#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1eol n ALA 1 N 0.00 2.76 -0.74 4.61 0.00 -1.26 -3.94 120.51 121.94 1eol n ALA 1 Ca 0.00 -0.45 0.08 0.00 0.00 0.00 0.00 53.44 53.06 1eol n ALA 1 Cb 0.00 -0.83 0.22 0.00 0.00 0.00 0.00 19.45 18.84 1eol n ALA 1 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1eol n ASP 1 N -2.35 3.53 -4.73 0.00 2.03 -1.26 -5.04 116.55 108.73 1eol n ASP 1 Ca -0.03 -2.71 -0.37 0.00 0.52 0.00 0.00 54.79 52.20 1eol n ASP 1 Cb 0.56 -0.44 0.06 0.00 -0.72 0.00 0.00 41.12 40.59 1eol n ASP 1 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1eol n GLY 2 N 0.86 0.63 3.29 0.00 0.00 -0.61 -4.70 105.19 104.66 1eol n GLY 2 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 1eol n GLY 2 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1eol s LEU 3 N 0.00 4.61 0.03 0.99 1.43 -1.20 -1.87 118.68 122.67 1eol s LEU 3 Ca 0.00 -1.22 -0.30 0.00 -1.03 0.00 0.00 54.13 51.58 1eol s LEU 3 Cb 0.00 -1.93 -0.05 0.00 0.03 0.00 0.00 46.19 44.25 1eol s LEU 3 CO 0.00 -0.39 1.14 -0.13 0.23 0.00 0.00 176.35 177.20 1eol s ARG 4 N 1.43 4.46 0.25 1.70 0.52 -1.26 -4.82 118.95 121.23 1eol s ARG 4 Ca 0.00 1.66 -0.03 0.00 -0.52 0.00 0.00 55.73 56.85 1eol s ARG 4 Cb -0.20 -3.40 0.48 0.00 0.52 0.00 0.00 34.95 32.35 1eol s ARG 4 CO 0.03 -0.22 1.74 -1.35 0.02 0.00 0.00 175.30 175.52 1eol h PRO 5 N 6.88 0.51 -0.01 3.54 0.11 -1.88 -1.85 132.00 139.30 1eol h PRO 5 Ca -0.40 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1eol h PRO 5 Cb 1.21 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1eol h PRO 5 CO 0.80 0.34 -0.12 1.28 -0.21 0.00 0.00 178.00 180.09 1eol n LEU 6 N -4.94 0.76 0.00 2.35 4.77 -1.26 -4.07 117.00 114.60 1eol n LEU 6 Ca 0.15 -0.15 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1eol n LEU 6 Cb 0.42 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.39 1eol n LEU 6 CO 0.20 0.14 0.00 0.49 -1.33 0.00 0.00 177.39 176.88 1eol n PHE 7 N -0.68 0.00 -0.20 -1.77 3.72 -0.76 -4.73 117.46 113.04 1eol n PHE 7 Ca 0.16 0.00 -0.01 0.00 -0.05 0.00 0.00 57.45 57.54 1eol n PHE 7 Cb 0.29 0.00 0.10 0.00 -0.94 0.00 0.00 39.48 38.93 1eol n PHE 7 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 1eol h GLU 8 N 0.00 0.46 0.00 -1.08 3.07 -1.53 0.90 114.58 116.40 1eol h GLU 8 Ca 0.00 -0.03 -0.00 0.00 -0.50 0.00 0.00 59.36 58.83 1eol h GLU 8 Cb 0.00 -0.10 -0.00 0.00 -0.84 0.00 0.00 28.75 27.81 1eol h GLU 8 CO 0.00 0.31 -0.02 0.87 -1.40 0.00 0.00 179.01 178.77 1eol h LYS 9 N 0.48 0.00 -0.05 2.33 1.79 -1.57 -1.75 116.57 117.80 1eol h LYS 9 Ca 0.29 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.76 1eol h LYS 9 Cb 0.30 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.95 1eol h LYS 9 CO -0.25 0.02 0.00 1.63 -1.08 0.00 0.00 179.45 179.76 1eol n LYS 10 N -3.49 0.94 -2.39 3.15 5.02 -0.47 -4.98 118.16 115.94 1eol n LYS 10 Ca -0.03 -1.33 -0.13 0.00 -2.02 0.00 0.00 58.31 54.80 1eol n LYS 10 Cb 0.11 -1.25 0.00 0.00 -0.02 0.00 0.00 35.03 33.87 1eol n LYS 10 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1eol n SER 11 N 0.70 -4.15 -4.65 4.39 2.88 0.00 -5.02 113.62 107.78 1eol n SER 11 Ca 0.08 -0.06 -0.33 0.00 -1.33 0.00 0.00 58.87 57.23 1eol n SER 11 Cb 0.33 -3.25 -0.10 0.00 -0.75 0.00 0.00 64.21 60.44 1eol n SER 11 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1eol s LEU 12 N -3.90 3.38 0.05 2.46 1.43 0.10 -4.99 118.68 117.21 1eol s LEU 12 Ca 0.06 -0.04 0.04 0.00 -1.03 0.00 0.00 54.13 53.15 1eol s LEU 12 Cb -0.03 -1.91 -0.04 0.00 0.03 0.00 0.00 46.19 44.25 1eol