PHE 355 CO 0.00 0.00 0.00 -1.58 1.01 0.00 0.00 176.76 176.19 3ekg s HIS 356 N 0.00 2.63 -1.45 1.38 5.65 -1.26 -1.94 115.29 120.30 3ekg s HIS 356 Ca 0.00 1.39 0.20 0.00 0.25 0.00 0.00 55.06 56.90 3ekg s HIS 356 Cb 0.00 -3.71 0.65 0.00 -1.18 0.00 0.00 32.58 28.35 3ekg s HIS 356 CO 0.00 -2.36 1.56 -0.35 -0.65 0.00 0.00 174.74 172.94 3ekg n PRO 357 N -0.30 3.22 0.10 2.88 -0.04 -1.26 -0.99 135.00 138.61 3ekg n PRO 357 Ca 0.06 -2.73 -0.02 0.00 -0.04 0.00 0.00 63.50 60.77 3ekg n PRO 357 Cb 0.44 -1.70 0.20 0.00 -0.04 0.00 0.00 33.50 32.40 3ekg n PRO 357 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 3ekg h GLN 358 N 3.95 0.20 -4.66 0.54 4.20 -1.73 -3.44 115.11 114.17 3ekg h GLN 358 Ca 0.00 -0.11 -0.70 0.00 0.06 0.00 0.00 58.65 57.91 3ekg h GLN 358 Cb 1.20 0.00 -0.26 0.00 0.30 0.00 0.00 27.48 28.72 3ekg h GLN 358 CO 0.11 0.64 -0.57 -0.51 -0.67 0.00 0.00 178.83 177.83 3ekg s LEU 359 N -8.10 4.42 0.26 1.46 1.02 -1.23 -1.34 118.68 115.16 3ekg s LEU 359 Ca -0.04 -1.01 -0.29 0.00 0.02 0.00 0.00 54.13 52.81 3ekg s LEU 359 Cb 0.13 -1.94 -0.09 0.00 0.02 0.00 0.00 46.19 44.31 3ekg s LEU 359 CO 0.77 -0.33 0.97 -0.76 0.02 0.00 0.00 176.35 177.02 3ekg s LEU 360 N 1.48 4.59 0.00 1.79 1.43 0.24 -3.19 118.68 125.01 3ekg s LEU 360 Ca 0.01 1.98 0.00 0.00 -1.03 0.00 0.00 54.13 55.09 3ekg s LEU 360 Cb -0.19 -3.68 0.00 0.00 0.03 0.00 0.00 46.19 42.35 3ekg s LEU 360 CO 0.04 0.07 0.00 0.61 0.23 0.00 0.00 176.35 177.31 3ekg n GLY 361 N 1.30 0.59 3.67 -3.19 0.00 -1.26 -1.85 105.19 104.46 3ekg n GLY 361 Ca -0.01 -0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 3ekg n GLY 361 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3ekg s GLU 362 N -0.21 4.26 0.31 1.61 2.12 -1.19 -4.76 118.70 120.84 3ekg s GLU 362 Ca 0.00 1.86 -0.27 0.00 0.36 0.00 0.00 54.97 56.92 3ekg s GLU 362 Cb 0.00 -3.70 -0.09 0.00 0.26 0.00 0.00 34.13 30.60 3ekg s GLU 362 CO 0.00 -0.64 1.01 -1.25 -0.54 0.00 0.00 175.26 173.84 3ekg s PRO 363 N 2.98 4.55 0.20 4.30 0.04 -1.26 -4.92 135.00 140.89 3ekg s PRO 363 Ca 0.61 1.53 0.09 0.00 0.04 0.00 0.00 61.00 63.27 3ekg s PRO 363 Cb -0.28 -2.93 -0.04 0.00 0.04 0.00 0.00 34.50 31.29 3ekg s PRO 363 CO 0.23 0.21 -0.05 0.14 0.04 0.00 0.00 177.00 177.56 3ekg s VAL 364 N -1.42 3.38 0.39 -0.36 -7.23 -1.26 -4.95 120.40 108.94 3ekg s VAL 364 Ca 0.49 -1.69 -0.27 0.00 -1.81 0.00 0.00 61.98 58.70 3ekg s VAL 364 Cb -0.24 -2.72 -0.10 0.00 0.56 0.00 0.00 36.38 33.88 3ekg s VAL 364 CO 0.31 -0.19 1.38 -2.84 -0.31 0.00 0.00 175.10 173.44 3ekg s PRO 365 N -3.10 4.04 -0.37 4.82 0.02 -1.26 -4.97 135.00 134.19 3ekg s PRO 365 Ca 0.27 2.33 -0.07 0.00 0.02 