#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oel s ALA 3 N 0.00 -0.87 -0.04 7.33 0.00 -1.26 -2.04 121.76 124.88 2oel s ALA 3 Ca 0.00 0.50 -0.24 0.00 0.00 0.00 0.00 51.96 52.22 2oel s ALA 3 Cb 0.00 -0.04 -0.04 0.00 0.00 0.00 0.00 23.12 23.04 2oel s ALA 3 CO 0.00 -0.25 0.73 0.08 0.00 0.00 0.00 175.76 176.32 2oel s VAL 4 N -1.07 4.97 -0.26 0.00 1.01 0.62 -4.38 120.40 121.28 2oel s VAL 4 Ca -0.11 1.52 -0.08 0.00 0.00 0.00 0.00 61.98 63.32 2oel s VAL 4 Cb -0.04 -4.07 -0.02 0.00 0.00 0.00 0.00 36.38 32.24 2oel s VAL 4 CO 0.04 0.27 0.08 -0.32 0.00 0.00 0.00 175.10 175.17 2oel s MET 5 N 0.63 3.56 -0.12 2.72 0.00 -0.45 -0.07 119.30 125.57 2oel s MET 5 Ca 0.39 -0.54 -0.08 0.00 0.00 0.00 0.00 55.69 55.46 2oel s MET 5 Cb -0.19 -3.36 -0.04 0.00 0.00 0.00 0.00 34.83 31.24 2oel s MET 5 CO 0.20 -0.24 0.17 0.00 0.00 0.00 0.00 175.02 175.14 2oel s ALA 6 N 1.61 3.85 -0.18 4.11 0.00 -0.05 -1.14 121.76 129.96 2oel s ALA 6 Ca 0.06 -0.60 -0.03 0.00 0.00 0.00 0.00 51.96 51.39 2oel s ALA 6 Cb -0.16 -2.03 -0.01 0.00 0.00 0.00 0.00 23.12 20.93 2oel s ALA 6 CO 0.04 0.57 -0.07 0.99 0.00 0.00 0.00 175.76 177.29 2oel s THR 7 N -0.92 3.37 0.22 0.00 2.01 -0.32 -1.17 115.64 118.83 2oel s THR 7 Ca 0.15 -0.52 0.10 0.00 0.31 0.00 0.00 61.69 61.73 2oel s THR 7 Cb -0.12 -2.49 -0.05 0.00 0.01 0.00 0.00 72.50 69.85 2oel s THR 7 CO 0.04 0.47 -0.18 -0.31 -0.69 0.00 0.00 174.62 173.95 2oel s TYR 8 N 0.87 2.00 -0.23 4.92 2.02 0.10 -0.35 117.35 126.68 2oel s TYR 8 Ca -0.02 -0.44 -0.03 0.00 -0.37 0.00 0.00 57.07 56.21 2oel s TYR 8 Cb -0.15 -0.93 0.01 0.00 -0.40 0.00 0.00 41.96 40.49 2oel s TYR 8 CO 0.01 0.48 -0.05 -1.17 -1.57 0.00 0.00 175.55 173.25 2oel s LEU 9 N -3.12 3.02 0.02 -1.29 2.96 -0.36 -0.53 118.68 119.39 2oel s LEU 9 Ca 0.23 -0.62 0.06 0.00 -0.22 0.00 0.00 54.13 53.58 2oel s LEU 9 Cb -0.04 -1.70 -0.03 0.00 0.50 0.00 0.00 46.19 44.91 2oel s LEU 9 CO 0.10 -0.07 -0.15 -0.76 -1.32 0.00 0.00 176.35 174.14 2oel s LEU 10 N 1.41 2.73 -0.06 -0.68 1.02 0.04 -1.86 118.68 121.28 2oel s LEU 10 Ca 0.03 -0.33 0.04 0.00 0.02 0.00 0.00 54.13 53.89 2oel s LEU 10 Cb -0.15 -1.58 0.00 0.00 0.02 0.00 0.00 46.19 44.48 2oel s LEU 10 CO -0.04 0.28 -0.17 -1.00 0.02 0.00 0.00 176.35 175.43 2oel s HIS 11 N -0.90 1.83 -0.00 0.29 3.76 -1.06 -1.83 115.29 117.37 2oel s HIS 11 Ca 0.15 -0.64 -0.29 0.00 -0.15 0.00 0.00 55.06 54.13 2oel s HIS 11 Cb -0.11 -1.26 0.10 0.00 1.11 0.00 0.00 32.58 32.43 2oel s HIS 11 CO 0.05 -0.26 0.93 0.34 -0.85 0.00 0.00 174.74 174.94 2oel s ASP 12 N 0.33 -0.32 -0.00 1.40 2.15 -0.45 -4.43 116.67 115.33 2oel s ASP 12 Ca -0.11 -0.05 0.17 0.00 0.43 0.00 0.00 52.55 52.99 2oel s ASP 12 Cb -0.15 0.37 -0.20 0.00 -0.30 0.00 0.00 42.92 42.65 2oel s ASP 12 CO 0.04 -0.62 0.66 -1.84 -0.17 0.00 0.00 175.17 173.24 2oel n GLU 13 N -0.26 1.20 -3.80 4.34 0.28 -1.26 0.58 120.64 121.72 2oel n GLU 13 Ca -0.08 -0.03 -0.21 0.00 -0.16 0.00 0.00 57.16 56.69 2oel n GLU 13 Cb 0.61 -1.33 -0.02 0.00 1.43 0.00 0.00 31.44 32.13 2oel n GLU 13 CO 0.00 0.00 0.00 0.95 -0.16 0.00 0.00 177.13 177.92 2oel s THR 14 N -2.73 4.32 -0.26 3.84 -4.23 -1.26 -4.94 115.64 110.38 2oel s THR 14 Ca 0.04 -1.16 -0.39 0.00 -1.18 0.00 0.00 61.69 59.00 2oel s THR 14 Cb 0.13 -3.47 -0.15 0.00 1.34 0.00 0.00 72.50 70.35 2oel s THR 14 CO 0.71 -0.24 1.81 -0.67 -0.54 0.00 0.00 174.62 175.69 2oel n ASP 15 N -1.43 2.55 -0.18 3.99 2.03 -1.26 -4.87 116.55 117.38 2oel n ASP 15 Ca -0.04 1.00 -0.09 0.00 0.52 0.00 0.00 54.79 56.18 2oel n ASP 15 Cb 0.58 -1.19 0.01 0.00 -0.72 0.00 0.00 41.12 39.80 2oel n ASP 15 CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 2oel h ILE 16 N 5.45 1.25 -0.88 5.18 1.08 -1.95 -2.74 117.51 124.90 2oel h ILE 16 Ca -0.45 -0.91 0.02 0.00 -0.39 0.00 0.00 64.86 63.13 2oel h ILE 16 Cb 1.31 0.85 -0.05 0.00 -3.07 0.00 0.00 36.82 35.87 2oel h ILE 16 CO 0.97 0.33 0.58 -0.09 -0.69 0.00 0.00 178.15 179.25 2oel h ARG 17 N 0.72 1.13 0.19 2.37 2.43 -1.99 0.26 114.38 119.48 2oel h ARG 17 Ca 0.16 -0.07 -0.01 0.00 -0.81 0.00 0.00 59.98 59.25 2oel h ARG 17 Cb 0.38 -0.25 -0.00 0.00 -0.42 0.00 0.00 29.97 29.67 2oel h ARG 17 CO 0.01 0.75 -0.11 0.87 -1.51 0.00 0.00 179.97 179.98 2oel h LYS 18 N 1.16 -0.27 -0.74 0.20 1.57 -1.90 -1.08 116.57 115.51 2oel h LYS 18 Ca 0.33 0.02 0.03 0.00 -1.87 0.00 0.00 60.65 59.16 2oel h LYS 18 Cb -0.09 0.06 -0.04 0.00 0.08 0.00 0.00 32.23 32.24 2oel h LYS 18 CO -0.08 -0.18 0.47 -0.22 -0.57 0.00 0.00 179.45 178.87 2oel h LYS 19 N -0.28 0.90 -0.08 3.15 3.64 -1.13 -0.77 116.57 122.00 2oel h LYS 19 Ca -0.02 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 2oel h LYS 19 Cb 0.23 -0.20 -0.00 0.00 -0.41 0.00 0.00 32.23 31.84 2oel h LYS 19 CO 0.03 0.60 0.05 0.00 -2.27 0.00 0.00 179.45 177.86 2oel h ALA 20 N 1.31 0.10 -0.71 5.00 0.00 -0.71 0.33 119.26 124.58 2oel h ALA 20 Ca 0.29 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.16 2oel h ALA 20 Cb -0.00 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 2oel h ALA 20 CO -0.10 -0.40 0.31 0.93 0.00 0.00 0.00 179.25 179.99 2oel h GLU 21 N 0.11 1.04 -0.80 0.00 4.39 -0.94 -0.54 114.58 117.83 2oel h GLU 21 Ca 0.03 -0.16 -0.01 0.00 0.34 0.00 0.00 59.36 59.56 2oel h GLU 21 Cb -0.01 -0.18 -0.04 0.00 -0.10 0.00 0.00 28.75 28.42 2oel h GLU 21 CO -0.01 0.82 0.47 0.78 -1.16 0.00 0.00 179.01 179.91 2oel h GLY 22 N 1.08 1.17 0.79 -3.84 0.00 -0.58 -1.12 103.07 100.58 2oel h GLY 22 Ca 0.24 -0.50 -0.04 0.00 0.00 0.00 0.00 47.33 47.03 2oel h GLY 22 CO -0.03 0.49 -0.03 -2.22 0.00 0.00 0.00 176.54 174.75 2oel h ILE 23 N 1.10 1.28 -0.57 2.60 2.04 -0.41 0.39 117.51 123.94 2oel h ILE 23 Ca 0.29 -0.98 0.05 0.00 1.00 0.00 0.00 64.86 65.22 2oel h ILE 23 Cb -0.02 1.57 -0.05 0.00 -0.74 0.00 0.00 36.82 37.58 2oel h ILE 23 CO -0.05 0.29 0.29 0.00 0.00 0.00 0.00 178.15 178.68 2oel h ALA 24 N 0.73 0.74 0.02 1.87 0.00 -0.87 -1.03 119.26 120.73 2oel h ALA 24 Ca 0.05 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 2oel h ALA 24 Cb 0.46 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2oel h ALA 24 CO 0.02 -0.05 -0.01 1.25 0.00 0.00 0.00 179.25 180.45 2oel h LEU 25 N 0.55 -0.03 -1.25 0.00 5.85 -1.18 -3.28 115.31 115.98 2oel h LEU 25 Ca 0.25 -0.58 0.12 0.00 0.84 0.00 0.00 57.88 58.51 2oel h LEU 25 Cb 0.17 0.01 -0.07 0.00 0.37 0.00 0.00 40.66 41.14 2oel h LEU 25 CO -0.18 0.74 0.57 1.23 -0.34 0.00 0.00 178.44 180.47 2oel h GLY 26 N -0.97 1.24 -1.49 3.75 0.00 -0.24 0.53 103.07 105.89 2oel h GLY 26 Ca -0.00 -0.33 0.00 0.00 0.00 0.00 0.00 47.33 47.00 2oel h GLY 26 CO 0.01 0.14 0.00 1.04 0.00 0.00 0.00 176.54 177.73 2oel n LEU 27 N -4.55 2.17 0.00 3.11 4.77 -0.39 -4.41 117.00 117.70 2oel n LEU 27 Ca 0.16 -1.09 0.00 0.00 -0.03 0.00 0.00 56.01 55.05 2oel n LEU 27 Cb 0.39 -0.29 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 2oel n LEU 27 CO 0.30 0.50 0.00 0.35 -1.33 0.00 0.00 177.39 177.21 2oel n THR 28 N 0.58 0.00 0.60 -5.08 -2.24 -0.44 -4.99 114.28 102.72 2oel n THR 28 Ca 0.13 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 62.03 2oel n THR 28 Cb 0.36 0.00 0.26 0.00 -2.10 0.00 0.00 70.33 68.85 2oel n THR 28 CO 0.00 0.00 0.00 2.30 -0.57 0.00 0.00 175.07 176.80 2oel n ILE 29 N 0.00 0.43 0.00 2.28 -5.35 -1.11 -4.96 119.36 110.65 2oel n ILE 29 Ca 0.00 -0.27 0.00 0.00 -0.27 0.00 0.00 62.75 62.21 2oel n ILE 29 Cb 0.00 -0.29 0.00 0.00 -1.74 0.00 0.00 39.64 37.61 2oel n ILE 29 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2oel n GLY 30 N 1.33 1.56 3.17 3.28 0.00 0.05 -4.87 105.19 109.71 2oel n GLY 30 Ca 0.04 -0.04 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 2oel n GLY 30 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2oel s THR 31 N 0.00 0.97 0.03 2.61 -4.23 -1.26 -4.63 115.64 109.13 2oel s THR 31 Ca 0.00 -1.50 0.00 0.00 -1.18 0.00 0.00 61.69 59.01 2oel s THR 31 Cb 0.00 -1.21 0.00 0.00 1.34 0.00 0.00 72.50 72.63 2oel s THR 31 CO 0.00 -0.44 0.00 1.87 -0.54 0.00 0.00 174.62 175.51 2oel n TRP 32 N 0.84 -1.14 -0.14 3.99 -0.00 -1.26 -4.91 117.44 114.83 2oel n TRP 32 Ca -0.18 0.07 0.03 0.00 -0.00 0.00 0.00 57.50 57.42 2oel n TRP 32 Cb 0.56 0.62 0.32 0.00 -0.00 0.00 0.00 31.31 32.81 2oel n TRP 32 CO 0.00 0.00 0.00 1.79 -0.00 0.00 0.00 177.69 179.48 2oel h THR 33 N 0.00 1.13 -0.00 5.87 1.35 -2.02 -2.14 112.91 117.10 2oel h THR 33 Ca 0.00 -0.28 0.00 0.00 -0.55 0.00 0.00 66.41 65.58 2oel h THR 33 Cb 0.00 0.24 0.00 0.00 -1.73 0.00 0.00 68.15 66.66 2oel h THR 33 CO 0.00 0.15 -0.02 0.47 -0.25 0.00 0.00 175.52 175.87 2oel n ASP 34 N -4.45 0.20 -4.79 5.36 9.92 -1.26 -4.87 116.55 116.66 2oel n ASP 34 Ca 0.07 -0.73 -0.39 0.00 -0.53 0.00 0.00 54.79 53.21 2oel n ASP 34 Cb 0.08 -0.09 -0.06 0.00 -0.64 0.00 0.00 41.12 40.41 2oel n ASP 34 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 2oel s LEU 35 N -2.24 4.53 0.49 0.64 1.02 -0.81 -5.05 118.68 117.26 2oel s LEU 35 Ca 0.39 1.42 -0.23 0.00 0.02 0.00 0.00 54.13 55.72 2oel s LEU 35 Cb 0.21 -3.08 -0.07 0.00 0.02 0.00 0.00 46.19 43.27 2oel s LEU 35 CO 0.41 0.21 1.27 -2.84 0.02 0.00 0.00 176.35 175.42 2oel s PRO 36 N -0.92 3.54 0.48 1.29 0.02 -1.26 -4.70 135.00 133.45 2oel s PRO 36 Ca 0.33 2.03 0.34 0.00 0.02 0.00 0.00 61.00 63.72 2oel s PRO 36 Cb -0.21 -2.41 1.47 0.00 0.02 0.00 0.00 34.50 33.38 2oel s PRO 36 CO 0.22 -0.81 1.67 0.00 -0.33 0.00 0.00 177.00 177.75 2oel h ALA 37 N 1.91 2.99 -0.48 -1.55 0.00 -1.97 0.44 119.26 120.60 2oel h ALA 37 Ca -0.50 0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.32 2oel h ALA 37 Cb 1.27 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.19 2oel h ALA 37 CO 0.59 -1.51 -0.19 1.25 0.00 0.00 0.00 179.25 179.39 2oel h LEU 38 N 0.09 0.99 -0.19 0.00 5.85 -2.01 -2.67 115.31 117.38 2oel h LEU 38 Ca 0.76 -0.36 -0.22 0.00 0.84 0.00 0.00 57.88 58.90 2oel h LEU 38 Cb 2.61 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 43.38 2oel h LEU 38 CO -0.23 1.14 -0.91 -0.33 -0.34 0.00 0.00 178.44 177.78 2oel h GLU 39 N 0.84 0.48 -0.39 1.25 5.08 -0.51 -3.04 114.58 118.30 2oel h GLU 39 Ca 0.12 -0.48 0.01 0.00 -1.00 0.00 0.00 59.36 58.01 2oel h GLU 39 Cb 0.75 0.13 -0.02 0.00 0.50 0.00 0.00 28.75 30.11 2oel h GLU 39 CO 0.06 1.12 0.24 1.96 -1.00 0.00 0.00 179.01 181.39 2oel h GLN 40 N 0.28 0.47 -0.16 2.33 4.20 -1.21 0.35 115.11 121.38 2oel h GLN 40 Ca -0.08 -0.03 -0.04 0.00 0.06 0.00 0.00 58.65 58.56 2oel h GLN 40 Cb 1.53 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 29.20 2oel h GLN 40 CO 0.16 0.31 -0.09 1.49 -0.67 0.00 0.00 178.83 180.04 2oel h GLU 41 N 0.49 0.25 -0.04 1.46 4.57 -1.54 0.40 114.58 120.16 2oel h GLU 41 Ca 0.15 -0.05 -0.23 0.00 -1.18 0.00 0.00 59.36 58.05 2oel h GLU 41 Cb -0.03 -0.04 0.01 0.00 -0.16 0.00 0.00 28.75 28.54 2oel h GLU 41 CO -0.05 0.35 -0.90 0.37 -1.18 0.00 0.00 179.01 177.59 2oel h GLN 42 N 0.24 0.57 -0.02 1.92 5.75 -1.20 -3.29 115.11 119.08 2oel h GLN 42 Ca 0.05 -0.55 0.00 0.00 -0.15 0.00 0.00 58.65 58.00 2oel h GLN 42 Cb 0.31 0.14 0.00 0.00 1.07 0.00 0.00 27.48 29.00 2oel h GLN 42 CO 0.02 1.18 -0.10 1.28 -2.65 0.00 0.00 178.83 178.55 2oel n LEU 43 N -3.83 2.05 -0.18 -2.39 4.77 0.11 -4.38 117.00 113.15 2oel n LEU 43 Ca -0.08 -0.68 -0.00 0.00 -0.03 0.00 0.00 56.01 55.22 2oel n LEU 43 Cb 0.81 -0.02 0.09 0.00 -2.33 0.00 0.00 43.42 41.97 2oel n LEU 43 CO 0.52 0.35 0.88 -0.09 -1.33 0.00 0.00 177.39 177.72 2oel h ARG 44 N 3.06 0.18 -0.99 3.23 9.65 -0.28 -0.96 114.38 128.27 2oel h ARG 44 Ca 0.00 -0.01 0.23 0.00 -1.10 0.00 0.00 59.98 59.10 2oel h ARG 44 Cb 0.71 -0.04 -0.09 0.00 -1.39 0.00 0.00 29.97 29.17 2oel h ARG 44 CO 0.00 0.12 0.64 0.87 2.80 0.00 0.00 179.97 184.40 2oel h LYS 45 N 0.19 0.45 -0.01 0.20 1.57 -1.81 -1.86 116.57 115.30 2oel h LYS 45 Ca 0.29 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.04 2oel h LYS 45 Cb 0.44 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.65 2oel h LYS 45 CO -0.42 0.29 -0.27 0.72 -0.57 0.00 0.00 179.45 179.21 2oel n HIS 46 N -4.60 0.00 -2.46 -1.35 8.25 -0.38 -4.73 115.22 109.94 2oel n HIS 46 Ca 0.23 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.27 2oel n HIS 46 Cb 0.77 -0.16 -0.03 0.00 1.12 0.00 0.00 29.99 31.69 2oel n HIS 46 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 2oel s LYS 47 N -2.59 4.36 0.57 -0.41 2.20 -0.70 -4.12 119.74 119.05 2oel s LYS 47 Ca 0.23 1.68 -0.14 0.00 -0.36 0.00 0.00 55.97 57.38 2oel s LYS 47 Cb 0.19 -3.54 -0.06 0.00 -1.51 0.00 0.00 37.83 32.92 2oel s LYS 47 CO 0.54 -0.42 1.01 0.20 -0.36 0.00 0.00 175.35 176.32 2oel s GLY 48 N 1.43 1.86 -0.01 5.54 0.00 -1.24 -4.70 107.32 110.20 2oel s GLY 48 Ca 0.56 0.05 -0.07 0.00 0.00 0.00 0.00 44.72 45.27 2oel s GLY 48 CO 0.23 0.33 0.14 -0.54 0.00 0.00 0.00 173.10 173.25 2oel s GLU 49 N -4.63 0.41 -0.41 2.90 0.41 -0.97 -4.55 118.70 111.86 2oel s GLU 49 Ca 0.57 -0.27 -0.27 0.00 -0.41 0.00 0.00 54.97 54.59 2oel s GLU 49 Cb -0.11 0.17 0.02 0.00 -1.78 0.00 0.00 34.13 32.44 2oel s GLU 49 CO 0.43 -0.09 1.01 0.08 -0.49 0.00 0.00 175.26 176.19 2oel s VAL 50 N -1.07 4.45 0.03 2.63 1.01 -1.26 -0.47 120.40 125.72 2oel s VAL 50 Ca -0.12 1.20 -0.18 0.00 0.00 0.00 0.00 61.98 62.89 2oel s VAL 50 Cb -0.06 -4.44 -0.25 0.00 0.00 0.00 0.00 36.38 31.63 2oel s VAL 50 CO 0.01 -0.71 1.10 0.58 0.00 0.00 0.00 175.10 176.09 2oel h VAL 51 N 5.96 1.37 -2.48 2.92 2.07 -0.26 -3.48 116.25 122.36 2oel h VAL 51 Ca -0.23 -2.22 0.05 0.00 0.82 0.00 0.00 66.70 65.12 2oel h VAL 51 Cb 1.07 2.61 -0.15 0.00 -1.52 0.00 0.00 31.29 33.30 2oel h VAL 51 CO 1.04 0.66 0.38 0.00 0.02 0.00 0.00 177.57 179.67 2oel s ALA 52 N -3.13 -1.75 -0.12 1.67 0.00 -1.08 -4.98 121.76 112.37 2oel s ALA 52 Ca -0.12 0.88 -0.04 0.00 0.00 0.00 0.00 51.96 52.69 2oel s ALA 52 Cb 0.04 0.50 0.05 0.00 0.00 0.00 0.00 23.12 23.71 2oel s ALA 52 CO 0.87 -0.68 0.07 0.42 0.00 0.00 0.00 175.76 176.44 2oel s ILE 53 N -3.12 -0.06 -0.42 0.00 1.01 -1.26 -1.08 121.20 116.26 2oel s ILE 53 Ca 0.02 0.06 -0.11 0.00 0.00 0.00 0.00 60.65 60.62 2oel s ILE 53 Cb -0.01 -0.43 0.06 0.00 0.01 0.00 0.00 42.46 42.10 2oel s ILE 53 CO -0.09 -0.09 0.29 -0.70 0.00 0.00 0.00 174.94 174.35 2oel s GLU 54 N 2.14 2.76 0.21 2.79 2.12 0.24 -4.94 118.70 124.01 2oel s GLU 54 Ca 0.03 -1.34 -0.30 0.00 0.36 0.00 0.00 54.97 53.72 2oel s GLU 54 Cb -0.14 -3.87 -0.09 