0.00 0.00 61.00 63.56 3ekg s PRO 365 Cb -0.08 -2.87 0.06 0.00 0.02 0.00 0.00 34.50 31.63 3ekg s PRO 365 CO 0.17 -0.49 0.15 -2.00 -0.33 0.00 0.00 177.00 174.50 3ekg s GLU 366 N -2.14 2.55 -1.36 5.54 2.12 0.92 -4.51 118.70 121.82 3ekg s GLU 366 Ca 0.55 -1.32 -0.05 0.00 0.36 0.00 0.00 54.97 54.50 3ekg s GLU 366 Cb -0.42 -3.55 0.03 0.00 0.26 0.00 0.00 34.13 30.45 3ekg s GLU 366 CO 0.55 -0.78 0.90 -1.71 -0.54 0.00 0.00 175.26 173.68 3ekg n ASN 367 N 4.81 -3.08 0.00 -1.70 5.15 -1.26 -2.21 115.26 116.97 3ekg n ASN 367 Ca -0.11 -0.74 0.00 0.00 -0.60 0.00 0.00 54.58 53.13 3ekg n ASN 367 Cb 0.44 -4.31 0.00 0.00 -0.53 0.00 0.00 39.78 35.37 3ekg n ASN 367 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3ekg n GLY 368 N -1.60 0.57 0.00 8.20 0.00 -1.26 -4.48 105.19 106.62 3ekg n GLY 368 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.86 3ekg n GLY 368 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ekg n ARG 369 N -2.09 1.36 -4.40 1.61 5.12 -0.94 -1.70 116.66 115.61 3ekg n ARG 369 Ca 0.00 0.00 -0.21 0.00 -1.93 0.00 0.00 57.85 55.71 3ekg n ARG 369 Cb 0.06 0.00 -0.16 0.00 -1.16 0.00 0.00 32.46 31.20 3ekg n ARG 369 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 3ekg s ARG 371 N 1.78 1.02 0.56 5.56 1.81 -1.26 -0.05 118.95 128.37 3ekg s ARG 371 Ca 0.00 -0.31 0.30 0.00 -1.72 0.00 0.00 55.73 54.00 3ekg s ARG 371 Cb 0.00 -0.94 1.69 0.00 -0.45 0.00 0.00 34.95 35.24 3ekg s ARG 371 CO 0.00 0.10 2.17 -0.07 -0.68 0.00 0.00 175.30 176.83 3ekg h LEU 372 N 6.45 0.00 -2.34 2.53 -0.00 -1.46 -1.14 115.31 119.34 3ekg h LEU 372 Ca -0.33 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.55 3ekg h LEU 372 Cb 1.17 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.83 3ekg h LEU 372 CO 0.49 0.06 0.00 0.77 -0.00 0.00 0.00 178.44 179.75 3ekg h SER 373 N 0.00 0.00 1.78 -0.43 4.64 -1.98 -0.77 113.55 116.79 3ekg h SER 373 Ca -0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 3ekg h SER 373 Cb 0.17 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.25 3ekg h SER 373 CO 0.01 0.00 -0.08 0.03 -0.87 0.00 0.00 176.83 175.92 3ekg h ARG 374 N 0.00 0.00 -2.61 4.77 3.08 -1.60 -3.34 114.38 114.68 3ekg h ARG 374 Ca 0.00 0.00 -0.80 0.00 0.07 0.00 0.00 59.98 59.25 3ekg h ARG 374 Cb 0.07 0.00 -0.25 0.00 0.08 0.00 0.00 29.97 29.87 3ekg h ARG 374 CO 0.00 0.08 1.17 1.28 -1.07 0.00 0.00 179.97 181.43 3ekg n LEU 375 N -3.13 7.06 -0.53 3.04 4.77 -0.30 -4.67 117.00 123.24 3ekg n LEU 375 Ca 0.03 -5.22 0.08 0.00 -0.03 0.00 0.00 56.01 50.87 3ekg n LEU 375 Cb 0.53 -1.25 0.04 0.00 -2.33 0.00 0.00 43.42 40.41 3ekg n LEU 375 CO 0.34 1.88 0.41 -0.90 -1.33 