0.00 0.26 0.00 0.00 34.13 30.29 2oel s GLU 54 CO -0.07 -0.92 1.26 -1.21 -0.54 0.00 0.00 175.26 173.79 2oel s GLU 55 N 1.52 4.44 0.37 4.30 2.02 -1.26 -0.97 118.70 129.12 2oel s GLU 55 Ca 0.03 1.99 0.08 0.00 0.02 0.00 0.00 54.97 57.09 2oel s GLU 55 Cb -0.22 -3.20 -0.04 0.00 0.10 0.00 0.00 34.13 30.76 2oel s GLU 55 CO 0.04 -0.16 0.20 -0.51 0.02 0.00 0.00 175.26 174.85 2oel s LEU 56 N -0.36 3.26 0.16 1.80 1.43 0.31 -4.94 118.68 120.32 2oel s LEU 56 Ca 0.54 -0.85 -0.30 0.00 -1.03 0.00 0.00 54.13 52.49 2oel s LEU 56 Cb -0.35 -1.73 -0.07 0.00 0.03 0.00 0.00 46.19 44.07 2oel s LEU 56 CO 0.39 -0.44 1.20 -0.83 0.23 0.00 0.00 176.35 176.90 2oel s GLY 57 N -3.92 2.60 0.40 -3.19 0.00 -1.26 -4.40 107.32 97.55 2oel s GLY 57 Ca 0.41 0.93 -0.27 0.00 0.00 0.00 0.00 44.72 45.78 2oel s GLY 57 CO 0.24 1.90 1.40 -2.21 0.00 0.00 0.00 173.10 174.43 2oel n GLU 58 N 2.85 2.34 -3.75 2.90 2.13 -1.26 -4.77 120.64 121.07 2oel n GLU 58 Ca 0.05 0.82 -0.37 0.00 0.66 0.00 0.00 57.16 58.33 2oel n GLU 58 Cb 0.45 -2.55 -0.12 0.00 0.27 0.00 0.00 31.44 29.49 2oel n GLU 58 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 2oel s SER 59 N -0.33 5.29 0.16 4.31 0.15 -1.26 -4.99 113.70 117.04 2oel s SER 59 Ca 0.57 -0.16 -0.16 0.00 0.70 0.00 0.00 55.95 56.90 2oel s SER 59 Cb -0.49 -1.95 0.03 0.00 -1.71 0.00 0.00 66.02 61.90 2oel s SER 59 CO 0.61 -0.02 1.81 -0.33 1.20 0.00 0.00 173.24 176.51 2oel h GLU 60 N 8.15 0.54 -0.45 5.44 4.39 -1.98 0.66 114.58 131.34 2oel h GLU 60 Ca -0.38 -0.03 0.03 0.00 0.34 0.00 0.00 59.36 59.32 2oel h GLU 60 Cb 1.18 -0.12 -0.04 0.00 -0.10 0.00 0.00 28.75 29.67 2oel h GLU 60 CO 0.58 0.36 0.23 -0.09 -1.16 0.00 0.00 179.01 178.93 2oel h ARG 61 N 0.55 0.45 -0.35 2.33 2.43 -1.99 0.86 114.38 118.66 2oel h ARG 61 Ca 0.16 -0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.26 2oel h ARG 61 Cb -0.05 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.39 2oel h ARG 61 CO -0.05 0.30 0.05 0.28 -1.51 0.00 0.00 179.97 179.04 2oel h VAL 62 N 0.46 1.24 -0.87 0.20 2.07 -1.89 -1.81 116.25 115.66 2oel h VAL 62 Ca 0.19 -0.86 -0.02 0.00 0.82 0.00 0.00 66.70 66.83 2oel h VAL 62 Cb 0.08 1.13 -0.04 0.00 -1.52 0.00 0.00 31.29 30.94 2oel h VAL 62 CO -0.13 0.29 0.45 0.78 0.02 0.00 0.00 177.57 178.99 2oel h ASN 63 N 0.42 1.11 -0.68 0.57 2.35 -0.48 -1.29 115.58 117.58 2oel h ASN 63 Ca 0.11 -0.11 -0.08 0.00 -0.55 0.00 0.00 56.30 55.66 2oel h ASN 63 Cb 0.37 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 38.44 2oel h ASN 63 CO 0.01 0.90 0.11 0.00 -1.65 0.00 0.00 177.43 176.80 2oel h ALA 64 N 1.27 0.90 -0.09 -0.83 0.00 -0.69 0.41 119.26 120.23 2oel h ALA 64 Ca 0.30 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 2oel h ALA 64 Cb 0.06 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 2oel h ALA 64 CO -0.04 0.67 0.03 -0.92 0.00 0.00 0.00 179.25 178.99 2oel h TYR 65 N 1.05 0.14 0.00 0.00 3.20 -0.85 -3.01 116.97 117.49 2oel h TYR 65 Ca 0.21 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.06 2oel h TYR 65 Cb 0.45 -0.04 0.00 0.00 1.54 0.00 0.00 36.73 38.68 2oel h TYR 65 CO 0.03 0.27 -0.05 0.74 -1.64 0.00 0.00 178.16 177.51 2oel h PHE 66 N -0.03 0.00 -0.32 -3.82 0.04 -1.17 -3.47 116.94 108.17 2oel h PHE 66 Ca 0.03 0.00 -0.14 0.00 2.80 0.00 0.00 57.97 60.66 2oel h PHE 66 Cb 0.19 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.29 2oel h PHE 66 CO -0.01 0.00 -0.13 0.41 -0.60 0.00 0.00 178.31 177.98 2oel n GLY 67 N 1.29 0.89 3.29 -1.45 0.00 0.14 -4.99 105.19 104.35 2oel n GLY 67 Ca 0.05 -0.62 -0.09 0.00 0.00 0.00 0.00 46.02 45.36 2oel n GLY 67 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oel s LYS 68 N -2.42 1.02 -0.34 1.61 1.02 -0.81 -5.01 119.74 114.81 2oel s LYS 68 Ca 0.00 -1.02 -0.22 0.00 0.02 0.00 0.00 55.97 54.76 2oel s LYS 68 Cb 0.00 0.38 0.00 0.00 -0.52 0.00 0.00 37.83 37.69 2oel s LYS 68 CO 0.00 -0.36 0.71 1.03 -0.92 0.00 0.00 175.35 175.80 2oel s ARG 69 N -3.90 3.78 -0.15 1.68 0.52 -1.26 -4.22 118.95 115.40 2oel s ARG 69 Ca 0.10 0.25 0.00 0.00 -0.52 0.00 0.00 55.73 55.57 2oel s ARG 69 Cb 0.04 -3.78 -0.00 0.00 0.52 0.00 0.00 34.95 31.72 2oel s ARG 69 CO -0.06 -0.74 -0.15 -0.51 0.02 0.00 0.00 175.30 173.86 2oel s LEU 70 N 2.86 2.51 0.38 2.53 1.43 -1.26 -4.50 118.68 122.62 2oel s LEU 70 Ca 0.28 -0.44 -0.24 0.00 -1.03 0.00 0.00 54.13 52.70 2oel s LEU 70 Cb -0.14 -1.57 -0.10 0.00 0.03 0.00 0.00 46.19 44.42 2oel s LEU 70 CO 0.15 0.11 0.99 -0.54 0.23 0.00 0.00 176.35 177.28 2oel s LYS 71 N 0.68 4.32 0.06 1.70 1.02 0.20 -4.50 119.74 123.20 2oel s LYS 71 Ca -0.07 1.36 0.09 0.00 0.02 0.00 0.00 55.97 57.36 2oel s LYS 71 Cb -0.16 -2.54 -0.03 0.00 -0.52 0.00 0.00 37.83 34.58 2oel s LYS 71 CO 0.02 0.02 -0.24 1.03 -0.92 0.00 0.00 175.35 175.26 2oel s ARG 72 N -2.51 1.58 -0.03 1.68 0.52 -1.26 -1.35 118.95 117.59 2oel s ARG 72 Ca 0.56 -1.08 -0.29 0.00 -0.52 0.00 0.00 55.73 54.41 2oel s ARG 72 Cb -0.18 -1.77 0.09 0.00 0.52 0.00 0.00 34.95 33.61 2oel s ARG 72 CO 0.23 0.45 0.78 0.00 0.02 0.00 0.00 175.30 176.78 2oel s ALA 73 N -0.84 -1.79 -0.26 2.13 0.00 -0.76 -0.53 121.76 119.70 2oel s ALA 73 Ca 0.10 1.17 -0.10 0.00 0.00 0.00 0.00 51.96 53.13 2oel s ALA 73 Cb -0.10 0.07 -0.04 0.00 0.00 0.00 0.00 23.12 23.05 2oel s ALA 73 CO 0.02 -0.49 0.15 0.42 0.00 0.00 0.00 175.76 175.87 2oel s ILE 74 N -2.00 5.05 -0.09 0.00 1.01 -0.14 -0.78 121.20 124.24 2oel s ILE 74 Ca -0.04 0.08 0.01 0.00 0.00 0.00 0.00 60.65 60.70 2oel s ILE 74 Cb -0.00 -3.38 -0.02 0.00 0.01 0.00 0.00 42.46 39.06 2oel s ILE 74 CO 0.00 0.29 -0.13 -0.69 0.00 0.00 0.00 174.94 174.42 2oel s VAL 75 N 1.60 3.16 -0.16 2.92 1.01 0.31 -0.59 120.40 128.65 2oel s VAL 75 Ca 0.07 -0.66 0.01 0.00 0.00 0.00 0.00 61.98 61.40 2oel s VAL 75 Cb -0.15 -2.29 0.00 0.00 0.00 0.00 0.00 36.38 33.94 2oel s VAL 75 CO 0.08 0.56 -0.17 -0.54 0.00 0.00 0.00 175.10 175.03 2oel s LYS 76 N -0.21 3.15 -0.05 2.72 1.02 -0.25 0.01 119.74 126.13 2oel s LYS 76 Ca 0.01 -0.78 0.05 0.00 0.02 0.00 0.00 55.97 55.27 2oel s LYS 76 Cb -0.13 -2.61 -0.01 0.00 -0.52 0.00 0.00 37.83 34.57 2oel s LYS 76 CO 0.03 -0.05 -0.21 0.42 -0.92 0.00 0.00 175.35 174.63 2oel s ILE 77 N 0.95 1.72 -0.23 2.17 1.01 -0.32 0.54 121.20 127.04 2oel s ILE 77 Ca -0.03 -0.88 -0.14 0.00 0.00 0.00 0.00 60.65 59.61 2oel s ILE 77 Cb -0.15 -1.47 -0.04 0.00 0.01 0.00 0.00 42.46 40.81 2oel s ILE 77 CO -0.03 0.49 0.31 0.00 0.00 0.00 0.00 174.94 175.70 2oel s ALA 78 N -0.02 3.58 -0.27 9.38 0.00 0.38 -0.87 121.76 133.93 2oel s ALA 78 Ca -0.05 -0.71 -0.03 0.00 0.00 0.00 0.00 51.96 51.17 2oel s ALA 78 Cb -0.13 -2.53 0.03 0.00 0.00 0.00 0.00 23.12 20.49 2oel s ALA 78 CO 0.03 -0.32 -0.01 0.71 0.00 0.00 0.00 175.76 176.17 2oel s TYR 79 N 1.34 3.13 0.16 0.00 2.02 0.89 -2.30 117.35 122.59 2oel s TYR 79 Ca 0.14 -1.48 -0.33 0.00 -0.37 0.00 0.00 57.07 55.03 2oel s TYR 79 Cb -0.14 -2.12 -0.13 0.00 -0.40 0.00 0.00 41.96 39.16 2oel s TYR 79 CO 0.07 -0.71 1.62 -2.30 -1.57 0.00 0.00 175.55 172.66 2oel n PRO 80 N 4.71 2.29 0.09 -1.71 -0.02 -1.26 -0.28 135.00 138.81 2oel n PRO 80 Ca -0.15 0.82 0.09 0.00 -2.02 0.00 0.00 63.50 62.24 2oel n PRO 80 Cb 0.46 -2.61 0.41 0.00 -0.02 0.00 0.00 33.50 31.74 2oel n PRO 80 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2oel n THR 81 N 3.59 1.03 1.11 3.45 -2.24 -0.87 -1.56 114.28 118.80 2oel n THR 81 Ca 0.17 0.35 0.13 0.00 -2.27 0.00 0.00 64.05 62.42 2oel n THR 81 Cb 0.30 -1.25 0.62 0.00 -2.10 0.00 0.00 70.33 67.90 2oel n THR 81 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 2oel n VAL 82 N -1.97 0.19 0.15 2.28 0.24 -1.26 -3.23 118.33 114.74 2oel n VAL 82 Ca 0.02 0.05 0.09 0.00 -2.04 0.00 0.00 64.34 62.46 2oel n VAL 82 Cb 0.16 -0.62 0.07 0.00 -1.47 0.00 0.00 33.84 31.98 2oel n VAL 82 CO 0.00 0.00 0.00 0.78 -2.14 0.00 0.00 176.83 175.47 2oel h ASN 83 N 0.00 0.00 -4.99 -1.34 4.21 -1.64 -3.48 115.58 108.35 2oel h ASN 83 Ca 0.00 0.00 -0.16 0.00 1.21 0.00 0.00 56.30 57.35 2oel h ASN 83 Cb 0.31 0.00 -0.15 0.00 -1.12 0.00 0.00 38.32 37.36 2oel h ASN 83 CO 0.00 0.12 -0.69 0.72 -1.29 0.00 0.00 177.43 176.29 2oel s PHE 84 N -3.20 0.64 0.68 1.19 -0.12 -1.20 -5.13 117.98 110.84 2oel s PHE 84 Ca 0.03 -0.97 -0.13 0.00 -0.05 0.00 0.00 56.93 55.81 2oel s PHE 84 Cb 0.07 -0.43 0.01 0.00 -0.63 0.00 0.00 43.02 42.04 2oel s PHE 84 CO 0.74 -0.28 1.08 -1.54 -0.05 0.00 0.00 175.22 175.17 2oel s SER 85 N -2.85 5.18 -1.40 1.98 1.04 -1.26 -4.92 113.70 111.47 2oel s SER 85 Ca 0.07 1.83 -0.15 0.00 0.48 0.00 0.00 55.95 58.18 2oel s SER 85 Cb 0.06 -2.53 0.02 0.00 0.10 0.00 0.00 66.02 63.67 2oel s SER 85 CO -0.07 -1.58 2.21 0.00 0.98 0.00 0.00 173.24 174.77 2oel n ALA 86 N -2.76 5.37 -2.99 5.32 0.00 -1.26 -4.62 120.51 119.57 2oel n ALA 86 Ca 0.09 -3.83 -0.11 0.00 0.00 0.00 0.00 53.44 49.59 2oel n ALA 86 Cb 0.53 -3.55 -0.07 0.00 0.00 0.00 0.00 19.45 16.36 2oel n ALA 86 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 2oel s ASP 87 N 3.35 -0.12 0.30 0.00 1.47 -1.26 -5.01 116.67 115.40 2oel s ASP 87 Ca 0.48 -0.21 0.00 0.00 1.18 0.00 0.00 52.55 54.00 2oel s ASP 87 Cb 0.14 0.36 0.46 0.00 -0.34 0.00 0.00 42.92 43.54 2oel s ASP 87 CO -0.07 -0.62 1.84 -0.07 0.68 0.00 0.00 175.17 176.93 2oel h LEU 88 N 3.18 0.70 -0.87 2.11 3.38 -1.96 -1.98 115.31 119.86 2oel h LEU 88 Ca -0.32 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 57.50 2oel h LEU 88 Cb 1.20 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 41.73 2oel h LEU 88 CO 0.46 0.70 0.42 -0.65 0.09 0.00 0.00 178.44 179.46 2oel h PRO 89 N 0.72 1.23 -0.61 1.13 0.11 -1.97 -0.64 132.00 131.97 2oel h PRO 89 Ca 0.16 -0.18 -0.10 0.00 0.11 0.00 0.00 66.00 65.99 2oel h PRO 89 Cb 0.30 -0.22 -0.02 0.00 0.11 0.00 0.00 31.00 31.16 2oel h PRO 89 CO 0.00 0.94 -0.01 0.00 -0.21 0.00 0.00 178.00 178.72 2oel h ALA 90 N 1.24 0.82 -0.12 -0.75 0.00 -1.78 -1.53 119.26 117.13 2oel h ALA 90 Ca 0.30 -0.32 0.01 0.00 0.00 0.00 0.00 54.91 54.90 2oel h ALA 90 Cb 0.11 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2oel h ALA 90 CO -0.04 0.67 0.04 1.25 0.00 0.00 0.00 179.25 181.18 2oel h LEU 91 N 0.98 0.06 -0.42 0.00 5.85 -0.89 -0.38 115.31 120.51 2oel h LEU 91 Ca 0.17 0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.85 2oel h LEU 91 Cb 0.58 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.59 2oel h LEU 91 CO 0.03 0.05 0.08 -0.07 -0.34 0.00 0.00 178.44 178.20 2oel h LEU 92 N 0.11 0.66 -0.81 2.25 3.38 -0.99 -1.24 115.31 118.66 2oel h LEU 92 Ca 0.05 -0.25 -0.08 0.00 0.09 0.00 0.00 57.88 57.69 2oel h LEU 92 Cb 0.02 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 2oel h LEU 92 CO -0.05 0.74 0.06 0.58 0.09 0.00 0.00 178.44 179.86 2oel h VAL 93 N 0.55 1.25 -0.14 1.22 2.07 -1.20 0.35 116.25 120.36 2oel h VAL 93 Ca 0.13 -1.02 -0.05 0.00 0.82 0.00 0.00 66.70 66.58 2oel h VAL 93 Cb 0.35 0.75 -0.00 0.00 -1.52 0.00 0.00 31.29 30.87 2oel h VAL 93 CO 0.01 0.37 -0.13 0.74 0.02 0.00 0.00 177.57 178.58 2oel h THR 94 N 0.89 1.35 0.00 2.57 2.02 -0.92 -2.41 112.91 116.41 2oel h THR 94 Ca 0.17 -1.28 0.00 0.00 0.77 0.00 0.00 66.41 66.08 2oel h THR 94 Cb 0.44 1.89 0.00 0.00 -1.74 0.00 0.00 68.15 68.74 2oel h THR 94 CO 0.02 0.37 -0.79 0.71 0.37 0.00 0.00 175.52 176.20 2oel h THR 95 N -0.05 0.00 -0.13 3.16 1.35 -1.19 -3.41 112.91 112.63 2oel h THR 95 Ca 0.02 -0.76 -0.22 0.00 -0.55 0.00 0.00 66.41 64.91 2oel h THR 95 Cb 0.65 1.31 -0.20 0.00 -1.73 0.00 0.00 68.15 68.18 2oel h THR 95 CO 0.03 0.00 -0.47 0.33 -0.25 0.00 0.00 175.52 175.16 2oel n PHE 96 N -2.43 -1.63 0.00 4.73 7.35 0.12 -4.89 117.46 120.71 2oel n PHE 96 Ca 0.02 -1.94 0.00 0.00 -0.76 0.00 0.00 57.45 54.76 2oel n PHE 96 Cb 0.50 1.23 0.00 0.00 0.35 0.00 0.00 39.48 41.56 2oel n PHE 96 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2oel n GLY 97 N -0.93 0.44 0.28 7.13 0.00 -0.91 -3.97 105.19 107.23 2oel n GLY 97 Ca -0.07 0.00 0.03 0.00 0.00 0.00 0.00 46.02 45.98 2oel n GLY 97 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2oel h LYS 98 N 0.00 0.43 0.00 1.61 3.64 -1.92 -2.03 116.57 118.30 2oel h LYS 98 Ca 0.00 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.31 2oel h LYS 98 Cb 0.00 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 31.74 2oel h LYS 98 CO 0.00 0.39 -0.07 1.25 -2.27 0.00 0.00 179.45 178.75 2oel h LEU 99 N 0.43 0.00 -0.84 5.20 5.85 -1.90 -0.51 115.31 123.54 2oel h LEU 99 Ca 0.10 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.82 2oel h LEU 99 Cb 0.14 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.17 2oel h LEU 99 CO -0.01 0.07 0.00 -1.54 -0.34 0.00 0.00 178.44 176.62 2oel n SER 100 N -4.22 0.58 -0.41 1.25 3.41 -0.76 -1.55 113.62 111.92 2oel n SER 100 Ca -0.03 0.68 0.11 0.00 -0.26 0.00 0.00 58.87 59.37 2oel n SER 100 Cb 0.15 -0.79 0.03 0.00 -0.26 0.00 0.00 64.21 63.34 2oel n SER 100 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2oel n LEU 101 N -2.18 1.79 -2.98 1.04 4.77 -0.20 -4.72 117.00 114.51 2oel n LEU 101 Ca 0.01 -0.66 -0.32 0.00 -0.03 0.00 0.00 56.01 55.01 2oel n LEU 101 Cb 0.17 -0.02 -0.06 0.00 -2.33 0.00 0.00 43.42 41.18 2oel n LEU 101 CO 0.16 0.34 2.60 -0.67 -1.33 0.00 0.00 177.39 178.49 2oel n ASP 102 N -0.27 7.61 0.00 -1.43 -0.08 -0.60 -4.97 116.55 116.81 2oel n ASP 102 Ca 0.09 -2.75 0.00 0.00 -1.51 0.00 0.00 54.79 50.62 2oel n ASP 102 Cb 0.44 -1.45 0.00 0.00 2.34 0.00 0.00 41.12 42.45 2oel n ASP 102 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2oel n GLY 103 N 2.62 1.98 3.47 0.27 0.00 -1.26 -4.42 105.19 107.86 2oel n GLY 103 Ca 0.64 -0.50 -0.43 0.00 0.00 0.00 0.00 46.02 45.73 2oel n GLY 103 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2oel s GLU 104 N 0.00 3.56 -0.02 1.61 8.01 -1.26 -4.93 118.70 125.66 2oel s GLU 104 Ca 0.00 -1.54 -0.00 0.00 0.01 0.00 0.00 54.97 53.43 2oel s GLU 104 Cb 0.00 -4.96 0.03 0.00 -4.31 0.00 0.00 34.13 24.89 2oel s GLU 104 CO 0.00 -1.87 0.03 0.08 0.01 0.00 0.00 175.26 173.50 2oel s VAL 105 N 3.30 -0.02 -0.07 2.63 1.01 -1.04 -2.57 120.40 123.63 2oel s VAL 105 Ca 0.35 0.21 0.03 0.00 0.00 0.00 0.00 61.98 62.57 2oel s VAL 105 Cb -0.05 -0.12 0.01 0.00 0.00 0.00 0.00 36.38 36.23 2oel s VAL 105 CO -0.08 0.10 -0.15 -0.60 0.00 0.00 0.00 175.10 174.38 2oel s ARG 106 N 1.13 1.95 -0.31 2.72 3.52 -0.78 -4.00 118.95 123.19 2oel s ARG 