0.00 0.00 177.39 177.79 3ekg n ASP 376 N 0.89 2.06 -4.90 -1.43 5.75 -1.25 -4.78 116.55 112.89 3ekg n ASP 376 Ca 0.41 -1.53 -0.28 0.00 -0.01 0.00 0.00 54.79 53.37 3ekg n ASP 376 Cb 0.29 0.19 -0.02 0.00 -1.03 0.00 0.00 41.12 40.55 3ekg n ASP 376 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 3ekg s GLN 377 N -1.56 3.64 0.60 0.11 -1.52 -1.26 -4.62 119.66 115.05 3ekg s GLN 377 Ca 0.17 0.25 -0.19 0.00 -1.95 0.00 0.00 55.36 53.64 3ekg s GLN 377 Cb 0.13 -2.43 -0.03 0.00 -0.22 0.00 0.00 33.01 30.46 3ekg s GLN 377 CO 0.28 -0.07 1.23 -2.30 -0.25 0.00 0.00 175.29 174.18 3ekg n PRO 378 N -1.70 1.24 0.00 2.91 -0.02 -1.26 -3.35 135.00 132.82 3ekg n PRO 378 Ca 0.01 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 3ekg n PRO 378 Cb 0.55 -2.45 0.00 0.00 -0.02 0.00 0.00 33.50 31.58 3ekg n PRO 378 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ekg n GLY 379 N 0.97 2.66 0.56 -1.23 0.00 -0.42 -1.71 105.19 106.01 3ekg n GLY 379 Ca 0.14 -0.41 0.06 0.00 0.00 0.00 0.00 46.02 45.81 3ekg n GLY 379 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3ekg n PHE 380 N 13.66 0.37 -1.50 1.61 3.72 -1.26 -1.33 117.46 132.73 3ekg n PHE 380 Ca 0.00 -0.18 -0.17 0.00 -0.05 0.00 0.00 57.45 57.05 3ekg n PHE 380 Cb 0.00 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.47 3ekg n PHE 380 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3ekg n GLY 381 N 1.02 1.68 3.41 1.37 0.00 -0.70 -4.91 105.19 107.06 3ekg n GLY 381 Ca 0.12 -0.15 -0.20 0.00 0.00 0.00 0.00 46.02 45.79 3ekg n GLY 381 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3ekg s VAL 382 N -2.59 1.61 0.15 1.61 -7.23 -1.26 -4.79 120.40 107.90 3ekg s VAL 382 Ca 0.00 -2.13 0.06 0.00 -1.81 0.00 0.00 61.98 58.10 3ekg s VAL 382 Cb 0.00 -2.37 -0.04 0.00 0.56 0.00 0.00 36.38 34.53 3ekg s VAL 382 CO 0.00 -0.35 -0.14 0.42 -0.31 0.00 0.00 175.10 174.72 3ekg s THR 383 N -3.04 1.47 0.05 5.32 -4.23 -0.77 -4.98 115.64 109.46 3ekg s THR 383 Ca 0.28 -1.87 -0.30 0.00 -1.18 0.00 0.00 61.69 58.62 3ekg s THR 383 Cb 0.03 -1.70 -0.05 0.00 1.34 0.00 0.00 72.50 72.11 3ekg s THR 383 CO 0.11 -0.46 1.17 -0.22 -0.54 0.00 0.00 174.62 174.68 3ekg s LEU 384 N -2.70 4.37 -0.07 4.79 2.96 -1.26 -0.60 118.68 126.17 3ekg s LEU 384 Ca 0.13 1.97 -0.30 0.00 -0.22 0.00 0.00 54.13 55.72 3ekg s LEU 384 Cb -0.04 -3.58 -0.06 0.00 0.50 0.00 0.00 46.19 43.02 3ekg s LEU 384 CO 0.04 -0.45 1.71 0.21 -1.32 0.00 0.00 176.35 176.54 3ekg s ASN 385 N 1.07 6.57 0.57 3.68 3.84 -0.45 -4.77 114.94 125.44 3ekg s ASN 385 Ca 0.58 2.21 0.26 0.00 0.21 0.00 0.00 52.86 56.12 3ekg s ASN 385 Cb -0.28 -2.53 1.55 0.00 -0.55 0.00 0.00 41.25 39.43 