106 Ca -0.08 -0.52 -0.28 0.00 -0.13 0.00 0.00 55.73 54.72 2oel s ARG 106 Cb -0.13 -1.58 0.01 0.00 -1.56 0.00 0.00 34.95 31.69 2oel s ARG 106 CO -0.03 0.08 1.00 -1.17 -0.81 0.00 0.00 175.30 174.37 2oel s LEU 107 N 0.54 3.99 -0.16 -0.88 2.96 0.08 -1.22 118.68 123.98 2oel s LEU 107 Ca -0.14 0.99 0.03 0.00 -0.22 0.00 0.00 54.13 54.78 2oel s LEU 107 Cb -0.16 -3.42 -0.23 0.00 0.50 0.00 0.00 46.19 42.89 2oel s LEU 107 CO 0.05 -0.79 0.20 0.18 -1.32 0.00 0.00 176.35 174.66 2oel n LEU 108 N 6.63 2.05 -3.56 -0.68 4.77 0.53 -0.82 117.00 125.93 2oel n LEU 108 Ca 0.10 0.11 -0.10 0.00 -0.03 0.00 0.00 56.01 56.09 2oel n LEU 108 Cb 0.47 -0.59 -0.02 0.00 -2.33 0.00 0.00 43.42 40.95 2oel n LEU 108 CO 0.56 0.75 0.50 -0.62 -1.33 0.00 0.00 177.39 177.24 2oel s ASP 109 N -6.49 -0.43 -0.02 -1.43 2.15 -1.09 -4.56 116.67 104.80 2oel s ASP 109 Ca -0.21 -0.16 0.00 0.00 0.43 0.00 0.00 52.55 52.61 2oel s ASP 109 Cb 0.07 0.58 0.02 0.00 -0.30 0.00 0.00 42.92 43.30 2oel s ASP 109 CO 0.74 -0.98 -0.00 -0.76 -0.17 0.00 0.00 175.17 174.00 2oel s LEU 110 N -2.75 1.28 -0.09 -1.34 1.43 -1.26 -1.17 118.68 114.78 2oel s LEU 110 Ca 0.05 -0.02 0.04 0.00 -1.03 0.00 0.00 54.13 53.17 2oel s LEU 110 Cb -0.02 -0.20 -0.00 0.00 0.03 0.00 0.00 46.19 46.00 2oel s LEU 110 CO -0.07 -0.08 -0.24 -1.61 0.23 0.00 0.00 176.35 174.58 2oel s GLU 111 N 0.86 2.94 0.08 1.70 2.02 -0.29 -4.98 118.70 121.02 2oel s GLU 111 Ca -0.09 -0.88 0.07 0.00 0.02 0.00 0.00 54.97 54.10 2oel s GLU 111 Cb -0.12 -2.28 -0.04 0.00 0.10 0.00 0.00 34.13 31.79 2oel s GLU 111 CO -0.02 0.24 -0.15 -0.06 0.02 0.00 0.00 175.26 175.30 2oel s PHE 112 N 0.20 2.64 0.36 1.61 0.08 -1.26 -1.34 117.98 120.26 2oel s PHE 112 Ca -0.14 -0.21 -0.27 0.00 0.12 0.00 0.00 56.93 56.43 2oel s PHE 112 Cb -0.17 -1.43 -0.09 0.00 -0.57 0.00 0.00 43.02 40.76 2oel s PHE 112 CO 0.07 0.36 1.22 -2.14 -0.10 0.00 0.00 175.22 174.63 2oel s PRO 113 N -1.89 4.25 0.31 0.24 0.02 -1.26 -4.83 135.00 131.84 2oel s PRO 113 Ca 0.18 2.00 0.08 0.00 0.02 0.00 0.00 61.00 63.28 2oel s PRO 113 Cb -0.11 -2.91 0.86 0.00 0.02 0.00 0.00 34.50 32.36 2oel s PRO 113 CO 0.10 -0.20 1.70 0.22 -0.33 0.00 0.00 177.00 178.49 2oel h ASP 114 N 3.11 0.51 -0.58 2.53 3.58 -1.99 0.22 116.42 123.79 2oel h ASP 114 Ca -0.49 0.15 0.05 0.00 0.42 0.00 0.00 57.03 57.17 2oel h ASP 114 Cb 1.23 0.09 -0.03 0.00 1.72 0.00 0.00 39.33 42.34 2oel h ASP 114 CO 0.64 0.02 0.39 -0.08 -2.88 0.00 0.00 179.24 177.33 2oel h GLU 115 N 0.46 0.58 0.03 0.28 4.81 -2.01 -2.35 114.58 116.38 2oel h GLU 115 Ca 0.63 -0.03 -0.26 0.00 -0.13 0.00 0.00 59.36 59.56 2oel h GLU 115 Cb 1.24 -0.13 0.02 0.00 0.63 0.00 0.00 28.75 30.51 2oel h GLU 115 CO -0.52 0.38 -1.03 2.35 -0.73 0.00 0.00 179.01 179.46 2oel h TRP 116 N 0.60 0.98 -0.71 0.92 7.01 -0.94 -3.22 115.95 120.59 2oel h TRP 116 Ca 0.24 -0.55 0.09 0.00 2.11 0.00 0.00 58.89 60.78 2oel h TRP 116 Cb 0.21 -0.10 -0.05 0.00 -2.10 0.00 0.00 29.16 27.12 2oel h TRP 116 CO -0.00 1.39 0.47 0.87 -2.79 0.00 0.00 178.44 178.38 2oel h LYS 117 N 0.30 0.61 0.00 2.65 1.57 -0.97 -1.66 116.57 119.07 2oel h LYS 117 Ca -0.14 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.61 2oel h LYS 117 Cb 1.69 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 33.87 2oel h LYS 117 CO 0.20 0.40 0.05 -0.09 -0.57 0.00 0.00 179.45 179.44 2oel h ARG 118 N 0.63 0.00 -0.10 3.15 2.43 -1.45 0.02 114.38 119.07 2oel h ARG 118 Ca 0.32 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.49 2oel h ARG 118 Cb 0.43 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.98 2oel h ARG 118 CO -0.11 0.00 0.00 1.04 -1.51 0.00 0.00 179.97 179.39 2oel n GLN 119 N -2.51 1.48 -4.44 0.20 6.02 -0.63 -4.81 117.38 112.70 2oel n GLN 119 Ca -0.02 -0.72 -0.29 0.00 -0.01 0.00 0.00 57.00 55.96 2oel n GLN 119 Cb 0.09 -1.38 -0.13 0.00 1.02 0.00 0.00 30.24 29.85 2oel n GLN 119 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 2oel s PHE 120 N -1.88 2.40 0.13 1.08 0.08 -0.01 -5.04 117.98 114.74 2oel s PHE 120 Ca 0.32 -0.34 -0.11 0.00 0.12 0.00 0.00 56.93 56.92 2oel s PHE 120 Cb 0.17 -1.31 -0.07 0.00 -0.57 0.00 0.00 43.02 41.24 2oel s PHE 120 CO 0.26 0.32 1.44 -1.00 -0.10 0.00 0.00 175.22 176.14 2oel h PRO 121 N 3.99 0.91 -1.07 0.24 0.13 -1.84 -3.50 132.00 130.87 2oel h PRO 121 Ca -0.50 -0.53 0.13 0.00 -0.87 0.00 0.00 66.00 64.22 2oel h PRO 121 Cb 1.17 0.05 -0.03 0.00 0.13 0.00 0.00 31.00 32.31 2oel h PRO 121 CO 0.42 1.18 -0.19 0.41 -0.23 0.00 0.00 178.00 179.59 2oel n GLY 122 N 0.27 -1.56 3.76 1.56 0.00 -0.30 -4.79 105.19 104.13 2oel n GLY 122 Ca -0.03 -1.41 -0.38 0.00 0.00 0.00 0.00 46.02 44.20 2oel n GLY 122 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2oel s PRO 123 N -1.53 3.52 0.12 1.61 0.02 -1.18 -3.93 135.00 133.63 2oel s PRO 123 Ca 0.00 2.07 -0.02 0.00 0.02 0.00 0.00 61.00 63.08 2oel s PRO 123 Cb 0.00 -2.42 -0.14 0.00 0.02 0.00 0.00 34.50 31.96 2oel s PRO 123 CO 0.00 -0.83 1.27 -0.09 -0.33 0.00 0.00 177.00 177.01 2oel h ARG 124 N 1.92 0.28 0.00 5.54 2.43 -1.87 -3.41 114.38 119.27 2oel h ARG 124 Ca -0.50 -0.36 -0.17 0.00 -0.81 0.00 0.00 59.98 58.14 2oel h ARG 124 Cb 1.27 0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 30.91 2oel h ARG 124 CO 0.59 1.10 -1.57 1.19 -1.51 0.00 0.00 179.97 179.77 2oel n PHE 125 N -3.62 0.00 -3.35 2.20 3.72 -1.26 -5.02 117.46 110.13 2oel n PHE 125 Ca -0.06 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.37 2oel n PHE 125 Cb 0.90 -0.37 -0.01 0.00 -0.94 0.00 0.00 39.48 39.06 2oel n PHE 125 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2oel n GLY 126 N 2.56 -1.68 0.17 1.37 0.00 -1.26 -1.98 105.19 104.37 2oel n GLY 126 Ca -0.19 -1.25 -0.09 0.00 0.00 0.00 0.00 46.02 44.48 2oel n GLY 126 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2oel h ILE 127 N -0.21 0.65 -0.53 -0.61 2.04 -1.13 -0.52 117.51 117.20 2oel h ILE 127 Ca 0.00 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.86 2oel h ILE 127 Cb 0.21 0.65 -0.03 0.00 -0.74 0.00 0.00 36.82 36.92 2oel h ILE 127 CO 0.00 0.00 0.33 0.44 0.00 0.00 0.00 178.15 178.92 2oel h ASP 128 N -0.15 0.63 -0.78 1.72 3.32 -1.86 -0.55 116.42 118.74 2oel h ASP 128 Ca 0.08 -0.05 -0.04 0.00 0.02 0.00 0.00 57.03 57.05 2oel h ASP 128 Cb 0.28 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 39.63 2oel h ASP 128 CO -0.21 0.49 0.33 1.23 -1.72 0.00 0.00 179.24 179.37 2oel h GLY 129 N 0.72 1.23 1.08 2.75 0.00 -1.14 -1.88 103.07 105.83 2oel h GLY 129 Ca 0.19 -0.65 -0.14 0.00 0.00 0.00 0.00 47.33 46.73 2oel h GLY 129 CO -0.04 0.62 -0.29 -2.22 0.00 0.00 0.00 176.54 174.61 2oel h ILE 130 N 1.12 1.28 -0.81 2.60 1.08 -0.81 -1.41 117.51 120.55 2oel h ILE 130 Ca 0.26 -1.45 0.01 0.00 -0.39 0.00 0.00 64.86 63.29 2oel h ILE 130 Cb 0.18 1.33 -0.04 0.00 -3.07 0.00 0.00 36.82 35.22 2oel h ILE 130 CO -0.03 0.49 0.54 0.03 -0.69 0.00 0.00 178.15 178.49 2oel h ARG 131 N 0.72 1.07 -0.26 2.37 3.08 -0.88 -1.38 114.38 119.11 2oel h ARG 131 Ca 0.08 -0.06 -0.13 0.00 0.07 0.00 0.00 59.98 59.93 2oel h ARG 131 Cb 0.87 -0.24 -0.00 0.00 0.08 0.00 0.00 29.97 30.68 2oel h ARG 131 CO 0.08 0.71 -0.35 -0.44 -1.07 0.00 0.00 179.97 178.89 2oel h ASP 132 N 1.10 0.76 -0.41 7.04 3.32 -1.16 0.16 116.42 127.23 2oel h ASP 132 Ca 0.30 -0.50 0.01 0.00 0.02 0.00 0.00 57.03 56.85 2oel h ASP 132 Cb -0.13 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.19 2oel h ASP 132 CO -0.06 1.11 0.27 0.03 -1.72 0.00 0.00 179.24 178.87 2oel h ARG 133 N 0.42 0.53 0.00 3.56 2.47 -0.73 -2.31 114.38 118.32 2oel h ARG 133 Ca 0.03 -0.03 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 2oel h ARG 133 Cb 0.94 -0.12 0.00 0.00 -1.65 0.00 0.00 29.97 29.14 2oel h ARG 133 CO 0.08 0.35 -1.06 1.55 0.56 0.00 0.00 179.97 181.45 2oel n VAL 134 N -4.48 0.01 -2.33 2.04 3.14 -0.57 -4.99 118.33 111.15 2oel n VAL 134 Ca 0.03 -0.07 -0.09 0.00 -2.96 0.00 0.00 64.34 61.25 2oel n VAL 134 Cb 0.07 0.76 0.00 0.00 -1.06 0.00 0.00 33.84 33.62 2oel n VAL 134 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2oel n GLY 135 N 1.46 0.08 2.99 7.55 0.00 0.48 -4.81 105.19 112.95 2oel n GLY 135 Ca 0.03 -0.47 -0.30 0.00 0.00 0.00 0.00 46.02 45.28 2oel n GLY 135 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2oel s VAL 136 N -2.58 1.59 0.29 1.61 1.01 -0.59 -5.02 120.40 116.71 2oel s VAL 136 Ca 0.05 -0.88 0.09 0.00 0.00 0.00 0.00 61.98 61.25 2oel s VAL 136 Cb -0.02 -1.62 -0.04 0.00 0.00 0.00 0.00 36.38 34.70 2oel s VAL 136 CO 0.06 0.25 0.06 -1.00 0.00 0.00 0.00 175.10 174.47 2oel s HIS 137 N 1.44 2.72 0.00 5.22 3.76 -1.26 -4.67 115.29 122.50 2oel s HIS 137 Ca 0.01 -0.28 0.00 0.00 -0.15 0.00 0.00 55.06 54.64 2oel s HIS 137 Cb -0.15 -1.37 0.00 0.00 1.11 0.00 0.00 32.58 32.17 2oel s HIS 137 CO -0.09 0.51 0.00 0.09 -0.85 0.00 0.00 174.74 174.41 2oel n ASN 138 N -1.00 0.00 -4.78 1.40 4.13 -1.26 -4.89 115.26 108.85 2oel n ASN 138 Ca -0.05 0.00 -0.35 0.00 1.68 0.00 0.00 54.58 55.86 2oel n ASN 138 Cb 0.60 0.00 -0.01 0.00 -1.54 0.00 0.00 39.78 38.83 2oel n ASN 138 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2oel s ARG 139 N 0.00 3.51 0.81 3.52 1.70 -1.26 -4.75 118.95 122.48 2oel s ARG 139 Ca 0.00 1.50 -0.12 0.00 -0.47 0.00 0.00 55.73 56.64 2oel s ARG 139 Cb 0.00 -2.04 0.08 0.00 -0.57 0.00 0.00 34.95 32.42 2oel s ARG 139 CO 0.00 -0.69 1.14 -1.25 -1.08 0.00 0.00 175.30 173.42 2oel s PRO 140 N -3.31 1.81 0.72 3.89 0.04 -1.18 -4.94 135.00 132.03 2oel s PRO 140 Ca 0.70 1.46 -0.07 0.00 0.04 0.00 0.00 61.00 63.13 2oel s PRO 140 Cb -0.21 -1.82 0.06 0.00 0.04 0.00 0.00 34.50 32.57 2oel s PRO 140 CO 0.25 -2.03 1.04 -0.51 0.04 0.00 0.00 177.00 175.79 2oel s LEU 141 N -5.92 2.78 -0.05 -3.56 1.43 -0.84 -4.89 118.68 107.64 2oel s LEU 141 Ca 0.67 0.52 0.01 0.00 -1.03 0.00 0.00 54.13 54.30 2oel s LEU 141 Cb -0.22 -3.16 0.02 0.00 0.03 0.00 0.00 46.19 42.86 2oel s LEU 141 CO 0.53 -1.62 -0.06 -0.22 0.23 0.00 0.00 176.35 175.21 2oel s LEU 142 N -5.29 1.42 0.12 1.79 2.96 -1.26 -0.45 118.68 117.97 2oel s LEU 142 Ca 0.60 -0.17 0.03 0.00 -0.22 0.00 0.00 54.13 54.38 2oel s LEU 142 Cb -0.11 -0.53 -0.04 0.00 0.50 0.00 0.00 46.19 46.01 2oel s LEU 142 CO 0.45 -0.03 -0.09 0.00 -1.32 0.00 0.00 176.35 175.37 2oel s MET 143 N 0.83 0.93 0.21 1.98 0.23 -0.57 -0.11 119.30 122.80 2oel s MET 143 Ca -0.12 -1.35 -0.03 0.00 -1.03 0.00 0.00 55.69 53.15 2oel s MET 143 Cb -0.15 -0.44 -0.03 0.00 -1.53 0.00 0.00 34.83 32.68 2oel s MET 143 CO 0.01 0.04 0.19 -1.54 -2.03 0.00 0.00 175.02 171.69 2oel s SER 144 N -2.99 0.12 0.01 -1.18 1.04 -0.62 -0.29 113.70 109.80 2oel s SER 144 Ca 0.13 -1.31 0.07 0.00 0.48 0.00 0.00 55.95 55.31 2oel s SER 144 Cb 0.03 0.42 -0.02 0.00 0.10 0.00 0.00 66.02 66.54 2oel s SER 144 CO -0.02 -0.89 -0.21 -0.63 0.98 0.00 0.00 173.24 172.47 2oel s ILE 145 N -4.13 1.71 0.47 -1.02 1.01 -0.43 -4.29 121.20 114.52 2oel s ILE 145 Ca 0.36 -1.07 -0.25 0.00 0.00 0.00 0.00 60.65 59.69 2oel s ILE 145 Cb 0.06 -1.45 -0.08 0.00 0.01 0.00 0.00 42.46 40.99 2oel s ILE 145 CO 0.12 0.35 1.43 0.49 0.00 0.00 0.00 174.94 177.33 2oel n PHE 146 N 2.18 2.68 -4.92 3.97 3.72 -1.26 -4.30 117.46 119.53 2oel n PHE 146 Ca -0.16 0.43 -0.33 0.00 -0.05 0.00 0.00 57.45 57.35 2oel n PHE 146 Cb 0.53 -2.45 -0.14 0.00 -0.94 0.00 0.00 39.48 36.48 2oel n PHE 146 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 2oel s LYS 147 N -2.52 2.64 -1.51 -1.08 2.20 -1.26 -4.53 119.74 113.68 2oel s LYS 147 Ca 0.63 -0.72 -0.13 0.00 -0.36 0.00 0.00 55.97 55.39 2oel s LYS 147 Cb -0.44 -2.39 0.08 0.00 -1.51 0.00 0.00 37.83 33.56 2oel s LYS 147 CO 0.56 0.54 0.98 0.41 -0.36 0.00 0.00 175.35 177.48 2oel n GLY 148 N 2.56 -0.49 0.18 5.54 0.00 -1.26 -4.91 105.19 106.81 2oel n GLY 148 Ca -0.17 0.19 0.10 0.00 0.00 0.00 0.00 46.02 46.14 2oel n GLY 148 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2oel h MET 149 N -2.11 0.00 -6.38 1.61 4.05 -1.99 -3.44 114.93 106.68 2oel h MET 149 Ca -0.58 0.00 -0.55 0.00 -0.28 0.00 0.00 59.70 58.28 2oel h MET 149 Cb 1.38 0.00 0.03 0.00 -0.80 0.00 0.00 31.60 32.20 2oel h MET 149 CO 0.66 0.09 1.16 -0.89 0.23 0.00 0.00 176.91 178.16 2oel n ILE 150 N -3.01 0.61 -0.39 1.77 5.41 -1.26 -0.91 119.36 121.58 2oel n ILE 150 Ca 0.02 -0.11 0.00 0.00 1.00 0.00 0.00 62.75 63.66 2oel n ILE 150 Cb 0.58 -2.14 0.00 0.00 -0.71 0.00 0.00 39.64 37.37 2oel n ILE 150 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2oel n GLY 151 N 4.41 0.90 3.98 7.39 0.00 -1.26 -5.06 105.19 115.54 2oel n GLY 151 Ca 0.20 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.01 2oel n GLY 151 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2oel s ARG 152 N -0.51 2.57 0.52 1.61 1.81 -0.09 -5.11 118.95 119.75 2oel s ARG 152 Ca 0.00 -0.82 0.06 0.00 -1.72 0.00 0.00 55.73 53.25 2oel s ARG 152 Cb 0.00 -2.51 0.03 0.00 -0.45 0.00 0.00 34.95 32.02 2oel s ARG 152 CO 0.00 -0.68 0.43 0.16 -0.68 0.00 0.00 175.30 174.53 2oel s ASP 153 N -4.42 4.73 0.38 0.23 1.47 -1.26 -4.56 116.67 113.24 2oel s ASP 153 Ca 0.57 -1.12 0.05 0.00 1.18 0.00 0.00 52.55 53.23 2oel s ASP 153 Cb -0.10 0.21 0.77 0.00 -0.34 0.00 0.00 42.92 43.45 2oel s ASP 153 CO 0.38 -1.03 2.02 -0.07 0.68 0.00 0.00 175.17 177.15 2oel h LEU 154 N 0.77 0.59 -0.93 2.11 3.38 -1.99 -1.30 115.31 117.94 2oel h LEU 154 Ca -0.37 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.53 2oel h LEU 154 Cb 1.29 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.88 2oel h LEU 154 CO 0.56 0.42 0.11 0.00 0.09 0.00 0.00 178.44 179.62 2oel h ALA 155 N 1.67 1.12 -0.27 1.53 0.00 -1.96 -0.08 119.26 121.27 2oel h ALA 155 Ca 0.21 -0.23 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 2oel h ALA 155 Cb 0.01 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 2oel h ALA 155 CO -0.05 0.58 -0.17 -0.92 0.00 0.00 0.00 179.25 178.69 2oel h TYR 156 N 0.85 0.69 -0.17 0.00 3.20 -1.71 -1.69 116.97 118.14 2oel h TYR 156 Ca 0.18 -0.18 0.02 0.00 3.14 0.00 0.00 58.73 61.89 2oel h TYR 156 Cb 0.35 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.45 2oel h TYR 156 CO 0.02 0.86 0.02 1.25 -1.64 0.00 0.00 178.16 178.67 2oel h LEU 157 N 0.32 -0.01 -0.67 2.82 6.46 -0.91 0.31 115.31 123.64 2oel h LEU 157 Ca 0.06 0.03 -0.01 0.00 -0.12 0.00 0.00 57.88 57.84 2oel h LEU 157 Cb 0.70 0.04 -0.03 0.00 -0.73 0.00 0.00 40.66 40.64 2oel h LEU 157 CO 0.05 0.02 0.38 0.71 -0.62 0.00 0.00 178.44 178.98 2oel h THR 158 N 0.09 1.20 -0.47 1.05 1.35 -0.96 0.14 112.91 115.31 2oel h THR 158 Ca 0.07 -0.48 -0.07 0.00 -0.55 0.00 0.00 66.41 65.39 2oel h THR 158 Cb 0.07 0.31 -0.02 0.00 -1.73 0.00 0.00 68.15 66.78 2oel h THR 158 CO -0.11 0.21 0.04 0.77 -0.25 0.00 0.00 175.52 176.19 2oel h SER 159 N 0.91 0.79 -0.11 5.36 4.64 -0.98 -1.64 113.55 122.51 2oel h SER 159 Ca 0.24 -0.29 -0.11 0.00 -0.47 0.00 0.00 61.79 61.16 2oel h SER 159 Cb 0.01 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 61.87 2oel h SER 159 CO -0.04 0.88 -0.30 -0.33 -0.87 0.00 0.00 176.83 176.17 2oel h GLU 160 N 0.67 0.59 -0.54 4.77 4.39 -0.69 -2.52 114.58 121.25 2oel h GLU 160 Ca 0.14 -0.25 -0.08 0.00 0.34 0.00 0.00 59.36 59.51 2oel h GLU 160 Cb 0.45 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.06 2oel h GLU 160 CO 0.02 0.82 0.03 1.25 -1.16 0.00 0.00 179.01 179.96 2oel h LEU 161 N 0.50 0.91 -0.58 1.33 5.85 -0.55 -2.70 115.31 120.07 2oel h LEU 161 Ca 0.06 -0.29 -0.05 0.00 0.84 0.00 0.00 57.88 58.44 2oel h LEU 161 Cb 0.77 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.53 2oel h LEU 161 CO 0.06 0.98 0.18 0.11 -0.34 0.00 0.00 178.44 179.43 2oel h LYS 162 N 0.81 0.91 -0.54 1.25 1.57 -1.18 -1.41 116.57 117.98 2oel h LYS 162 Ca 0.16 -0.20 0.06 0.00 -1.87 0.00 0.00 60.65 58.80 2oel h LYS 162 Cb 0.50 -0.13 -0.05 0.00 0.08 0.00 0.00 32.23 32.62 2oel h LYS 162 CO 0.02 0.82 0.25 0.87 -0.57 0.00 0.00 179.45 180.84 2oel h LYS 163 N 0.82 0.46 -0.34 3.15 1.57 -1.31 0.46 116.57 121.39 2oel h LYS 163 Ca 0.19 -0.03 -0.06 0.00 -1.87 0.00 0.00 60.65 58.88 2oel h LYS 163 Cb 0.29 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 2oel h LYS 163 CO -0.01 0.30 -0.03 1.96 -0.57 0.00 0.00 179.45 181.11 2oel h GLN 164 N 0.47 0.62 -0.46 3.15 4.20 -1.29 -2.15 115.11 119.65 2oel h GLN 164 Ca 0.25 -0.21 -0.07 0.00 0.06 0.00 0.00 58.65 58.67 2oel h GLN 164 Cb 0.20 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.92 2oel h GLN 164 CO -0.20 0.76 -0.01 0.00 -0.67 0.00 0.00 178.83 178.71 2oel h ALA 165 N 0.84 1.13 0.00 3.87 0.00 -0.78 -1.64 119.26 122.67 2oel h ALA 165 Ca 0.09 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 2oel h ALA 165 Cb 0.50 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 2oel h ALA 165 CO 0.02 0.56 -0.06 -0.07 0.00 0.00 0.00 179.25 179.70 2oel h LEU 166 N 0.70 0.00 0.00 0.00 3.38 0.07 -1.22 115.31 118.24 2oel h LEU 166 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2oel h LEU 166 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 2oel h LEU 166 CO 0.02 0.06 0.00 0.61 0.09 0.00 0.00 178.44 179.22 2oel n GLY 167 N -0.22 -1.16 0.94 0.83 0.00 -0.62 -4.91 105.19 100.06 2oel n GLY 167 Ca -0.00 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.86 2oel n GLY 167 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2oel n GLY 168 N 1.12 0.76 3.78 -0.02 0.00 -0.46 -2.01 105.19 108.36 2oel n GLY 168 Ca 0.17 -0.02 -0.35 0.00 0.00 0.00 0.00 46.02 45.82 2oel n GLY 168 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2oel s VAL 169 N -2.00 3.25 0.02 1.61 -7.23 -1.20 -4.95 120.40 109.91 2oel s VAL 169 Ca 0.00 0.79 0.10 0.00 -1.81 0.00 0.00 61.98 61.07 2oel s VAL 169 Cb 0.00 -3.33 -0.19 0.00 0.56 0.00 0.00 36.38 33.42 2oel s VAL 169 CO 0.00 -0.15 1.01 0.44 -0.31 0.00 0.00 175.10 176.09 2oel h ASP 170 N 1.34 0.00 -3.98 4.85 3.32 -0.80 -3.42 116.42 117.73 2oel h ASP 170 Ca -0.50 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 56.41 2oel h ASP 170 Cb 1.25 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 40.56 2oel h ASP 170 CO 0.58 0.94 -0.31 -0.22 -1.72 0.00 0.00 179.24 178.50 2oel s LEU 171 N -6.38 0.71 0.47 1.55 0.20 -1.00 -0.75 118.68 113.48 2oel s LEU 171 Ca -0.01 0.63 0.02 0.00 0.69 0.00 0.00 54.13 55.46 2oel s LEU 171 Cb 0.09 1.19 -0.02 0.00 -0.43 0.00 0.00 46.19 47.02 2oel s LEU 171 CO 0.82 -0.15 0.05 -0.69 -0.29 0.00 0.00 176.35 176.08 2oel s VAL 172 N 0.02 1.00 0.23 1.68 1.01 0.07 -1.59 120.40 122.82 2oel s VAL 172 Ca -0.01 -2.00 0.06 0.00 0.00 0.00 0.00 61.98 60.03 2oel s VAL 172 Cb -0.03 -2.28 -0.04 0.00 0.00 0.00 0.00 36.38 34.04 2oel s VAL 172 CO 0.01 0.00 0.19 -1.81 0.00 0.00 0.00 175.10 173.49 2oel s ASP 174 N -3.77 5.58 0.41 3.32 1.01 -0.62 -0.26 116.67 122.35 2oel s ASP 174 Ca 0.14 -0.19 -0.25 0.00 0.71 0.00 0.00 52.55 52.96 2oel s ASP 174 Cb 0.02 -1.45 -0.08 0.00 1.01 0.00 0.00 42.92 42.42 2oel s ASP 174 CO 0.08 -0.01 1.18 -0.62 0.21 0.00 0.00 175.17 176.01 2oel s ASP 175 N -3.64 6.44 0.42 0.27 -1.08 -1.26 -4.80 116.67 113.02 2oel s ASP 175 Ca 0.32 2.35 0.29 0.00 -0.52 0.00 0.00 52.55 55.00 2oel s ASP 175 Cb -0.09 -2.61 1.44 0.00 -1.46 0.00 0.00 42.92 40.20 2oel s ASP 175 CO 0.25 -0.73 1.89 1.05 0.52 0.00 0.00 175.17 178.14 2oel h GLU 176 N 2.52 0.00 -0.63 4.34 9.09 -2.01 -1.24 114.58 126.65 2oel h GLU 176 Ca -0.49 0.00 0.00 0.00 0.05 0.00 0.00 59.36 58.92 2oel h GLU 176 Cb 1.24 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.34 2oel h GLU 176 CO 0.62 0.00 0.00 0.44 0.05 0.00 0.00 179.01 180.12 2oel n ILE 177 N -2.58 1.40 -3.10 -1.06 -5.35 -1.26 -4.85 119.36 102.56 2oel n ILE 177 Ca -0.01 -0.95 -0.43 0.00 -0.27 0.00 0.00 62.75 61.10 2oel n ILE 177 Cb 0.14 0.11 -0.07 0.00 -1.74 0.00 0.00 39.64 38.08 2oel n ILE 177 CO 0.00 0.00 0.00 -0.22 -1.76 0.00 0.00 176.55 174.57 2oel s LEU 178 N -1.51 4.47 0.29 7.28 2.96 -0.47 -5.00 118.68 126.70 2oel s LEU 178 Ca 0.42 -0.30 0.07 0.00 -0.22 0.00 0.00 54.13 54.10 2oel s LEU 178 Cb 0.26 -2.75 -0.03 0.00 0.50 0.00 0.00 46.19 44.17 2oel s LEU 178 CO 0.22 -0.78 0.25 -0.36 -1.32 0.00 0.00 176.35 174.35 2oel s PHE 179 N 2.85 3.04 0.51 5.38 0.08 -1.26 -4.86 117.98 123.72 2oel s PHE 179 Ca 0.23 -0.19 -0.22 0.00 0.12 0.00 0.00 56.93 56.87 2oel s PHE 179 Cb -0.14 -1.59 -0.06 0.00 -0.57 0.00 0.00 43.02 40.66 2oel s PHE 179 CO 0.19 0.36 1.30 -0.51 -0.10 0.00 0.00 175.22 176.46 2oel s ASP 180 N -3.92 5.63 0.32 1.36 1.01 -1.26 -4.93 116.67 114.87 2oel s ASP 180 Ca 0.37 2.62 -0.12 0.00 0.71 0.00 0.00 52.55 56.13 2oel s ASP 180 Cb -0.07 -2.63 0.02 0.00 1.01 0.00 0.00 42.92 41.25 2oel s ASP 180 CO 0.26 -1.31 0.60 -0.94 0.21 0.00 0.00 175.17 173.99 2oel s SER 181 N -1.05 0.18 0.29 0.27 1.04 -1.18 -5.00 113.70 108.24 2oel s SER 181 Ca 0.68 -1.09 0.02 0.00 0.48 0.00 0.00 55.95 56.03 2oel s SER 181 Cb -0.37 0.71 0.43 0.00 0.10 0.00 0.00 66.02 66.89 2oel s SER 181 CO 0.44 -1.37 1.76 -0.33 0.98 0.00 0.00 173.24 174.72 2oel h GLU 182 N 2.10 0.57 -0.23 4.02 4.39 -2.00 -2.31 114.58 121.12 2oel h GLU 182 Ca -0.27 -0.18 -0.20 0.00 0.34 0.00 0.00 59.36 59.05 2oel h GLU 182 Cb 1.25 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.85 2oel h GLU 182 CO 0.36 0.69 -0.64 -0.07 -1.16 0.00 0.00 179.01 178.19 2oel h LEU 183 N 0.52 0.95 -6.36 1.33 3.38 -1.96 -3.38 115.31 109.80 2oel h LEU 183 Ca 0.09 -0.56 -0.60 0.00 0.09 0.00 0.00 57.88 56.91 2oel h LEU 183 Cb 0.55 -0.28 -0.41 0.00 0.09 0.00 0.00 40.66 40.61 2oel h LEU 183 CO 0.03 1.35 -0.73 0.18 0.09 0.00 0.00 178.44 179.37 2oel n LEU 184 N -3.98 2.51 -4.76 1.67 4.77 -1.11 -3.96 117.00 112.14 2oel n LEU 184 Ca -0.05 -5.15 -0.39 0.00 -0.03 0.00 0.00 56.01 50.39 2oel n LEU 184 Cb 0.68 -0.32 0.01 0.00 -2.33 0.00 0.00 43.42 41.46 2oel n LEU 184 CO 0.51 1.98 0.96 -2.84 -1.33 0.00 0.00 177.39 176.67 2oel s PRO 185 N -1.79 3.63 0.14 3.23 0.02 -0.89 -3.13 135.00 136.21 2oel s PRO 185 Ca 0.35 2.14 -0.27 0.00 0.02 0.00 0.00 61.00 63.23 2oel s PRO 185 Cb 0.10 -2.51 -0.02 0.00 0.02 0.00 0.00 34.50 32.09 2oel s PRO 185 CO -0.08 -0.77 1.58 0.35 -0.33 0.00 0.00 177.00 177.76 2oel h PHE 186 N 2.11 -1.15 -0.31 6.54 3.57 -1.96 -0.39 116.94 125.35 2oel h PHE 186 Ca -0.50 0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.04 2oel h PHE 186 Cb 1.27 0.54 -0.02 0.00 2.79 0.00 0.00 35.95 40.53 2oel h PHE 186 CO 0.50 -0.45 0.13 0.93 -2.23 0.00 0.00 178.31 177.20 2oel h GLU 187 N -0.41 0.43 -0.29 1.11 5.08 -1.97 -2.49 114.58 116.04 2oel h GLU 187 Ca 0.11 -0.05 -0.19 0.00 -1.00 0.00 0.00 59.36 58.23 2oel h GLU 187 Cb 0.59 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.76 2oel h GLU 187 CO -0.46 0.36 -0.55 0.87 -1.00 0.00 0.00 179.01 178.23 2oel h LYS 188 N 0.44 0.89 -0.93 2.33 1.57 -1.74 -1.84 116.57 117.28 2oel h LYS 188 Ca 0.11 -0.56 0.05 0.00 -1.87 0.00 0.00 60.65 58.38 2oel h LYS 188 Cb 0.08 0.07 -0.06 0.00 0.08 0.00 0.00 32.23 32.40 2oel h LYS 188 CO -0.01 1.20 0.59 0.00 -0.57 0.00 0.00 179.45 180.66 2oel h ARG 189 N 0.68 1.08 0.30 3.15 3.08 -0.67 0.14 114.38 122.14 2oel h ARG 189 Ca 0.01 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 59.99 2oel h ARG 189 Cb 1.16 -0.24 0.00 0.00 0.08 0.00 0.00 29.97 30.97 2oel h ARG 189 CO 0.12 0.71 -0.15 0.82 -1.07 0.00 0.00 179.97 180.41 2oel h ILE 190 N 1.11 0.73 -0.27 2.04 2.04 -1.25 -0.16 117.51 121.75 2oel h ILE 190 Ca 0.39 -0.40 -0.08 0.00 1.00 0.00 0.00 64.86 65.78 2oel h ILE 190 Cb 0.09 0.94 -0.01 0.00 -0.74 0.00 0.00 36.82 37.11 2oel h ILE 190 CO -0.15 0.08 -0.13 0.71 0.00 0.00 0.00 178.15 178.66 2oel h THR 191 N -0.62 1.30 -0.54 -0.27 1.35 -1.14 -0.52 112.91 112.46 2oel h THR 191 Ca -0.04 -1.21 -0.08 0.00 -0.55 0.00 0.00 66.41 64.52 2oel h THR 191 Cb 0.45 1.52 -0.02 0.00 -1.73 0.00 0.00 68.15 68.37 2oel h THR 191 CO 0.07 0.38 0.01 -0.33 -0.25 0.00 0.00 175.52 175.40 2oel h GLU 192 N 0.29 0.95 -0.59 4.72 4.39 -0.81 -2.17 114.58 121.36 2oel h GLU 192 Ca 0.06 -0.30 -0.02 0.00 0.34 0.00 0.00 59.36 59.44 2oel h GLU 192 Cb 0.64 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 29.17 2oel h GLU 192 CO 0.04 0.96 0.29 0.78 -1.16 0.00 0.00 179.01 179.92 2oel h GLY 193 N 0.83 0.91 0.80 -3.84 0.00 -0.96 -2.12 103.07 98.69 2oel h GLY 193 Ca 0.16 -0.44 0.02 0.00 0.00 0.00 0.00 47.33 47.07 2oel h GLY 193 CO 0.03 0.42 0.05 1.70 0.00 0.00 0.00 176.54 178.73 2oel h LYS 194 N 0.80 0.13 -0.28 4.80 3.64 -0.90 -0.51 116.57 124.25 2oel h LYS 194 Ca 0.20 -0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.61 2oel h LYS 194 Cb 0.10 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.87 2oel h LYS 194 CO -0.03 0.08 0.10 0.00 -2.27 0.00 0.00 179.45 177.33 2oel h ALA 195 N 1.13 0.32 -0.77 5.00 0.00 -1.24 -0.56 119.26 123.14 2oel h ALA 195 Ca 0.09 0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.05 2oel h ALA 195 Cb 0.07 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 2oel h ALA 195 CO -0.11 -0.31 0.50 0.00 0.00 0.00 0.00 179.25 179.33 2oel h ALA 196 N 1.18 0.99 0.00 0.00 0.00 -1.05 -1.32 119.26 119.06 2oel h ALA 196 Ca 0.12 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 2oel h ALA 196 Cb 0.09 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2oel h ALA 196 CO -0.13 0.34 -0.40 -0.07 0.00 0.00 0.00 179.25 178.99 2oel h LEU 197 N 1.00 0.00 -0.32 0.00 3.38 -0.66 -2.32 115.31 116.39 2oel h LEU 197 Ca 0.29 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.13 2oel h LEU 197 Cb -0.06 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 2oel h LEU 197 CO -0.08 0.40 -0.30 1.56 0.09 0.00 0.00 178.44 180.10 2oel h GLN 198 N 0.00 0.77 -0.85 1.13 1.08 -0.35 -2.14 115.11 114.75 2oel h GLN 198 Ca -0.00 -0.40 0.00 0.00 -1.45 0.00 0.00 58.65 56.80 2oel h GLN 198 Cb 0.77 0.01 -0.04 0.00 -0.05 0.00 0.00 27.48 28.17 2oel h GLN 198 CO 0.05 1.03 0.54 0.93 -0.95 0.00 0.00 178.83 180.43 2oel h GLU 199 N 0.54 1.13 -0.57 1.46 5.08 -0.98 -1.85 114.58 119.40 2oel h GLU 199 Ca 0.05 -0.08 -0.08 0.00 -1.00 0.00 0.00 59.36 58.25 2oel h GLU 199 Cb 0.88 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 29.86 2oel h GLU 199 CO 0.08 0.76 0.04 0.28 -1.00 0.00 0.00 179.01 179.17 2oel h VAL 200 N 1.15 1.25 0.24 3.13 2.07 -1.28 -1.64 116.25 121.18 2oel h VAL 200 Ca 0.31 -1.05 -0.01 0.00 0.82 0.00 0.00 66.70 66.77 2oel h VAL 200 Cb -0.10 0.78 0.00 0.00 -1.52 0.00 0.00 31.29 30.45 2oel h VAL 200 CO -0.06 0.38 -0.12 0.22 0.02 0.00 0.00 177.57 178.00 2oel h TYR 201 N 0.88 -0.32 -1.02 1.57 3.20 -0.79 0.13 116.97 120.63 2oel h TYR 201 Ca 0.17 -0.01 0.25 0.00 3.14 0.00 0.00 58.73 62.28 2oel h TYR 201 Cb 0.47 0.11 -0.11 0.00 1.54 0.00 0.00 36.73 38.73 2oel h TYR 201 CO 0.03 -0.20 0.62 0.93 -1.64 0.00 0.00 178.16 177.91 2oel h GLU 202 N -0.33 0.52 -0.00 1.82 4.39 -1.11 2.42 114.58 122.28 2oel h GLU 202 Ca -0.03 -0.03 -0.11 0.00 0.34 0.00 0.00 59.36 59.53 2oel h GLU 202 Cb 0.26 -0.12 0.01 0.00 -0.10 0.00 0.00 28.75 28.80 2oel h GLU 202 CO 0.05 0.34 -0.43 0.37 -1.16 0.00 0.00 179.01 178.18 2oel h GLN 203 N 0.53 0.30 0.00 2.33 4.15 -0.35 -3.40 115.11 118.67 2oel h GLN 203 Ca 0.62 -0.32 0.00 0.00 0.77 0.00 0.00 58.65 59.73 2oel h GLN 203 Cb 1.30 0.09 0.00 0.00 0.21 0.00 0.00 27.48 29.07 2oel h GLN 203 CO -0.41 1.01 0.00 0.25 -1.93 0.00 0.00 178.83 177.76 2oel n THR 204 N -4.36 0.00 -0.92 2.39 -2.24 0.36 -4.98 114.28 104.54 2oel n THR 204 Ca -0.10 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.18 2oel n THR 204 Cb 0.59 1.