3ekg s ASN 385 CO 0.29 -1.01 2.10 -0.65 -2.79 0.00 0.00 177.10 175.03 3ekg h PRO 386 N 9.98 0.00 -0.87 0.43 0.11 -1.93 -2.08 132.00 137.65 3ekg h PRO 386 Ca -0.40 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.69 3ekg h PRO 386 Cb 1.18 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.25 3ekg h PRO 386 CO 0.96 0.00 0.46 0.93 -0.21 0.00 0.00 178.00 180.13 3ekg h GLU 387 N 0.00 1.22 -6.25 1.05 4.39 -1.95 -3.41 114.58 109.63 3ekg h GLU 387 Ca 0.10 -0.15 -0.56 0.00 0.34 0.00 0.00 59.36 59.09 3ekg h GLU 387 Cb 0.48 -0.23 -0.02 0.00 -0.10 0.00 0.00 28.75 28.88 3ekg h GLU 387 CO -0.00 0.91 1.17 0.00 -1.16 0.00 0.00 179.01 179.93 3ekg s GLN 389 N 4.72 3.61 0.50 0.00 -0.21 -1.26 -4.96 119.66 122.06 3ekg s GLN 389 Ca 0.77 0.52 -0.20 0.00 0.02 0.00 0.00 55.36 56.48 3ekg s GLN 389 Cb -0.29 -3.97 -0.08 0.00 1.00 0.00 0.00 33.01 29.67 3ekg s GLN 389 CO 0.31 -1.54 1.04 -0.51 -2.12 0.00 0.00 175.29 172.47 3ekg s LEU 390 N 4.87 3.80 -0.09 2.90 1.43 -1.26 -4.84 118.68 125.49 3ekg s LEU 390 Ca 0.49 1.91 0.01 0.00 -1.03 0.00 0.00 54.13 55.51 3ekg s LEU 390 Cb -0.08 -4.56 0.02 0.00 0.03 0.00 0.00 46.19 41.60 3ekg s LEU 390 CO 0.30 -0.83 -0.10 -2.28 0.23 0.00 0.00 176.35 173.67 3ekg s HIS 391 N -2.05 1.44 -0.82 0.29 5.65 -1.13 -4.96 115.29 113.71 3ekg s HIS 391 Ca 0.67 -0.62 -0.09 0.00 0.25 0.00 0.00 55.06 55.27 3ekg s HIS 391 Cb -0.16 -1.13 0.21 0.00 -1.18 0.00 0.00 32.58 30.32 3ekg s HIS 391 CO 0.22 -0.38 0.73 0.50 -0.65 0.00 0.00 174.74 175.16 3ekg s ARG 392 N 1.15 3.37 0.35 2.88 6.06 -1.26 -0.94 118.95 130.55 3ekg s ARG 392 Ca -0.06 -2.70 0.03 0.00 -2.50 0.00 0.00 55.73 50.51 3ekg s ARG 392 Cb -0.14 -4.20 0.63 0.00 0.06 0.00 0.00 34.95 31.30 3ekg s ARG 392 CO -0.02 -1.25 1.94 -1.35 -2.50 0.00 0.00 175.30 172.12 3ekg h PRO 393 N 7.19 0.66 -4.88 5.12 0.11 -1.97 -3.45 132.00 134.78 3ekg h PRO 393 Ca 0.09 -0.09 -0.28 0.00 0.11 0.00 0.00 66.00 65.83 3ekg h PRO 393 Cb 0.96 -0.12 -0.15 0.00 0.11 0.00 0.00 31.00 31.80 3ekg h PRO 393 CO 0.79 0.54 -0.71 0.71 -0.21 0.00 0.00 178.00 179.12 3ekg s TYR 394 N -5.32 1.08 0.30 0.65 2.02 -1.26 -5.11 117.35 109.71 3ekg s TYR 394 Ca -0.09 -0.81 0.03 0.00 -0.37 0.00 0.00 57.07 55.83 3ekg s TYR 394 Cb 0.16 -0.58 -0.04 0.00 -0.40 0.00 0.00 41.96 41.10 3ekg s TYR 394 CO 0.76 -0.02 0.16 0.95 -1.57 0.00 0.00 175.55 175.83 3ekg s THR 395 N -3.36 0.32 0.00 -0.71 -4.23 -1.26 -4.82 115.64 101.58 3ekg s THR 395 Ca 0.13 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.64 3ekg s THR 395 Cb 0.03 -2.52 0.00 0.00 1.34 0.00 0.00 72.50 71.35 3ekg s THR 395 CO -0.02 0.00 0.00 0.00 -0.54 0.00 0.00 174.62 174.06