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.82 2oel n THR 204 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2oel n GLY 205 N 0.64 0.60 3.74 3.38 0.00 0.81 -4.98 105.19 109.37 2oel n GLY 205 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 2oel n GLY 205 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2oel s LYS 206 N -0.36 4.39 -0.22 1.61 2.47 -1.26 -4.97 119.74 121.40 2oel s LYS 206 Ca 0.00 0.81 -0.13 0.00 -1.56 0.00 0.00 55.97 55.10 2oel s LYS 206 Cb 0.00 -3.39 -0.05 0.00 -1.46 0.00 0.00 37.83 32.93 2oel s LYS 206 CO 0.00 0.22 0.26 0.50 0.16 0.00 0.00 175.35 176.49 2oel s ARG 207 N 0.27 4.12 -0.04 4.03 6.06 -1.26 -3.80 118.95 128.33 2oel s ARG 207 Ca 0.34 -0.06 0.03 0.00 -2.50 0.00 0.00 55.73 53.54 2oel s ARG 207 Cb -0.18 -3.53 0.01 0.00 0.06 0.00 0.00 34.95 31.31 2oel s ARG 207 CO 0.18 0.04 -0.12 0.99 -2.50 0.00 0.00 175.30 173.89 2oel s THR 208 N 1.11 1.03 0.15 4.11 2.01 -1.26 -4.71 115.64 118.08 2oel s THR 208 Ca 0.13 -0.46 0.01 0.00 0.31 0.00 0.00 61.69 61.67 2oel s THR 208 Cb -0.14 -0.93 -0.04 0.00 0.01 0.00 0.00 72.50 71.41 2oel s THR 208 CO 0.06 0.32 0.31 -0.76 -0.69 0.00 0.00 174.62 173.85 2oel s LEU 209 N 0.38 4.31 -0.20 4.42 1.43 0.07 -4.94 118.68 124.15 2oel s LEU 209 Ca -0.08 0.26 -0.00 0.00 -1.03 0.00 0.00 54.13 53.28 2oel s LEU 209 Cb -0.12 -3.00 0.02 0.00 0.03 0.00 0.00 46.19 43.11 2oel s LEU 209 CO 0.02 0.04 -0.15 -0.47 0.23 0.00 0.00 176.35 176.02 2oel s TYR 210 N -1.74 2.88 -0.48 0.29 5.04 -1.26 -0.75 117.35 121.33 2oel s TYR 210 Ca 0.36 -1.55 -0.19 0.00 -2.44 0.00 0.00 57.07 53.24 2oel s TYR 210 Cb -0.11 -1.97 0.05 0.00 0.35 0.00 0.00 41.96 40.27 2oel s TYR 210 CO 0.28 -0.76 0.59 0.00 -1.34 0.00 0.00 175.55 174.33 2oel s ALA 211 N 1.32 3.39 -0.02 3.97 0.00 0.64 -2.73 121.76 128.33 2oel s ALA 211 Ca 0.04 -1.65 -0.16 0.00 0.00 0.00 0.00 51.96 50.19 2oel s ALA 211 Cb -0.14 -3.29 -0.05 0.00 0.00 0.00 0.00 23.12 19.63 2oel s ALA 211 CO -0.10 -1.91 0.44 0.54 0.00 0.00 0.00 175.76 174.74 2oel s VAL 212 N 2.55 5.03 0.06 0.00 0.11 -0.51 -1.59 120.40 126.05 2oel s VAL 212 Ca 0.15 0.91 -0.31 0.00 -2.93 0.00 0.00 61.98 59.80 2oel s VAL 212 Cb -0.18 -3.76 -0.07 0.00 -1.53 0.00 0.00 36.38 30.83 2oel s VAL 212 CO 0.13 0.51 1.53 0.21 -3.33 0.00 0.00 175.10 174.15 2oel s ASN 213 N -0.66 6.71 -0.46 3.54 2.47 -1.26 -0.29 114.94 125.00 2oel s ASN 213 Ca 0.25 2.35 -0.13 0.00 0.42 0.00 0.00 52.86 55.75 2oel s ASN 213 Cb -0.17 -2.57 0.08 0.00 -1.45 0.00 0.00 41.25 37.15 2oel s ASN 213 CO 0.13 -0.80 0.35 -0.22 -3.72 0.00 0.00 177.10 172.85 2oel s LEU 214 N 2.23 5.50 0.00 3.21 2.96 0.08 -4.87 118.68 127.79 2oel s LEU 214 Ca 0.69 -1.45 0.00 0.00 -0.22 0.00 0.00 54.13 53.15 2oel s LEU 214 Cb -0.37 -2.11 0.00 0.00 0.50 0.00 0.00 46.19 44.21 2oel s LEU 214 CO 0.30 -0.62 0.00 0.35 -1.32 0.00 0.00 176.35 175.05 2oel n THR 215 N 5.09 0.00 -0.96 3.68 -2.24 -1.26 -4.62 114.28 113.97 2oel n THR 215 Ca -0.12 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.66 2oel n THR 215 Cb 0.43 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.66 2oel n THR 215 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2oel n GLY 216 N 3.23 -2.20 3.77 3.38 0.00 -1.26 -4.84 105.19 107.27 2oel n GLY 216 Ca 0.00 -1.89 -0.39 0.00 0.00 0.00 0.00 46.02 43.75 2oel n GLY 216 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oel s LYS 217 N -0.20 3.82 0.18 1.61 1.02 -1.26 -4.92 119.74 120.00 2oel s LYS 217 Ca 0.00 2.08 -0.21 0.00 0.02 0.00 0.00 55.97 57.85 2oel s LYS 217 Cb 0.00 -2.62 0.11 0.00 -0.52 0.00 0.00 37.83 34.80 2oel s LYS 217 CO 0.00 -0.59 1.58 1.15 -0.92 0.00 0.00 175.35 176.58 2oel h THR 218 N 2.21 0.15 0.00 2.17 2.02 -1.99 -1.51 112.91 115.96 2oel h THR 218 Ca -0.50 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.68 2oel h THR 218 Cb 1.25 0.15 0.00 0.00 -1.74 0.00 0.00 68.15 67.81 2oel h THR 218 CO 0.61 0.00 0.00 0.49 0.37 0.00 0.00 175.52 176.99 2oel n PHE 219 N -5.43 0.00 0.24 3.16 3.72 -1.26 -1.90 117.46 115.99 2oel n PHE 219 Ca 0.04 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.47 2oel n PHE 219 Cb 0.36 0.00 -0.00 0.00 -0.94 0.00 0.00 39.48 38.89 2oel n PHE 219 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2oel n ALA 220 N -0.61 2.58 -0.05 4.37 0.00 -0.58 -4.74 120.51 121.47 2oel n ALA 220 Ca 0.04 -0.35 -0.11 0.00 0.00 0.00 0.00 53.44 53.02 2oel n ALA 220 Cb 0.02 -0.19 -0.05 0.00 0.00 0.00 0.00 19.45 19.23 2oel n ALA 220 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2oel h LEU 221 N 0.58 0.27 -0.69 0.00 3.38 -1.24 -2.78 115.31 114.83 2oel h LEU 221 Ca 0.00 -0.22 -0.03 0.00 0.09 0.00 0.00 57.88 57.72 2oel h LEU 221 Cb 0.18 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 2oel h LEU 221 CO 0.00 0.42 0.30 0.11 0.09 0.00 0.00 178.44 179.37 2oel h LYS 222 N 0.11 1.02 -0.50 1.13 1.57 -1.85 0.58 116.57 118.63 2oel h LYS 222 Ca 0.06 -0.17 -0.02 0.00 -1.87 0.00 0.00 60.65 58.65 2oel h LYS 222 Cb 0.25 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.37 2oel h LYS 222 CO -0.00 0.82 0.24 -0.44 -0.57 0.00 0.00 179.45 179.50 2oel h ASP 223 N 0.97 0.64 0.79 0.86 3.32 -1.87 -0.66 116.42 120.48 2oel h ASP 223 Ca 0.23 -0.12 -0.13 0.00 0.02 0.00 0.00 57.03 57.03 2oel h ASP 223 Cb 0.16 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 2oel h ASP 223 CO -0.02 0.59 -0.62 0.07 -1.72 0.00 0.00 179.24 177.54 2oel h LYS 224 N 0.66 0.00 -0.32 3.56 2.10 -1.28 -2.29 116.57 119.00 2oel h LYS 224 Ca 0.17 0.00 -0.13 0.00 -2.00 0.00 0.00 60.65 58.69 2oel h LYS 224 Cb 0.11 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.43 2oel h LYS 224 CO -0.02 0.62 -0.32 0.00 -2.00 0.00 0.00 179.45 177.72 2oel h ALA 225 N 1.38 0.84 -0.54 0.07 0.00 -0.60 -0.13 119.26 120.29 2oel h ALA 225 Ca -0.01 -0.41 -0.07 0.00 0.00 0.00 0.00 54.91 54.42 2oel h ALA 225 Cb 1.18 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.82 2oel h ALA 225 CO 0.08 0.64 0.05 -0.22 0.00 0.00 0.00 179.25 179.80 2oel h LYS 226 N 0.58 0.92 -0.69 0.00 3.64 -0.97 -0.90 116.57 119.15 2oel h LYS 226 Ca 0.06 -0.27 -0.05 0.00 -1.27 0.00 0.00 60.65 59.12 2oel h LYS 226 Cb 0.84 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 32.53 2oel h LYS 226 CO 0.07 0.91 0.22 0.00 -2.27 0.00 0.00 179.45 178.39 2oel h ARG 227 N 0.80 1.06 -0.48 1.90 2.47 -1.14 -1.06 114.38 117.94 2oel h ARG 227 Ca 0.16 -0.21 -0.01 0.00 -1.26 0.00 0.00 59.98 58.66 2oel h ARG 227 Cb 0.47 -0.16 -0.02 0.00 -1.65 0.00 0.00 29.97 28.60 2oel h ARG 227 CO 0.02 0.90 0.27 0.00 0.56 0.00 0.00 179.97 181.72 2oel h ALA 228 N 1.22 0.61 -0.64 0.04 0.00 -0.61 0.67 119.26 120.54 2oel h ALA 228 Ca 0.23 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.07 2oel h ALA 228 Cb 0.28 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 2oel h ALA 228 CO -0.01 0.11 0.42 0.00 0.00 0.00 0.00 179.25 179.77 2oel h ALA 229 N 1.12 0.82 -0.47 0.00 0.00 -0.72 -0.32 119.26 119.69 2oel h ALA 229 Ca 0.17 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 2oel h ALA 229 Cb 0.02 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 2oel h ALA 229 CO -0.03 0.22 0.05 0.93 0.00 0.00 0.00 179.25 180.43 2oel h GLU 230 N 0.85 0.73 0.00 0.00 5.08 -0.67 -2.24 114.58 118.34 2oel h GLU 230 Ca 0.24 -0.17 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 2oel h GLU 230 Cb -0.08 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.07 2oel h GLU 230 CO -0.06 0.71 0.00 1.28 -1.00 0.00 0.00 179.01 179.94 2oel n LEU 231 N -4.26 0.00 0.00 1.33 4.77 0.18 -4.91 117.00 114.11 2oel n LEU 231 Ca 0.03 0.23 0.00 0.00 -0.03 0.00 0.00 56.01 56.24 2oel n LEU 231 Cb 0.25 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 2oel n LEU 231 CO 0.40 -0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.07 2oel n GLY 232 N 1.17 0.71 3.74 -0.72 0.00 -0.62 -4.78 105.19 104.68 2oel n GLY 232 Ca 0.16 -0.71 -0.40 0.00 0.00 0.00 0.00 46.02 45.06 2oel n GLY 232 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oel n ALA 233 N -0.57 1.73 -0.06 4.61 0.00 -0.23 -4.94 120.51 121.06 2oel n ALA 233 Ca 0.00 0.24 -0.16 0.00 0.00 0.00 0.00 53.44 53.52 2oel n ALA 233 Cb 0.24 -2.35 -0.13 0.00 0.00 0.00 0.00 19.45 17.21 2oel n ALA 233 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2oel h ASP 234 N 2.10 0.07 -4.88 0.00 3.32 -1.91 -3.46 116.42 111.67 2oel h ASP 234 Ca -0.50 -0.93 -0.14 0.00 0.02 0.00 0.00 57.03 55.48 2oel h ASP 234 Cb 1.28 -0.02 -0.21 0.00 0.22 0.00 0.00 39.33 40.60 2oel h ASP 234 CO 0.60 1.13 -0.46 -0.69 -1.72 0.00 0.00 179.24 178.11 2oel s VAL 235 N -2.27 0.07 -0.25 -1.35 1.01 -1.11 -4.05 120.40 112.46 2oel s VAL 235 Ca -0.20 -0.60 -0.06 0.00 0.00 0.00 0.00 61.98 61.13 2oel s VAL 235 Cb -0.01 -0.45 -0.01 0.00 0.00 0.00 0.00 36.38 35.91 2oel s VAL 235 CO 0.70 -0.33 0.03 -0.76 0.00 0.00 0.00 175.10 174.74 2oel s LEU 236 N -1.25 3.30 0.04 3.92 1.43 -0.29 -1.43 118.68 124.41 2oel s LEU 236 Ca -0.13 -0.38 -0.25 0.00 -1.03 0.00 0.00 54.13 52.34 2oel s LEU 236 Cb -0.07 -1.84 -0.05 0.00 0.03 0.00 0.00 46.19 44.26 2oel s LEU 236 CO 0.02 -0.06 0.77 -0.22 0.23 0.00 0.00 176.35 177.09 2oel s LEU 237 N 1.54 4.44 -0.04 1.79 2.96 0.60 -0.50 118.68 129.46 2oel s LEU 237 Ca 0.05 1.44 -0.02 0.00 -0.22 0.00 0.00 54.13 55.38 2oel s LEU 237 Cb -0.15 -3.23 0.03 0.00 0.50 0.00 0.00 46.19 43.34 2oel s LEU 237 CO 0.01 -0.00 0.07 0.12 -1.32 0.00 0.00 176.35 175.22 2oel s PHE 238 N 0.03 0.02 -1.58 5.38 5.36 0.13 -0.74 117.98 126.58 2oel s PHE 238 Ca 0.39 0.29 -0.11 0.00 -0.96 0.00 0.00 56.93 56.53 2oel s PHE 238 Cb -0.20 -0.41 -0.06 0.00 -0.34 0.00 0.00 43.02 42.01 2oel s PHE 238 CO 0.23 -0.18 2.77 0.09 -1.46 0.00 0.00 175.22 176.67 2oel n ASN 239 N 5.10 7.51 -0.32 6.13 5.03 -1.26 -1.48 115.26 135.97 2oel n ASN 239 Ca -0.08 -2.63 0.19 0.00 0.87 0.00 0.00 54.58 52.92 2oel n ASN 239 Cb 0.50 -1.58 0.38 0.00 -1.02 0.00 0.00 39.78 38.07 2oel n ASN 239 CO 0.00 0.00 0.00 1.62 -1.83 0.00 0.00 177.26 177.05 2oel h VAL 240 N 3.26 0.31 0.00 2.41 3.04 -1.90 -1.36 116.25 122.01 2oel h VAL 240 Ca 0.80 -0.09 0.00 0.00 -1.01 0.00 0.00 66.70 66.39 2oel h VAL 240 Cb 0.37 0.01 0.00 0.00 -2.01 0.00 0.00 31.29 29.66 2oel h VAL 240 CO 1.81 0.05 0.00 0.49 -1.01 0.00 0.00 177.57 178.91 2oel n PHE 241 N -5.13 0.79 1.09 3.17 3.72 -1.26 -0.96 117.46 118.87 2oel n PHE 241 Ca 0.27 0.34 0.12 0.00 -0.05 0.00 0.00 57.45 58.13 2oel n PHE 241 Cb 0.84 -1.05 0.26 0.00 -0.94 0.00 0.00 39.48 38.59 2oel n PHE 241 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2oel n ALA 242 N -1.78 3.46 -0.03 4.37 0.00 -0.51 -4.47 120.51 121.56 2oel n ALA 242 Ca 0.01 -0.40 -0.03 0.00 0.00 0.00 0.00 53.44 53.02 2oel n ALA 242 Cb 0.16 -1.09 -0.03 0.00 0.00 0.00 0.00 19.45 18.49 2oel n ALA 242 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2oel n TYR 243 N -1.13 0.00 0.00 0.00 4.01 -0.29 -5.14 117.16 114.60 2oel n TYR 243 Ca 0.08 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.82 2oel n TYR 243 Cb 0.34 -0.22 0.00 0.00 -0.31 0.00 0.00 39.34 39.15 2oel n TYR 243 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2oel n GLY 244 N 3.01 3.65 0.36 2.72 0.00 -0.14 -4.75 105.19 110.04 2oel n GLY 244 Ca -0.09 -1.47 0.12 0.00 0.00 0.00 0.00 46.02 44.58 2oel n GLY 244 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2oel h LEU 245 N 0.00 0.48 -1.69 0.99 3.38 -1.96 -1.62 115.31 114.89 2oel h LEU 245 Ca 0.00 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 2oel h LEU 245 Cb 0.00 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 2oel h LEU 245 CO 0.00 0.27 -0.13 -0.78 0.09 0.00 0.00 178.44 177.89 2oel h ASP 246 N 0.52 0.03 -0.45 -0.43 3.58 -1.95 -2.27 116.42 115.45 2oel h ASP 246 Ca 0.34 -0.00 -0.14 0.00 0.42 0.00 0.00 57.03 57.65 2oel h ASP 246 Cb 0.62 -0.01 -0.01 0.00 1.72 0.00 0.00 39.33 41.65 2oel h ASP 246 CO -0.12 0.16 -0.27 0.58 -2.88 0.00 0.00 179.24 176.71 2oel h VAL 247 N 0.03 1.27 -0.69 2.25 2.07 -1.58 -1.05 116.25 118.55 2oel h VAL 247 Ca 0.01 -1.44 0.01 0.00 0.82 0.00 0.00 66.70 66.09 2oel h VAL 247 Cb 0.25 1.22 -0.03 0.00 -1.52 0.00 0.00 31.29 31.21 2oel h VAL 247 CO 0.02 0.49 0.46 0.25 0.02 0.00 0.00 177.57 178.81 2oel h LEU 248 N 0.82 0.79 -0.90 2.57 5.85 -1.45 -1.56 115.31 121.43 2oel h LEU 248 Ca 0.09 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.77 2oel h LEU 248 Cb 0.86 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.66 2oel h LEU 248 CO 0.08 0.57 0.44 -0.61 -0.34 0.00 0.00 178.44 178.58 2oel h GLN 249 N 0.93 1.23 -0.69 1.25 4.15 -1.16 -1.37 115.11 119.45 2oel h GLN 249 Ca 0.25 -0.16 -0.03 0.00 0.77 0.00 0.00 58.65 59.49 2oel h GLN 249 Cb -0.10 -0.23 -0.03 0.00 0.21 0.00 0.00 27.48 27.33 2oel h GLN 249 CO -0.06 0.92 0.33 0.00 -1.93 0.00 0.00 178.83 178.09 2oel h ALA 250 N 1.26 0.88 -0.50 3.38 0.00 -0.59 0.25 119.26 123.95 2oel h ALA 250 Ca 0.30 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.99 2oel h ALA 250 Cb 0.08 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2oel h ALA 250 CO -0.04 0.45 0.00 -0.07 0.00 0.00 0.00 179.25 179.59 2oel h LEU 251 N 0.95 0.79 -0.38 0.00 3.38 -0.90 -2.51 115.31 116.65 2oel h LEU 251 Ca 0.24 -0.19 -0.17 0.00 0.09 0.00 0.00 57.88 57.84 2oel h LEU 251 Cb 0.12 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.65 2oel h LEU 251 CO -0.03 0.86 -0.48 -0.09 0.09 0.00 0.00 178.44 178.79 2oel h ARG 252 N 0.77 0.85 0.00 1.13 9.65 -0.79 -3.23 114.38 122.76 2oel h ARG 252 Ca 0.15 -0.50 0.00 0.00 -1.10 0.00 0.00 59.98 58.53 2oel h ARG 252 Cb 0.46 0.04 0.00 0.00 -1.39 0.00 0.00 29.97 29.08 2oel h ARG 252 CO 0.02 1.13 -0.03 0.39 2.80 0.00 0.00 179.97 184.29 2oel n GLU 253 N -4.02 0.01 -2.55 0.20 1.02 0.03 -4.74 120.64 110.59 2oel n GLU 253 Ca -0.03 0.01 -0.43 0.00 -0.02 0.00 0.00 57.16 56.69 2oel n GLU 253 Cb 0.59 -1.51 -0.02 0.00 -0.02 0.00 0.00 31.44 30.47 2oel n GLU 253 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2oel s ASP 254 N -3.06 6.57 0.35 1.62 -1.08 -0.96 -4.88 116.67 115.22 2oel s ASP 254 Ca 0.14 0.52 0.26 0.00 -0.52 0.00 0.00 52.55 52.94 2oel s ASP 254 Cb 0.19 -2.55 1.22 0.00 -1.46 0.00 0.00 42.92 40.32 2oel s ASP 254 CO 0.54 -1.30 1.78 -0.33 0.52 0.00 0.00 175.17 176.38 2oel h GLU 255 N 9.54 0.00 -0.00 4.34 4.39 -1.90 -1.64 114.58 129.30 2oel h GLU 255 Ca -0.24 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.46 2oel h GLU 255 Cb 1.07 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.72 2oel h GLU 255 CO 1.12 0.00 -0.10 0.39 -1.16 0.00 0.00 179.01 179.26 2oel n GLU 256 N -2.40 0.66 0.00 2.33 1.02 -1.26 -4.23 120.64 116.76 2oel n GLU 256 Ca 0.00 -0.21 0.00 0.00 -0.02 0.00 0.00 57.16 56.93 2oel n GLU 256 Cb 0.15 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.07 2oel n GLU 256 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 2oel n ILE 257 N -0.99 0.00 -3.98 -3.67 5.41 -0.63 -4.58 119.36 110.93 2oel n ILE 257 Ca 0.14 0.29 -0.26 0.00 1.00 0.00 0.00 62.75 63.92 2oel n ILE 257 Cb 0.27 -1.28 -0.02 0.00 -0.71 0.00 0.00 39.64 37.90 2oel n ILE 257 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2oel n ALA 258 N -2.10 -1.96 -2.41 -1.39 0.00 -1.15 -4.73 120.51 106.76 2oel n ALA 258 Ca 0.00 -0.26 -0.28 0.00 0.00 0.00 0.00 53.44 52.91 2oel n ALA 258 Cb 0.00 -1.59 -0.15 0.00 0.00 0.00 0.00 19.45 17.71 2oel n ALA 258 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2oel s VAL 259 N -3.93 1.81 0.56 0.00 1.01 -1.26 -5.09 120.40 113.49 2oel s VAL 259 Ca 0.05 -1.12 -0.20 0.00 0.00 0.00 0.00 61.98 60.71 2oel s VAL 259 Cb -0.03 -1.53 -0.06 0.00 0.00 0.00 0.00 36.38 34.76 2oel s VAL 259 CO 0.89 0.38 1.02 -2.65 0.00 0.00 0.00 175.10 174.74 2oel n PRO 260 N 2.16 1.08 -4.93 2.72 -0.02 -1.26 -4.80 135.00 129.96 2oel n PRO 260 Ca -0.16 0.41 -0.31 0.00 -2.02 0.00 0.00 63.50 61.42 2oel n PRO 260 Cb 0.53 -2.19 -0.17 0.00 -0.02 0.00 0.00 33.50 31.65 2oel n PRO 260 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2oel s ILE 261 N -1.44 1.90 -0.30 4.25 1.01 -1.26 -1.13 121.20 124.22 2oel s ILE 261 Ca 0.73 -0.91 -0.07 0.00 0.00 0.00 0.00 60.65 60.39 2oel s ILE 261 Cb -0.44 -1.67 0.01 0.00 0.01 0.00 0.00 42.46 40.37 2oel s ILE 261 CO 0.49 0.52 0.09 -0.32 0.00 0.00 0.00 174.94 175.73 2oel s MET 262 N 0.56 3.04 -0.09 2.79 -2.45 0.34 -0.72 119.30 122.78 2oel s MET 262 Ca -0.14 -0.89 -0.23 0.00 -1.25 0.00 0.00 55.69 53.17 2oel s MET 262 Cb -0.17 -3.40 -0.03 0.00 1.25 0.00 0.00 34.83 32.48 2oel s MET 262 CO 0.05 -0.47 0.71 0.00 1.05 0.00 0.00 175.02 176.35 2oel s ALA 263 N 1.50 3.38 0.03 4.11 0.00 -0.35 -0.70 121.76 129.72 2oel s ALA 263 Ca 0.02 0.09 -0.09 0.00 0.00 0.00 0.00 51.96 51.98 2oel s ALA 263 Cb -0.17 -3.00 -0.05 0.00 0.00 0.00 0.00 23.12 19.90 2oel s ALA 263 CO 0.03 -0.22 0.33 -1.58 0.00 0.00 0.00 175.76 174.32 2oel s HIS 264 N 1.09 3.60 -1.86 0.00 2.46 -0.55 -2.33 115.29 117.70 2oel s HIS 264 Ca 0.37 0.71 0.27 0.00 0.47 0.00 0.00 55.06 56.87 2oel s HIS 264 Cb -0.17 -2.09 1.52 0.00 -0.13 0.00 0.00 32.58 31.71 2oel s HIS 264 CO 0.17 0.59 1.93 -0.35 -2.47 0.00 0.00 174.74 174.60 2oel n PRO 265 N 1.18 0.72 -1.58 2.88 -0.04 -1.25 -4.31 135.00 132.61 2oel n PRO 265 Ca -0.11 0.01 -0.51 0.00 -0.04 0.00 0.00 63.50 62.85 2oel n PRO 265 Cb 0.53 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.43 2oel n PRO 265 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2oel n ALA 266 N -1.07 -1.01 0.00 0.55 0.00 -1.26 -0.90 120.51 116.81 2oel n ALA 266 Ca 0.18 0.50 0.00 0.00 0.00 0.00 0.00 53.44 54.12 2oel n ALA 266 Cb 0.12 -2.05 0.00 0.00 0.00 0.00 0.00 19.45 17.52 2oel n ALA 266 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2oel n PHE 267 N 2.14 0.00 0.27 0.00 7.35 -1.26 -4.33 117.46 121.63 2oel n PHE 267 Ca 0.17 0.00 0.14 0.00 -0.76 0.00 0.00 57.45 57.00 2oel n PHE 267 Cb 0.20 -0.20 0.78 0.00 0.35 0.00 0.00 39.48 40.61 2oel n PHE 267 CO 0.00 0.00 0.00 0.66 -0.76 0.00 0.00 176.76 176.66 2oel h SER 268 N 0.00 0.00 0.42 -2.13 4.64 -1.38 -1.81 113.55 113.29 2oel h SER 268 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2oel h SER 268 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2oel h SER 268 CO 0.00 0.09 0.00 0.61 -0.87 0.00 0.00 176.83 176.66 2oel n GLY 269 N -0.75 -0.92 0.14 -0.77 0.00 -1.26 -1.79 105.19 99.84 2oel n GLY 269 Ca -0.02 -0.06 0.13 0.00 0.00 0.00 0.00 46.02 46.07 2oel n GLY 269 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oel h ALA 270 N 2.58 0.99 0.00 4.61 0.00 -1.72 -3.38 119.26 122.34 2oel h ALA 270 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.72 2oel h ALA 270 Cb 0.21 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 2oel h ALA 270 CO 0.00 0.00 -1.72 0.28 0.00 0.00 0.00 179.25 177.81 2oel n VAL 271 N -2.50 0.72 0.03 0.00 0.31 -0.74 -4.91 118.33 111.24 2oel n VAL 271 Ca 0.05 -0.33 -0.11 0.00 -0.01 0.00 0.00 64.34 63.94 2oel n VAL 271 Cb 0.46 -0.88 -0.14 0.00 -0.91 0.00 0.00 33.84 32.37 2oel n VAL 271 CO 0.00 0.00 0.00 0.71 -1.32 0.00 0.00 176.83 176.22 2oel h THR 272 N 0.00 1.17 -0.22 2.52 1.35 -1.55 -2.31 112.91 113.87 2oel h THR 272 Ca -0.28 -2.91 -0.02 0.00 -0.55 0.00 0.00 66.41 62.64 2oel h THR 272 Cb 1.50 2.65 -0.01 0.00 -1.73 0.00 0.00 68.15 70.56 2oel h THR 272 CO -0.02 0.75 0.03 1.55 -0.25 0.00 0.00 175.52 177.57 2oel h PRO 273 N 0.03 0.31 -7.09 4.72 0.13 -1.86 -3.42 132.00 124.82 2oel h PRO 273 Ca -0.20 -0.04 -0.55 0.00 -0.87 0.00 0.00 66.00 64.33 2oel h PRO 273 Cb 1.95 -0.06 0.14 0.00 0.13 0.00 0.00 31.00 33.16 2oel h PRO 273 CO 0.12 0.32 0.53 0.45 -0.23 0.00 0.00 178.00 179.19 2oel s SER 274 N -6.84 4.93 0.23 1.44 0.15 -1.26 -4.94 113.70 107.40 2oel s SER 274 Ca -0.06 2.61 0.17 0.00 0.70 0.00 0.00 55.95 59.37 2oel s SER 274 Cb 0.16 -2.62 0.03 0.00 -1.71 0.00 0.00 66.02 61.88 2oel s SER 274 CO 0.72 -1.79 1.24 -0.08 1.20 0.00 0.00 173.24 174.54 2oel h GLU 275 N 0.90 0.00 0.00 5.44 4.81 -2.00 -3.39 114.58 120.34 2oel h GLU 275 Ca -0.51 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.72 2oel h GLU 275 Cb 1.32 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.70 2oel h GLU 275 CO 0.55 0.33 -1.34 1.19 -0.73 0.00 0.00 179.01 179.01 2oel n PHE 276 N -3.06 0.00 -4.51 0.92 3.72 -1.26 -4.95 117.46 108.32 2oel n PHE 276 Ca -0.01 0.00 -0.26 0.00 -0.05 0.00 0.00 57.45 57.13 2oel n PHE 276 Cb 0.72 -0.20 -0.07 0.00 -0.94 0.00 0.00 39.48 38.99 2oel n PHE 276 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2oel n TYR 277 N -1.78 0.15 -4.04 1.38 4.01 -1.26 -2.51 117.16 113.11 2oel n TYR 277 Ca -0.01 -2.67 0.00 0.00 -0.16 0.00 0.00 57.90 55.05 2oel n TYR 277 Cb 0.25 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.27 2oel n TYR 277 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2oel n GLY 278 N -0.87 -0.89 3.02 2.72 0.00 -1.26 -4.47 105.19 103.44 2oel n GLY 278 Ca -0.06 -1.20 -0.23 0.00 0.00 0.00 0.00 46.02 44.53 2oel n GLY 278 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2oel s VAL 279 N 0.00 1.01 0.39 1.61 1.01 -0.87 -0.74 120.40 122.81 2oel s VAL 279 Ca 0.00 -0.45 -0.27 0.00 0.00 0.00 0.00 61.98 61.26 2oel s VAL 279 Cb 0.00 -0.91 -0.10 0.00 0.00 0.00 0.00 36.38 35.37 2oel s VAL 279 CO 0.00 0.32 1.45 0.00 0.00 0.00 0.00 175.10 176.86 2oel s ALA 280 N 0.42 3.48 0.50 5.51 0.00 0.00 -3.84 121.76 127.83 2oel s ALA 280 Ca -0.09 1.51 0.16 0.00 0.00 0.00 0.00 51.96 53.54 2oel s ALA 280 Cb -0.13 -3.59 1.22 0.00 0.00 0.00 0.00 23.12 20.63 2oel s ALA 280 CO 0.02 -1.04 2.10 -1.00 0.00 0.00 0.00 175.76 175.84 2oel h PRO 281 N 2.86 0.09 -0.26 0.00 0.13 -1.92 -1.16 132.00 131.74 2oel h PRO 281 Ca -0.51 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 64.61 2oel h PRO 281 Cb 1.24 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 2oel h PRO 281 CO 0.63 0.06 0.12 0.66 -0.23 0.00 0.00 178.00 179.25 2oel h SER 282 N 0.10 0.32 0.00 1.44 4.64 -1.88 0.37 113.55 118.54 2oel h SER 282 Ca 0.08 -0.02 -0.19 0.00 -0.47 0.00 0.00 61.79 61.19 2oel h SER 282 Cb 0.21 -0.08 -0.03 0.00 -0.31 0.00 0.00 62.40 62.19 2oel h SER 282 CO -0.01 0.28 -1.04 0.25 -0.87 0.00 0.00 176.83 175.44 2oel h LEU 283 N 0.37 0.01 -0.48 5.97 5.85 -1.61 -0.16 115.31 125.27 2oel h LEU 283 Ca 0.09 -0.61 -0.07 0.00 0.84 0.00 0.00 57.88 58.13 2oel h LEU 283 Cb 0.05 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.05 2oel h LEU 283 CO -0.01 1.41 0.01 -0.25 -0.34 0.00 0.00 178.44 179.26 2oel h TRP 284 N -0.97 0.91 0.00 1.25 -0.00 -1.18 -1.13 115.95 114.83 2oel h TRP 284 Ca -0.29 -0.15 -0.29 0.00 -0.00 0.00 0.00 58.89 58.16 2oel h TRP 284 Cb 1.27 -0.24 -0.05 0.00 -0.00 0.00 0.00 29.16 30.14 2oel h TRP 284 CO 0.13 0.86 -2.23 1.28 -0.00 0.00 0.00 178.44 178.49 2oel n LEU 285 N -4.36 0.10 0.00 0.65 4.77 0.09 -4.34 117.00 113.91 2oel n LEU 285 Ca 0.01 0.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 2oel n LEU 285 Cb 0.30 0.37 0.00 0.00 -2.33 0.00 0.00 43.42 41.76 2oel n LEU 285 CO 0.42 0.39 0.00 0.61 -1.33 0.00 0.00 177.39 177.48 2oel n GLY 286 N 1.64 0.40 0.19 -0.72 0.00 -1.00 -4.32 105.19 101.37 2oel n GLY 286 Ca -0.26 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.71 2oel n GLY 286 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2oel h LYS 287 N 0.00 -0.03 -0.45 1.61 3.64 -1.04 -2.12 116.57 118.18 2oel h LYS 287 Ca 0.00 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.26 2oel h LYS 287 Cb 0.00 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 2oel h LYS 287 CO 0.00 -0.02 -0.21 -0.07 -2.27 0.00 0.00 179.45 176.88 2oel h LEU 288 N -0.04 0.93 -0.74 5.20 3.38 -1.47 -2.07 115.31 120.51 2oel h LEU 288 Ca 0.19 -0.35 -0.11 0.00 0.09 0.00 0.00 57.88 57.70 2oel h LEU 288 Cb 0.32 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 2oel h LEU 288 CO -0.42 1.11 -0.27 -0.07 0.09 0.00 0.00 178.44 178.88 2oel h LEU 289 N 0.79 0.67 -0.06 1.67 3.38 -1.70 -0.38 115.31 119.68 2oel h LEU 289 Ca 0.11 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.82 2oel h LEU 289 Cb 0.76 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.33 2oel h LEU 289 CO 0.06 0.91 0.01 -0.09 0.09 0.00 0.00 178.44 179.42 2oel h ARG 290 N 0.57 0.09 -0.73 1.13 2.43 -1.32 -1.34 114.38 115.20 2oel h ARG 290 Ca 0.07 -0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.23 2oel h ARG 290 Cb 0.76 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.26 2oel h ARG 290 CO 0.06 0.32 0.48 1.25 -1.51 0.00 0.00 179.97 180.58 2oel h LEU 291 N -0.16 0.85 -1.19 3.80 6.46 -1.26 -2.26 115.31 121.56 2oel h LEU 291 Ca 0.02 -0.02 -0.06 0.00 -0.12 0.00 0.00 57.88 57.70 2oel h LEU 291 Cb 0.28 -0.21 -0.01 0.00 -0.73 0.00 0.00 40.66 39.99 2oel h LEU 291 CO 0.00 0.61 -0.27 0.00 -0.62 0.00 0.00 178.44 178.17 2oel h ALA 292 N 1.54 1.07 0.00 1.25 0.00 -0.91 -0.78 119.26 121.44 2oel h ALA 292 Ca 0.27 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2oel h ALA 292 Cb -0.11 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.63 2oel h ALA 292 CO -0.06 0.34 0.00 0.41 0.00 0.00 0.00 179.25 179.94 2oel n GLY 293 N 0.01 0.81 3.70 0.00 0.00 -0.85 -3.33 105.19 105.54 2oel n GLY 293 Ca -0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 2oel n GLY 293 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oel s ALA 294 N -1.37 3.40 -0.07 4.61 0.00 -0.56 -4.31 121.76 123.45 2oel s ALA 294 Ca 0.00 0.74 0.14 0.00 0.00 0.00 0.00 51.96 52.83 2oel s ALA 294 Cb 0.00 -3.46 -0.09 0.00 0.00 0.00 0.00 23.12 19.57 2oel s ALA 294 CO 0.00 -0.52 1.11 -0.44 0.00 0.00 0.00 175.76 175.92 2oel h ASP 295 N 7.02 0.00 -4.27 0.00 3.32 -1.27 -3.41 116.42 117.81 2oel h ASP 295 Ca -0.39 0.00 -0.40 0.00 0.02 0.00 0.00 57.03 56.26 2oel h ASP 295 Cb 1.20 0.00 -0.26 0.00 0.22 0.00 0.00 39.33 40.49 2oel h ASP 295 CO 0.83 0.69 -0.78 -0.36 -1.72 0.00 0.00 179.24 177.90 2oel s PHE 296 N -2.85 0.97 -0.12 4.55 0.08 -1.01 -0.42 117.98 119.19 2oel s PHE 296 Ca 0.00 -0.29 -0.02 0.00 0.12 0.00 0.00 56.93 56.74 2oel s PHE 296 Cb 0.08 -0.59 0.04 0.00 -0.57 0.00 0.00 43.02 41.98 2oel s PHE 296 CO 0.79 -0.00 0.01 0.08 -0.10 0.00 0.00 175.22 176.00 2oel s VAL 297 N -0.67 0.45 -0.02 -0.44 1.01 -0.38 -1.22 120.40 119.13 2oel s VAL 297 Ca 0.01 -0.13 -0.18 0.00 0.00 0.00 0.00 61.98 61.68 2oel s VAL 297 Cb -0.06 -0.72 -0.05 0.00 0.00 0.00 0.00 36.38 35.54 2oel s VAL 297 CO 0.00 0.10 0.52 -0.76 0.00 0.00 0.00 175.10 174.96 2oel s LEU 298 N 1.93 4.41 0.11 3.92 1.02 -0.98 -1.20 118.68 127.89 2oel s LEU 298 Ca 0.03 1.04 -0.10 0.00 0.02 0.00 0.00 54.13 55.12 2oel s LEU 298 Cb -0.14 -2.78 0.00 0.00 0.02 0.00 0.00 46.19 43.29 2oel s LEU 298 CO -0.06 0.16 0.25 0.72 0.02 0.00 0.00 176.35 177.43 2oel s PHE 299 N -0.34 0.15 -0.01 0.29 -0.12 -0.95 -3.79 117.98 113.21 2oel s PHE 299 Ca 0.28 -0.55 -0.35 0.00 -0.05 0.00 0.00 56.93 56.26 2oel s PHE 299 Cb -0.17 -0.00 -0.13 0.00 -0.63 0.00 0.00 43.02 42.08 2oel s PHE 299 CO 0.15 -0.61 1.72 -2.30 -0.05 0.00 0.00 175.22 174.12 2oel n PRO 300 N -0.12 1.96 -1.63 1.99 -0.02 -1.26 0.02 135.00 135.93 2oel n PRO 300 Ca -0.13 0.71 -0.30 0.00 -2.02 0.00 0.00 63.50 61.76 2oel n PRO 300 Cb 0.63 -2.50 0.08 0.00 -0.02 0.00 0.00 33.50 31.69 2oel n PRO 300 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2oel s SER 301 N 2.65 4.64 -0.26 2.55 1.04 -0.44 -4.61 113.70 119.28 2oel s SER 301 Ca 0.88 1.23 0.05 0.00 0.48 0.00 0.00 55.95 58.59 2oel s SER 301 Cb -0.75 -1.96 0.49 0.00 0.10 0.00 0.00 66.02 63.89 2oel s SER 301 CO 0.48 -1.86 1.54 -0.81 0.98 0.00 0.00 173.24 173.57 2oel n PRO 302 N -3.36 2.44 -4.26 4.02 -0.04 -1.26 -0.91 135.00 131.64 2oel n PRO 302 Ca 0.07 -2.09 -0.18 0.00 -0.04 0.00 0.00 63.50 61.26 2oel n PRO 302 Cb 0.57 -1.88 -0.11 0.00 -0.04 0.00 0.00 33.50 32.04 2oel n PRO 302 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2oel s TYR 303 N -2.24 1.44 0.00 0.54 2.02 -1.26 -4.66 117.35 113.20 2oel s TYR 303 Ca 0.38 -0.58 0.00 0.00 -0.37 0.00 0.00 57.07 56.51 2oel s TYR 303 Cb 0.31 -0.74 0.00 0.00 -0.40 0.00 0.00 41.96 41.13 2oel s TYR 303 CO 0.09 0.17 0.00 0.41 -1.57 0.00 0.00 175.55 174.65 2oel n GLY 304 N 0.34 -2.17 0.39 0.71 0.00 -1.26 -3.83 105.19 99.36 2oel n GLY 304 Ca -0.14 -1.63 0.17 0.00 0.00 0.00 0.00 46.02 44.42 2oel n GLY 304 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2oel h SER 305 N 0.00 0.45 -0.80 1.61 4.64 -1.95 -2.68 113.55 114.83 2oel h SER 305 Ca 0.00 0.04 -0.47 0.00 -0.47 0.00 0.00 61.79 60.89 2oel h SER 305 Cb 0.00 -0.05 -0.42 0.00 -0.31 0.00 0.00 62.40 61.62 2oel h SER 305 CO 0.00 0.20 -0.91 1.33 -0.87 0.00 0.00 176.83 176.59 2oel n VAL 306 N -4.52 2.10 -1.68 0.95 0.24 -1.26 -5.08 118.33 109.07 2oel n VAL 306 Ca 0.18 -3.93 -0.44 0.00 -2.04 0.00 0.00 64.34 58.11 2oel n VAL 306 Cb 0.62 -0.44 -0.02 0.00 -1.47 0.00 0.00 33.84 32.53 2oel n VAL 306 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2oel n ALA 307 N -0.61 1.27 -1.90 2.33 0.00 -1.01 -4.88 120.51 115.72 2oel n ALA 307 Ca 0.32 0.39 -0.38 0.00 0.00 0.00 0.00 53.44 53.77 2oel n ALA 307 Cb 0.87 -2.28 -0.06 0.00 0.00 0.00 0.00 19.45 17.98 2oel n ALA 307 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2oel s LEU 308 N -0.30 4.46 0.02 0.00 2.96 -0.09 -4.89 118.68 120.85 2oel s LEU 308 Ca 0.64 1.72 -0.37 0.00 -0.22 0.00 0.00 54.13 55.90 2oel s LEU 308 Cb -0.61 -3.67 -0.16 0.00 0.50 0.00 0.00 46.19 42.26 2oel s LEU 308 CO 0.54 0.07 1.51 1.21 -1.32 0.00 0.00 176.35 178.35 2oel n GLU 309 N 1.03 1.45 -0.36 1.98 0.00 -1.26 -4.18 120.64 119.29 2oel n GLU 309 Ca -0.02 0.52 0.01 0.00 0.00 0.00 0.00 57.16 57.68 2oel n GLU 309 Cb 0.49 -2.22 0.08 0.00 0.00 0.00 0.00 31.44 29.79 2oel n GLU 309 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.13 177.04 2oel h ARG 310 N 5.70 -0.01 -0.50 5.31 2.43 -1.93 0.15 114.38 125.53 2oel h ARG 310 Ca -0.47 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 58.70 2oel h ARG 310 Cb 1.31 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.84 2oel h ARG 310 CO 0.85 -0.01 0.31 0.93 -1.51 0.00 0.00 179.97 180.54 2oel h GLU 311 N -0.01 0.67 -0.22 0.20 4.39 -1.99 -0.27 114.58 117.35 2oel h GLU 311 Ca 0.39 -0.05 -0.04 0.00 0.34 0.00 0.00 59.36 60.00 2oel h GLU 311 Cb 0.64 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 29.14 2oel h GLU 311 CO -0.97 0.47 -0.00 1.96 -1.16 0.00 0.00 179.01 179.30 2oel h GLN 312 N 0.68 0.38 -0.53 2.33 1.08 -1.09 -0.28 115.11 117.69 2oel h GLN 312 Ca 0.18 -0.12 -0.01 0.00 -1.45 0.00 0.00 58.65 57.25 2oel h GLN 312 Cb -0.03 -0.03 -0.03 0.00 -0.05 0.00 0.00 27.48 27.34 2oel h GLN 312 CO -0.04 0.58 0.30 0.00 -0.95 0.00 0.00 178.83 178.73 2oel h ALA 313 N 0.79 0.68 -0.51 3.87 0.00 -0.69 -1.96 119.26 121.44 2oel h ALA 313 Ca 0.06 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 2oel h ALA 313 Cb 0.41 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 2oel h ALA 313 CO 0.01 0.18 0.04 -0.07 0.00 0.00 0.00 179.25 179.41 2oel h LEU 314 N 0.71 0.78 -1.36 0.00 3.38 -1.01 -2.51 115.31 115.30 2oel h LEU 314 Ca 0.19 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 2oel h LEU 314 Cb 0.02 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 2oel h LEU 314 CO -0.03 0.83 0.23 1.23 0.09 0.00 0.00 178.44 180.78 2oel h GLY 315 N 0.98 0.71 0.69 0.83 0.00 -0.48 0.77 103.07 106.57 2oel h GLY 315 Ca 0.16 -0.32 -0.02 0.00 0.00 0.00 0.00 47.33 47.15 2oel h GLY 315 CO 0.01 0.31 -0.02 -2.22 0.00 0.00 0.00 176.54 174.62 2oel h ILE 316 N 0.67 1.29 -0.96 2.60 2.04 -0.97 -2.17 117.51 120.02 2oel h ILE 316 Ca 0.17 -0.93 0.02 0.00 1.00 0.00 0.00 64.86 65.11 2oel h ILE 316 Cb 0.07 1.78 -0.05 0.00 -0.74 0.00 0.00 36.82 37.88 2oel h ILE 316 CO -0.02 0.26 0.64 0.00 0.00 0.00 0.00 178.15 179.02 2oel h ALA 317 N 0.66 1.33 -0.47 1.87 0.00 -1.04 -1.64 119.26 119.98 2oel h ALA 317 Ca 0.02 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2oel h ALA 317 Cb 0.42 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2oel h ALA 317 CO 0.01 0.61 0.16 0.00 0.00 0.00 0.00 179.25 180.03 2oel h ARG 318 N 1.28 0.71 -0.51 0.00 3.08 -0.77 -1.73 114.38 116.44 2oel h ARG 318 Ca 0.36 -0.14 -0.03 0.00 0.07 0.00 0.00 59.98 60.23 2oel h ARG 318 Cb -0.11 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 29.81 2oel h ARG 318 CO -0.09 0.67 0.18 0.00 -1.07 0.00 0.00 179.97 179.66 2oel h ALA 319 N 1.01 1.36 0.00 0.04 0.00 -0.92 0.20 119.26 120.96 2oel h ALA 319 Ca 0.15 -0.15 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 2oel h ALA 319 Cb 0.24 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2oel h ALA 319 CO -0.01 0.47 -0.43 -0.07 0.00 0.00 0.00 179.25 179.21 2oel h LEU 320 N 0.73 0.00 -0.57 0.00 3.38 -0.95 -3.35 115.31 114.56 2oel h LEU 320 Ca 0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.14 2oel h LEU 320 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 2oel h LEU 320 CO -0.01 0.43 -0.09 0.35 0.09 0.00 0.00 178.44 179.21 2oel n THR 321 N -3.70 0.00 -1.63 0.22 -2.24 -0.68 -0.77 114.28 105.48 2oel n THR 321 Ca -0.01 -0.45 -0.55 0.00 -2.27 0.00 0.00 64.05 60.76 2oel n THR 321 Cb 0.51 1.04 -0.07 0.00 -2.10 0.00 0.00 70.33 69.71 2oel n THR 321 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2oel n ASP 322 N -0.44 2.38 0.00 3.42 -0.08 0.67 -4.82 116.55 117.68 2oel n ASP 322 Ca 0.02 0.91 0.10 0.00 -1.51 0.00 0.00 54.79 54.30 2oel n ASP 322 Cb 0.08 -1.18 0.53 0.00 2.34 0.00 0.00 41.12 42.89 2oel n ASP 322 CO 0.00 0.00 0.00 -0.90 0.12 0.00 0.00 177.20 176.42 2oel n ASP 323 N 6.55 0.00 -0.02 1.67 5.68 -1.26 -2.95 116.55 126.22 2oel n ASP 323 Ca 0.30 -0.22 0.14 0.00 -0.50 0.00 0.00 54.79 54.51 2oel n ASP 323 Cb 0.16 -0.18 0.59 0.00 -1.14 0.00 0.00 41.12 40.55 2oel n ASP 323 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2oel n GLN 324 N -1.18 0.22 -3.35 0.11 1.13 -1.26 -4.85 117.38 108.21 2oel n GLN 324 Ca 0.11 -0.04 -0.33 0.00 -1.94 0.00 0.00 57.00 54.80 2oel n GLN 324 Cb 0.12 -1.50 -0.06 0.00 0.11 0.00 0.00 30.24 28.92 2oel n GLN 324 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 2oel s GLU 325 N -2.81 3.87 0.00 -1.09 0.41 -1.15 -4.96 118.70 112.97 2oel s GLU 325 Ca 0.20 0.39 0.00 0.00 -0.41 0.00 0.00 54.97 55.15 2oel s GLU 325 Cb 0.19 -2.65 0.00 0.00 -1.78 0.00 0.00 34.13 29.90 2oel s GLU 325 CO 0.53 0.31 0.69 -0.35 -0.49 0.00 0.00 175.26 175.94 2oel n PRO 326 N -0.04 1.00 -4.37 0.39 -0.04 -1.26 -4.79 135.00 125.89 2oel n PRO 326 Ca 0.00 0.00 -0.23 0.00 -0.04 0.00 0.00 63.50 63.23 2oel n PRO 326 Cb 0.52 -1.31 -0.11 0.00 -0.04 0.00 0.00 33.50 32.56 2oel n PRO 326 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2oel s PHE 327 N -0.63 2.00 0.83 0.54 0.08 -1.26 -4.96 117.98 114.58 2oel s PHE 327 Ca 0.00 -0.43 -0.10 0.00 0.12 0.00 0.00 56.93 56.52 2oel s PHE 327 Cb 0.00 -0.98 0.09 0.00 -0.57 0.00 0.00 43.02 41.56 2oel s PHE 327 CO 0.00 0.41 1.12 0.00 -0.10 0.00 0.00 175.22 176.65 2oel s ALA 328 N -1.98 1.95 0.32 5.36 0.00 -1.26 -4.97 121.76 121.18 2oel s ALA 328 Ca 0.18 0.41 -0.26 0.00 0.00 0.00 0.00 51.96 52.29 2oel s ALA 328 Cb -0.06 -3.35 -0.10 0.00 0.00 0.00 0.00 23.12 19.61 2oel s ALA 328 CO 0.08 -2.15 0.97 1.03 0.00 0.00 0.00 175.76 175.69 2oel s ARG 329 N -4.77 4.55 -0.01 0.00 0.52 -1.26 -4.42 118.95 113.56 2oel s ARG 329 Ca 0.64 1.42 -0.03 0.00 -0.52 0.00 0.00 55.73 57.24 2oel s ARG 329 Cb -0.20 -2.84 -0.04 0.00 0.52 0.00 0.00 34.95 32.39 2oel s ARG 329 CO 0.56 0.23 0.18 0.00 0.02 0.00 0.00 175.30 176.29 2oel s ALA 330 N -1.54 3.93 -0.12 2.13 0.00 0.05 -0.64 121.76 125.58 2oel s ALA 330 Ca 0.50 -0.77 -0.29 0.00 0.00 0.00 0.00 51.96 51.39 2oel s ALA 330 Cb -0.21 -1.86 -0.03 0.00 0.00 0.00 0.00 23.12 21.01 2oel s ALA 330 CO 0.27 0.74 1.48 -0.06 0.00 0.00 0.00 175.76 178.19 2oel s PHE 331 N -1.32 2.37 -0.02 0.00 2.99 0.44 -4.46 117.98 117.98 2oel s PHE 331 Ca 0.27 0.58 -0.30 0.00 0.00 0.00 0.00 56.93 57.48 2oel s PHE 331 Cb -0.13 -3.75 -0.03 0.00 0.00 0.00 0.00 43.02 39.12 2oel s PHE 331 CO 0.18 -2.83 1.00 -2.14 -0.00 0.00 0.00 175.22 171.43 2oel s PRO 332 N 3.86 4.52 -0.53 0.24 0.02 -1.26 -1.25 135.00 140.59 2oel s PRO 332 Ca 0.65 1.44 0.04 0.00 0.02 0.00 0.00 61.00 63.14 2oel s PRO 332 Cb -0.27 -3.48 0.16 0.00 0.02 0.00 0.00 34.50 30.93 2oel s PRO 332 CO 0.23 -0.13 0.36 0.08 -0.33 0.00 0.00 177.00 177.20 2oel s VAL 333 N 1.28 1.76 0.09 3.83 1.01 -0.34 -2.59 120.40 125.45 2oel s VAL 333 Ca 0.52 -3.24 -0.31 0.00 0.00 0.00 0.00 61.98 58.95 2oel s VAL 333 Cb -0.21 -2.19 -0.09 0.00 0.00 0.00 0.00 36.38 33.89 2oel s VAL 333 CO 0.25 -1.01 1.78 -2.16 0.00 0.00 0.00 175.10 173.96 2oel s PRO 334 N -0.40 4.16 0.06 2.72 0.04 -1.26 -2.23 135.00 138.08 2oel s PRO 334 Ca 0.24 2.50 0.08 0.00 0.04 0.00 0.00 61.00 63.86 2oel s PRO 334 Cb -0.11 -3.66 -0.03 0.00 0.04 0.00 0.00 34.50 30.74 2oel s PRO 334 CO -0.11 -0.82 -0.23 -1.12 0.04 0.00 0.00 177.00 174.77 2oel s SER 335 N 2.80 2.74 0.00 6.66 0.01 0.10 -4.32 113.70 121.69 2oel s SER 335 Ca 0.79 -0.59 0.00 0.00 1.31 0.00 0.00 55.95 57.46 2oel s SER 335 Cb -0.43 -0.22 0.00 0.00 0.21 0.00 0.00 66.02 65.58 2oel s SER 335 CO 0.35 0.17 0.00 0.00 0.41 0.00 0.00 173.24 174.17 2oel n ALA 336 N 1.62 -0.35 -1.37 1.44 0.00 -1.26 -1.33 120.51 119.26 2oel n ALA 336 Ca -0.18 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.16 2oel n ALA 336 Cb 0.53 -0.12 -0.04 0.00 0.00 0.00 0.00 19.45 19.82 2oel n ALA 336 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2oel n GLY 337 N 1.27 1.10 3.77 0.00 0.00 -1.26 -4.54 105.19 105.53 2oel n GLY 337 Ca 0.00 -0.54 -0.37 0.00 0.00 0.00 0.00 46.02 45.11 2oel n GLY 337 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2oel s ILE 338 N -2.40 5.22 0.11 -0.61 -1.09 -1.26 -4.50 121.20 116.66 2oel s ILE 338 Ca 0.00 0.69 -0.13 0.00 -2.23 0.00 0.00 60.65 58.99 2oel s ILE 338 Cb 0.00 -3.68 0.02 0.00 -1.58 0.00 0.00 42.46 37.22 2oel s ILE 338 CO 0.00 0.44 0.31 -1.38 -1.23 0.00 0.00 174.94 173.08 2oel s HIS 339 N -0.03 -0.05 0.32 3.97 -3.43 -1.26 -4.88 115.29 109.92 2oel s HIS 339 Ca 0.20 -0.32 0.10 0.00 -0.80 0.00 0.00 55.06 54.24 2oel s HIS 339 Cb -0.14 0.11 0.91 0.00 -1.43 0.00 0.00 32.58 32.03 2oel s HIS 339 CO 0.08 -0.63 1.71 -1.35 -2.00 0.00 0.00 174.74 172.55 2oel h PRO 340 N 2.56 0.49 0.00 -0.38 0.11 -1.92 0.43 132.00 133.28 2oel h PRO 340 Ca -0.34 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.74 2oel h PRO 340 Cb 1.23 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2oel h PRO 340 CO 0.51 0.32 0.00 0.41 -0.21 0.00 0.00 178.00 179.03 2oel n GLY 341 N -1.31 -0.75 0.01 -0.55 0.00 -1.25 -1.83 105.19 99.50 2oel n GLY 341 Ca 0.27 0.01 0.11 0.00 0.00 0.00 0.00 46.02 46.40 2oel n GLY 341 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2oel n LEU 342 N -1.61 0.77 -0.23 0.99 4.77 0.14 -1.33 117.00 120.50 2oel n LEU 342 Ca 0.01 -0.29 0.04 0.00 -0.03 0.00 0.00 56.01 55.74 2oel n LEU 342 Cb 0.07 -0.07 0.15 0.00 -2.33 0.00 0.00 43.42 41.24 2oel n LEU 342 CO 0.07 0.18 0.91 0.58 -1.33 0.00 0.00 177.39 177.79 2oel h VAL 343 N 0.00 0.53 -0.80 4.08 2.07 -1.43 -0.72 116.25 119.99 2oel h VAL 343 Ca 0.00 -0.08 0.06 0.00 0.82 0.00 0.00 66.70 67.50 2oel h VAL 343 Cb 0.56 0.28 -0.06 0.00 -1.52 0.00 0.00 31.29 30.55 2oel h VAL 343 CO 0.00 0.04 0.48 -0.65 0.02 0.00 0.00 177.57 177.46 2oel h PRO 344 N 0.23 0.85 -0.41 1.57 0.11 -1.81 -1.57 132.00 130.96 2oel h PRO 344 Ca 0.38 -0.05 -0.15 0.00 0.11 0.00 0.00 66.00 66.28 2oel h PRO 344 Cb 0.62 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.53 2oel h PRO 344 CO -0.50 0.56 -0.34 1.25 -0.21 0.00 0.00 178.00 178.76 2oel h LEU 345 N 0.88 1.02 -0.23 2.35 5.85 -1.59 -1.14 115.31 122.44 2oel h LEU 345 Ca 0.35 -0.44 0.03 0.00 0.84 0.00 0.00 57.88 58.66 2oel h LEU 345 Cb 0.18 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 40.89 2oel h LEU 345 CO -0.18 1.25 0.03 0.40 -0.34 0.00 0.00 178.44 179.60 2oel h ILE 346 N 0.80 0.88 -0.49 4.05 2.04 -0.71 0.32 117.51 124.39 2oel h ILE 346 Ca 0.08 -0.04 -0.10 0.00 1.00 0.00 0.00 64.86 65.79 2oel h ILE 346 Cb 0.93 0.75 -0.02 0.00 -0.74 0.00 0.00 36.82 37.75 2oel h ILE 346 CO 0.09 0.02 -0.09 0.40 0.00 0.00 0.00 178.15 178.57 2oel h ILE 347 N 0.12 1.26 -0.54 -0.67 2.04 -1.25 0.19 117.51 118.66 2oel h ILE 347 Ca 0.11 -1.20 -0.07 0.00 1.00 0.00 0.00 64.86 64.70 2oel h ILE 347 Cb 0.11 0.98 -0.02 0.00 -0.74 0.00 0.00 36.82 37.15 2oel h ILE 347 CO -0.15 0.42 0.06 -0.09 0.00 0.00 0.00 178.15 178.39 2oel h ARG 348 N 0.81 0.91 -0.05 2.37 2.43 -0.66 0.24 114.38 120.42 2oel h ARG 348 Ca 0.13 -0.26 -0.08 0.00 -0.81 0.00 0.00 59.98 58.97 2oel h ARG 348 Cb 0.61 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.07 2oel h ARG 348 CO 0.04 0.89 -0.27 -0.44 -1.51 0.00 0.00 179.97 178.68 2oel h ASP 349 N 0.79 0.33 -0.00 -3.80 3.32 -0.15 -3.38 116.42 113.52 2oel h ASP 349 Ca 0.16 -0.66 0.00 0.00 0.02 0.00 0.00 57.03 56.55 2oel h ASP 349 Cb 0.44 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.90 2oel h ASP 349 CO 0.02 0.94 -0.67 0.49 -1.72 0.00 0.00 179.24 178.29 2oel n PHE 350 N -4.48 0.00 -1.20 4.55 3.72 0.64 -5.04 117.46 115.65 2oel n PHE 350 Ca -0.09 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.31 2oel n PHE 350 Cb 0.48 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.02 2oel n PHE 350 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2oel n GLY 351 N 1.34 -2.49 0.16 1.37 0.00 0.84 -4.52 105.19 101.90 2oel n GLY 351 Ca 0.04 -1.65 0.04 0.00 0.00 0.00 0.00 46.02 44.45 2oel n GLY 351 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2oel h LEU 352 N 0.00 0.00 -5.97 0.99 3.38 -1.89 -3.36 115.31 108.45 2oel h LEU 352 Ca 0.00 0.00 -0.74 0.00 0.09 0.00 0.00 57.88 57.23 2oel h LEU 352 Cb 0.00 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 40.63 2oel h LEU 352 CO 0.00 0.45 2.41 0.47 0.09 0.00 0.00 178.44 181.85 2oel n ASP 353 N -3.27 6.50 -3.88 -0.43 8.00 -1.26 -3.12 116.55 119.09 2oel n ASP 353 Ca 0.02 -3.06 -0.13 0.00 0.71 0.00 0.00 54.79 52.33 2oel n ASP 353 Cb 0.67 -1.45 -0.08 0.00 -0.02 0.00 0.00 41.12 40.25 2oel n ASP 353 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 2oel s THR 354 N 0.08 0.00 -0.09 -3.53 -1.32 -1.26 -4.46 115.64 105.06 2oel s THR 354 Ca 0.48 -1.78 0.04 0.00 -1.21 0.00 0.00 61.69 59.22 2oel s THR 354 Cb 0.14 -2.45 0.00 0.00 -1.51 0.00 0.00 72.50 68.69 2oel s THR 354 CO -0.05 0.00 -0.21 -0.63 -2.21 0.00 0.00 174.62 171.52 2oel s ILE 355 N -3.84 1.82 -0.38 5.08 1.01 -1.07 -1.98 121.20 121.84 2oel s ILE 355 Ca 0.34 -0.88 -0.25 0.00 0.00 0.00 0.00 60.65 59.85 2oel s ILE 355 Cb 0.03 -1.59 0.02 0.00 0.01 0.00 0.00 42.46 40.93 2oel s ILE 355 CO 0.15 0.51 0.90 -0.69 0.00 0.00 0.00 174.94 175.80 2oel s VAL 356 N 0.40 4.60 -0.67 2.92 1.01 0.40 -4.28 120.40 124.78 2oel s VAL 356 Ca -0.17 1.07 -0.17 0.00 0.00 0.00 0.00 61.98 62.71 2oel s VAL 356 Cb -0.17 -4.32 0.13 0.00 0.00 0.00 0.00 36.38 32.02 2oel s VAL 356 CO 0.07 -0.55 0.74 0.21 0.00 0.00 0.00 175.10 175.57 2oel s ASN 357 N 1.92 6.35 0.15 3.32 3.84 -1.26 -1.51 114.94 127.75 2oel s ASN 357 Ca 0.37 -1.82 0.18 0.00 0.21 0.00 0.00 52.86 51.79 2oel s ASN 357 Cb -0.12 -2.28 0.77 0.00 -0.55 0.00 0.00 41.25 39.07 2oel s ASN 357 CO 0.19 -0.96 1.54 0.00 -2.79 0.00 0.00 177.10 175.08 2oel n ALA 358 N 5.72 1.50 -0.43 1.71 0.00 0.61 -4.66 120.51 124.96 2oel n ALA 358 Ca -0.01 0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.47 2oel n ALA 358 Cb 0.44 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.61 2oel n ALA 358 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2oel n GLY 359 N -0.36 1.35 0.03 0.00 0.00 -1.24 -2.05 105.19 102.92 2oel n GLY 359 Ca 0.02 -0.49 0.14 0.00 0.00 0.00 0.00 46.02 45.69 2oel n GLY 359 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2oel n GLY 360 N 0.00 -1.28 0.30 -0.02 0.00 -1.26 -1.32 105.19 101.61 2oel n GLY 360 Ca 0.00 -0.20 0.19 0.00 0.00 0.00 0.00 46.02 46.01 2oel n GLY 360 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2oel h GLY 361 N 4.99 0.00 1.61 -0.02 0.00 -1.75 -2.92 103.07 104.97 2oel h GLY 361 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 47.33 47.37 2oel h GLY 361 CO 0.00 0.00 0.18 1.19 0.00 0.00 0.00 176.54 177.91 2oel h ILE 362 N 0.00 0.97 0.00 2.60 2.10 -1.58 -0.55 117.51 121.06 2oel h ILE 362 Ca -0.00 -0.07 0.00 0.00 1.08 0.00 0.00 64.86 65.87 2oel h ILE 362 Cb 0.33 0.76 0.00 0.00 -1.09 0.00 0.00 36.82 36.83 2oel h ILE 362 CO 0.00 0.03 0.00 0.45 -1.08 0.00 0.00 178.15 177.56 2oel h HIS 363 N 0.19 0.00 0.00 2.19 3.86 -1.80 -3.13 115.15 116.46 2oel h HIS 363 Ca 0.11 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.32 2oel h HIS 363 Cb 0.21 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.68 2oel h HIS 363 CO -0.00 0.00 0.00 0.41 0.86 0.00 0.00 177.93 179.20 2oel n GLY 364 N 0.41 -1.10 3.77 2.45 0.00 -0.21 -4.40 105.19 106.11 2oel n GLY 364 Ca 0.02 -0.18 -0.37 0.00 0.00 0.00 0.00 46.02 45.49 2oel n GLY 364 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2oel s HIS 365 N -2.22 2.79 0.43 1.61 5.04 -1.18 -4.90 115.29 116.86 2oel s HIS 365 Ca 0.40 1.50 0.24 0.00 -1.54 0.00 0.00 55.06 55.66 2oel s HIS 365 Cb 0.21 -3.46 1.24 0.00 0.04 0.00 0.00 32.58 30.61 2oel s HIS 365 CO 0.40 -1.75 1.74 -1.35 -2.34 0.00 0.00 174.74 171.44 2oel h PRO 366 N 2.04 0.26 -0.81 2.88 0.11 -1.91 -0.07 132.00 134.50 2oel h PRO 366 Ca -0.50 -0.02 -0.47 0.00 0.11 0.00 0.00 66.00 65.12 2oel h PRO 366 Cb 1.25 -0.06 -0.26 0.00 0.11 0.00 0.00 31.00 32.04 2oel h PRO 366 CO 0.60 0.17 0.39 -0.25 -0.21 0.00 0.00 178.00 178.71 2oel n ASP 367 N -4.58 4.50 -0.60 -2.05 8.00 -1.26 -5.07 116.55 115.49 2oel n ASP 367 Ca 0.28 -3.72 0.00 0.00 0.71 0.00 0.00 54.79 52.06 2oel n ASP 367 Cb 1.06 -0.78 0.00 0.00 -0.02 0.00 0.00 41.12 41.38 2oel n ASP 367 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2oel n GLY 368 N -1.05 -1.28 0.35 0.44 0.00 -0.04 -2.83 105.19 100.78 2oel n GLY 368 Ca 0.52 -1.14 0.09 0.00 0.00 0.00 0.00 46.02 45.49 2oel n GLY 368 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oel h ALA 369 N -0.64 1.84 -0.26 4.61 0.00 -1.77 -0.24 119.26 122.81 2oel h ALA 369 Ca 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2oel h ALA 369 Cb 0.00 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2oel h ALA 369 CO 0.00 0.04 0.12 0.82 0.00 0.00 0.00 179.25 180.23 2oel h ILE 370 N 0.58 1.16 -0.56 0.00 2.04 -1.69 0.18 117.51 119.21 2oel h ILE 370 Ca 0.29 -0.45 -0.11 0.00 1.00 0.00 0.00 64.86 65.59 2oel h ILE 370 Cb 0.37 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 37.40 2oel h ILE 370 CO -0.09 0.16 -0.07 1.23 0.00 0.00 0.00 178.15 179.38 2oel h GLY 371 N 0.29 1.11 1.00 5.37 0.00 -1.26 -1.50 103.07 108.09 2oel h GLY 371 Ca 0.09 -0.87 0.00 0.00 0.00 0.00 0.00 47.33 46.56 2oel h GLY 371 CO -0.01 0.79 0.34 -1.33 0.00 0.00 0.00 176.54 176.33 2oel h GLY 372 N 0.96 0.74 1.19 4.60 0.00 -0.70 -0.41 103.07 109.46 2oel h GLY 372 Ca 0.15 -0.29 -0.13 0.00 0.00 0.00 0.00 47.33 47.06 2oel h GLY 372 CO 0.04 0.28 -0.25 -1.33 0.00 0.00 0.00 176.54 175.29 2oel h GLY 373 N 0.71 1.00 1.35 4.60 0.00 -0.54 -2.36 103.07 107.82 2oel h GLY 373 Ca 0.19 -0.90 -0.03 0.00 0.00 0.00 0.00 47.33 46.59 2oel h GLY 373 CO -0.04 0.81 0.24 3.21 0.00 0.00 0.00 176.54 180.77 2oel h ARG 374 N 0.79 0.84 -0.34 4.80 3.08 -0.64 -0.43 114.38 122.47 2oel h ARG 374 Ca 0.10 -0.12 -0.04 0.00 0.07 0.00 0.00 59.98 59.98 2oel h ARG 374 Cb 0.81 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.70 2oel h ARG 374 CO 0.07 0.68 0.05 0.00 -1.07 0.00 0.00 179.97 179.70 2oel h ALA 375 N 1.43 0.46 -0.23 0.04 0.00 -0.85 -1.04 119.26 119.08 2oel h ALA 375 Ca 0.20 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2oel h ALA 375 Cb 0.15 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2oel h ALA 375 CO -0.02 0.16 0.06 0.74 0.00 0.00 0.00 179.25 180.19 2oel h PHE 376 N 0.40 0.38 -0.86 0.00 0.04 -1.02 -1.34 116.94 114.55 2oel h PHE 376 Ca 0.10 -0.04 -0.02 0.00 2.80 0.00 0.00 57.97 60.81 2oel h PHE 376 Cb 0.36 -0.11 -0.04 0.00 2.20 0.00 0.00 35.95 38.37 2oel h PHE 376 CO 0.03 0.46 0.46 0.00 -0.60 0.00 0.00 178.31 178.66 2oel h ARG 377 N 0.19 1.20 -0.59 1.51 2.47 -1.05 -0.43 114.38 117.67 2oel h ARG 377 Ca 0.07 -0.14 -0.07 0.00 -1.26 0.00 0.00 59.98 58.58 2oel h ARG 377 Cb 0.27 -0.23 -0.03 0.00 -1.65 0.00 0.00 29.97 28.33 2oel h ARG 377 CO 0.00 0.88 0.10 0.00 0.56 0.00 0.00 179.97 181.52 2oel h ALA 378 N 1.30 1.07 -0.34 0.04 0.00 -1.03 -1.64 119.26 118.66 2oel h ALA 378 Ca 0.30 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 2oel h ALA 378 Cb 0.04 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2oel h ALA 378 CO -0.05 0.61 -0.13 0.00 0.00 0.00 0.00 179.25 179.68 2oel h ALA 379 N 1.21 0.47 -0.34 0.00 0.00 -0.58 -2.03 119.26 117.99 2oel h ALA 379 Ca 0.19 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2oel h ALA 379 Cb 0.38 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2oel h ALA 379 CO 0.01 0.37 0.22 0.82 0.00 0.00 0.00 179.25 180.66 2oel h ILE 380 N 0.47 1.10 -0.96 0.00 2.04 -0.90 -2.54 117.51 116.71 2oel h ILE 380 Ca 0.08 -0.20 0.01 0.00 1.00 0.00 0.00 64.86 65.75 2oel h ILE 380 Cb 0.66 0.62 -0.05 0.00 -0.74 0.00 0.00 36.82 37.31 2oel h ILE 380 CO 0.04 0.10 0.64 0.44 0.00 0.00 0.00 178.15 179.37 2oel h ASP 381 N 0.45 1.10 -0.09 1.72 3.32 -1.23 -2.33 116.42 119.37 2oel h ASP 381 Ca 0.12 -0.03 0.03 0.00 0.02 0.00 0.00 57.03 57.17 2oel h ASP 381 Cb -0.03 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.22 2oel h ASP 381 CO -0.03 0.79 -0.07 0.00 -1.72 0.00 0.00 179.24 178.22 2oel h ALA 382 N 1.36 0.01 -0.86 3.45 0.00 -0.97 0.19 119.26 122.43 2oel h ALA 382 Ca 0.35 0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.32 2oel h ALA 382 Cb -0.14 0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 2oel h ALA 382 CO -0.08 -0.53 0.56 0.28 0.00 0.00 0.00 179.25 179.48 2oel h VAL 383 N -0.08 1.19 0.00 0.00 2.07 -1.23 -1.11 116.25 117.09 2oel h VAL 383 Ca 0.06 -0.39 -0.07 0.00 0.82 0.00 0.00 66.70 67.12 2oel h VAL 383 Cb 0.16 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 29.88 2oel h VAL 383 CO -0.14 0.21 -0.35 -0.07 0.02 0.00 0.00 177.57 177.24 2oel h LEU 384 N 1.13 0.00 -0.77 2.57 4.07 -0.89 -2.06 115.31 119.36 2oel h LEU 384 Ca 0.33 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.29 2oel h LEU 384 Cb -0.08 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.66 2oel h LEU 384 CO -0.09 0.35 0.00 0.00 -1.08 0.00 0.00 178.44 177.62 2oel n ALA 385 N -2.34 2.53 -3.44 1.53 0.00 0.62 -4.92 120.51 114.49 2oel n ALA 385 Ca -0.01 -0.40 -0.19 0.00 0.00 0.00 0.00 53.44 52.85 2oel n ALA 385 Cb 0.45 -1.12 0.08 0.00 0.00 0.00 0.00 19.45 18.86 2oel n ALA 385 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2oel n GLY 386 N 0.99 -0.39 3.08 0.00 0.00 -0.77 -5.02 105.19 103.07 2oel n GLY 386 Ca 0.14 0.13 -0.12 0.00 0.00 0.00 0.00 46.02 46.17 2oel n GLY 386 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2oel s ARG 387 N -5.66 0.58 0.47 1.61 1.70 -0.51 -5.04 118.95 112.10 2oel s ARG 387 Ca 0.21 -0.88 -0.24 0.00 -0.47 0.00 0.00 55.73 54.35 2oel s ARG 387 Cb -0.09 -0.24 -0.07 0.00 -0.57 0.00 0.00 34.95 33.98 2oel s ARG 387 CO 0.70 0.03 1.29 -1.25 -1.08 0.00 0.00 175.30 174.99 2oel s PRO 388 N -2.09 3.62 0.28 3.89 0.04 -1.26 -4.11 135.00 135.37 2oel s PRO 388 Ca -0.06 2.09 0.01 0.00 0.04 0.00 0.00 61.00 63.08 2oel s PRO 388 Cb -0.06 -2.49 0.60 0.00 0.04 0.00 0.00 34.50 32.59 2oel s PRO 388 CO -0.01 -0.75 1.76 -0.07 0.04 0.00 0.00 177.00 177.96 2oel h LEU 389 N 2.08 0.56 -1.87 -3.56 3.38 -1.94 -0.36 115.31 113.60 2oel h LEU 389 Ca -0.50 0.10 -0.03 0.00 0.09 0.00 0.00 57.88 57.54 2oel h LEU 389 Cb 1.26 0.01 -0.00 0.00 0.09 0.00 0.00 40.66 42.02 2oel h LEU 389 CO 0.60 0.20 -0.13 0.03 0.09 0.00 0.00 178.44 179.23 2oel h ARG 390 N 0.63 0.00 -0.38 1.13 3.08 -1.97 0.13 114.38 117.00 2oel h ARG 390 Ca 0.50 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.49 2oel h ARG 390 Cb 0.76 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.80 2oel h ARG 390 CO -0.39 0.13 0.01 0.00 -1.07 0.00 0.00 179.97 178.66 2oel h ALA 391 N 1.87 0.51 -0.22 0.04 0.00 -1.42 -1.03 119.26 119.01 2oel h ALA 391 Ca -0.00 -0.24 -0.16 0.00 0.00 0.00 0.00 54.91 54.50 2oel h ALA 391 Cb 0.32 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 2oel h ALA 391 CO 0.02 0.27 -0.53 0.00 0.00 0.00 0.00 179.25 179.00 2oel h ALA 392 N 0.88 0.65 -0.31 0.00 0.00 -1.33 -2.94 119.26 116.21 2oel h ALA 392 Ca 0.11 -0.51 0.04 0.00 0.00 0.00 0.00 54.91 54.55 2oel h ALA 392 Cb 0.44 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 2oel h ALA 392 CO 0.02 0.68 0.21 0.00 0.00 0.00 0.00 179.25 180.16 2oel h ALA 393 N 0.91 1.97 0.00 0.00 0.00 -0.44 0.12 119.26 121.81 2oel h ALA 393 Ca 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2oel h ALA 393 Cb 1.09 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.82 2oel h ALA 393 CO 0.11 -0.01 0.00 0.00 0.00 0.00 0.00 179.25 179.34 2oel n ALA 394 N -2.53 1.59 0.03 0.00 0.00 -0.42 -2.47 120.51 116.71 2oel n ALA 394 Ca 0.03 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.50 2oel n ALA 394 Cb 0.19 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.34 2oel n ALA 394 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2oel n GLU 395 N -1.90 1.33 -3.71 0.00 1.02 0.25 -4.94 120.64 112.69 2oel n GLU 395 Ca 0.02 -0.39 -0.29 0.00 -0.02 0.00 0.00 57.16 56.49 2oel n GLU 395 Cb 0.18 -0.87 -0.16 0.00 -0.02 0.00 0.00 31.44 30.57 2oel n GLU 395 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 2oel s ASN 396 N -0.35 3.42 0.24 1.62 3.84 -0.27 -5.02 114.94 118.42 2oel s ASN 396 Ca 0.01 -1.19 -0.05 0.00 0.21 0.00 0.00 52.86 51.84 2oel s ASN 396 Cb 0.01 -0.67 0.38 0.00 -0.55 0.00 0.00 41.25 40.42 2oel s ASN 396 CO 0.01 -0.36 1.80 -0.08 -2.79 0.00 0.00 177.10 175.68 2oel h GLU 397 N 8.21 0.72 -0.66 0.43 4.81 -1.89 -1.44 114.58 124.75 2oel h GLU 397 Ca -0.16 -0.04 0.04 0.00 -0.13 0.00 0.00 59.36 59.07 2oel h GLU 397 Cb 1.07 -0.16 -0.05 0.00 0.63 0.00 0.00 28.75 30.24 2oel h GLU 397 CO 0.40 0.48 0.39 0.00 -0.73 0.00 0.00 179.01 179.55 2oel h ALA 398 N 1.45 0.86 -0.42 2.92 0.00 -1.92 -0.67 119.26 121.48 2oel h ALA 398 Ca 0.39 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 55.15 2oel h ALA 398 Cb 0.37 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2oel h ALA 398 CO -0.25 0.12 -0.29 1.25 0.00 0.00 0.00 179.25 180.08 2oel h LEU 399 N 0.76 0.98 -0.50 0.00 5.85 -1.67 -2.43 115.31 118.29 2oel h LEU 399 Ca 0.27 -0.43 -0.02 0.00 0.84 0.00 0.00 57.88 58.54 2oel h LEU 399 Cb 0.07 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.81 2oel h LEU 399 CO -0.13 1.20 0.23 -0.61 -0.34 0.00 0.00 178.44 178.79 2oel h GLN 400 N 0.76 0.73 -0.90 1.25 5.75 -0.91 -0.72 115.11 121.08 2oel h GLN 400 Ca 0.08 -0.11 0.05 0.00 -0.15 0.00 0.00 58.65 58.52 2oel h GLN 400 Cb 0.87 -0.13 -0.05 0.00 1.07 0.00 0.00 27.48 29.24 2oel h GLN 400 CO 0.08 0.62 0.59 0.87 -2.65 0.00 0.00 178.83 178.33 2oel h LYS 401 N 0.66 1.04 -0.18 1.69 1.57 -1.06 0.39 116.57 120.69 2oel h LYS 401 Ca 0.17 -0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 58.85 2oel h LYS 401 Cb 0.14 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.21 2oel h LYS 401 CO -0.02 0.69 -0.05 0.00 -0.57 0.00 0.00 179.45 179.50 2oel h ALA 402 N 1.49 0.25 -0.51 3.86 0.00 -0.97 -1.47 119.26 121.91 2oel h ALA 402 Ca 0.37 -0.25 0.01 0.00 0.00 0.00 0.00 54.91 55.04 2oel h ALA 402 Cb 0.10 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 2oel h ALA 402 CO -0.12 0.02 0.33 0.82 0.00 0.00 0.00 179.25 180.30 2oel h ILE 403 N 0.06 1.11 0.00 0.00 2.04 -0.55 0.52 117.51 120.69 2oel h ILE 403 Ca 0.04 -0.23 -0.03 0.00 1.00 0.00 0.00 64.86 65.65 2oel h ILE 403 Cb 0.49 0.38 -0.00 0.00 -0.74 0.00 0.00 36.82 36.95 2oel h ILE 403 CO 0.02 0.12 -0.14 0.44 0.00 0.00 0.00 178.15 178.59 2oel h ASP 404 N 0.67 0.00 0.12 1.72 3.32 -0.91 1.68 116.42 123.01 2oel h ASP 404 Ca 0.19 0.00 -0.26 0.00 0.02 0.00 0.00 57.03 56.98 2oel h ASP 404 Cb -0.06 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.50 2oel h ASP 404 CO -0.05 0.14 -1.29 -0.09 -1.72 0.00 0.00 179.24 176.23 2oel h ARG 405 N 0.00 0.25 0.00 3.56 1.12 -0.14 -3.42 114.38 115.76 2oel h ARG 405 Ca -0.00 -0.43 0.00 0.00 -1.11 0.00 0.00 59.98 58.44 2oel h ARG 405 Cb 0.55 0.16 0.00 0.00 -0.01 0.00 0.00 29.97 30.67 2oel h ARG 405 CO 0.02 1.21 0.00 0.91 -3.11 0.00 0.00 179.97 178.99 2oel n TRP 406 N -3.97 0.00 -0.55 2.20 8.01 0.17 -5.08 117.44 118.22 2oel n TRP 406 Ca -0.23 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 55.96 2oel n TRP 406 Cb 0.88 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 30.18 2oel n TRP 406 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2oel n GLY 407 N 0.62 -2.33 3.23 6.99 0.00 0.57 -4.93 105.19 109.35 2oel n GLY 407 Ca 0.00 -1.55 -0.31 0.00 0.00 0.00 0.00 46.02 44.16 2oel n GLY 407 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2oel s VAL 408 N -0.86 2.00 -0.23 1.61 1.01 -1.26 -3.94 120.40 118.73 2oel s VAL 408 Ca 0.00 -1.01 -0.21 0.00 0.00 0.00 0.00 61.98 60.76 2oel s VAL 408 Cb 0.00 -1.71 -0.02 0.00 0.00 0.00 0.00 36.38 34.65 2oel s VAL 408 CO 0.00 0.55 0.64 -0.69 0.00 0.00 0.00 175.10 175.60 2oel s VAL 409 N 0.11 4.99 0.32 2.92 1.01 -0.44 -5.02 120.40 124.28 2oel s VAL 409 Ca -0.11 1.18 -0.29 0.00 0.00 0.00 0.00 61.98 62.76 2oel s VAL 409 Cb -0.16 -3.95 -0.11 0.00 0.00 0.00 0.00 36.38 32.17 2oel s VAL 409 CO 0.06 0.06 1.45 -0.70 0.00 0.00 0.00 175.10 175.97 2oel s GLU 410 N 2.26 4.22 -0.01 2.72 2.56 -1.26 -4.76 118.70 124.43 2oel s GLU 410 Ca 0.28 2.41 0.10 0.00 0.00 0.00 0.00 54.97 57.76 2oel s GLU 410 Cb -0.16 -3.04 -0.14 0.00 2.00 0.00 0.00 34.13 32.79 2oel s GLU 410 CO 0.09 -0.43 0.33 1.33 -0.56 0.00 0.00 175.26 176.02 2oel n VAL 411 N 1.32 0.00 -1.67 3.70 0.24 -1.26 -4.96 118.33 115.69 2oel n VAL 411 Ca 0.03 -0.25 -0.44 0.00 -2.04 0.00 0.00 64.34 61.64 2oel n VAL 411 Cb 0.40 0.60 -0.04 0.00 -1.47 0.00 0.00 33.84 33.34 2oel n VAL 411 CO 0.00 0.00 0.00 1.21 -2.14 0.00 0.00 176.83 175.90 2oel n GLU 412 N -1.58 2.63 0.00 7.34 2.13 -1.26 -5.07 120.64 124.83 2oel n GLU 412 Ca -0.00 0.96 0.04 0.00 0.66 0.00 0.00 57.16 58.82 2oel n GLU 412 Cb 0.22 -2.88 0.24 0.00 0.27 0.00 0.00 31.44 29.29 2oel n GLU 412 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72