s LEU 12 CO 0.07 0.29 -0.02 -1.61 0.23 0.00 0.00 176.35 175.31 1eol s GLU 13 N -1.41 2.57 0.72 1.70 2.02 -1.26 -3.79 118.70 119.25 1eol s GLU 13 Ca 0.18 -0.78 -0.11 0.00 0.02 0.00 0.00 54.97 54.28 1eol s GLU 13 Cb -0.11 -2.54 0.03 0.00 0.10 0.00 0.00 34.13 31.61 1eol s GLU 13 CO 0.08 0.57 1.09 0.16 0.02 0.00 0.00 175.26 177.18 1eol s ASP 14 N -1.95 5.16 0.43 -0.19 1.47 -1.26 -4.97 116.67 115.36 1eol s ASP 14 Ca 0.22 0.94 0.17 0.00 1.18 0.00 0.00 52.55 55.07 1eol s ASP 14 Cb -0.11 -1.67 1.09 0.00 -0.34 0.00 0.00 42.92 41.89 1eol s ASP 14 CO 0.14 -1.48 1.89 0.11 0.68 0.00 0.00 175.17 176.50 1eol h LYS 14 N -0.71 0.38 0.00 2.11 1.79 -2.01 -3.24 116.57 114.89 1eol h LYS 14 Ca -0.45 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 57.99 1eol h LYS 14 Cb 1.28 -0.09 0.00 0.00 -1.58 0.00 0.00 32.23 31.84 1eol h LYS 14 CO 0.64 0.25 -0.00 0.25 -1.08 0.00 0.00 179.45 179.51 1eol n THR 14 N -4.48 0.95 0.25 -0.16 -2.24 -1.26 -4.73 114.28 102.61 1eol n THR 14 Ca 0.17 -0.98 0.12 0.00 -2.27 0.00 0.00 64.05 61.10 1eol n THR 14 Cb 0.63 0.50 0.64 0.00 -2.10 0.00 0.00 70.33 70.01 1eol n THR 14 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 1eol h GLU 14 N 0.00 0.00 -0.13 -0.78 4.11 -1.96 -2.38 114.58 113.45 1eol h GLU 14 Ca 0.00 0.00 -0.04 0.00 0.07 0.00 0.00 59.36 59.39 1eol h GLU 14 Cb 0.58 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.82 1eol h GLU 14 CO 0.00 0.15 -0.10 -0.09 0.07 0.00 0.00 179.01 179.03 1eol h ARG 14 N 0.00 0.19 -0.54 1.06 9.65 -1.85 -2.43 114.38 120.47 1eol h ARG 14 Ca -0.00 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.84 1eol h ARG 14 Cb 0.50 -0.03 0.00 0.00 -1.39 0.00 0.00 29.97 29.05 1eol h ARG 14 CO 0.02 0.31 0.00 -1.91 2.80 0.00 0.00 179.97 181.19 1eol n GLU 14 N -4.32 0.13 0.00 0.20 2.13 -0.90 -0.84 120.64 117.05 1eol n GLU 14 Ca -0.01 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.81 1eol n GLU 14 Cb 0.24 -1.15 0.00 0.00 0.27 0.00 0.00 31.44 30.79 1eol n GLU 14 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 1eol n LEU 14 N 0.55 0.00 0.19 4.31 7.99 -0.92 -3.08 117.00 126.05 1eol n LEU 14 Ca 0.00 0.00 0.14 0.00 -0.01 0.00 0.00 56.01 56.14 1eol n LEU 14 Cb 0.04 0.00 0.48 0.00 -0.11 0.00 0.00 43.42 43.83 1eol n LEU 14 CO 0.00 0.00 0.90 -0.33 -1.51 0.00 0.00 177.39 176.45 1eol h GLU 14 N 0.00 0.00 0.00 3.23 5.08 -1.26 -2.87 114.58 118.76 1eol h GLU 14 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1eol h GLU 14 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1eol h GLU 14 CO 0.00 0.00 -0.58 0.66 -1.00 0.00 0.00 179.01 178.09 1eol h SER 14 N 0.00 0.00 -0.74 1.42 4.64 -1.80 -3.42 113.55 113.65 1eol h SER 14 Ca 0.00 -0.12 -0.49 0.00 -0.47 0.00 0.00 61.79 60.71 1eol h SER 14 Cb 0.60 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.63 1eol h SER 14 CO 0.00 0.06 1.47 -0.31 -0.87 0.00 0.00 176.83 177.18 1eol s TYR 14 N -3.21 2.30 0.00 4.77 2.02 -1.08 -4.44 117.35 117.70 1eol s TYR 14 Ca 0.05 -0.42 0.00 0.00 -0.37 0.00 0.00 57.07 56.33 1eol s TYR 14 Cb 0.12 -4.37 0.00 0.00 -0.40 0.00 0.00 41.96 37.30 1eol s TYR 14 CO 0.72 -1.60 0.00 -0.89 -1.57 0.00 0.00 175.55 172.20 1eol n ILE 14 N 7.20 0.00 -3.53 2.71 5.41 -1.26 -5.07 119.36 124.81 1eol n ILE 14 Ca 0.44 0.00 0.01 0.00 1.00 0.00 0.00 62.75 64.20 1eol n ILE 14 Cb 0.47 -0.25 -0.06 0.00 -0.71 0.00 0.00 39.64 39.10 1eol n ILE 14 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 1eol s ILE 16 N -2.00 -0.08 -0.17 1.39 -1.09 0.14 -5.14 121.20 114.25 1eol s ILE 16 Ca 0.00 0.00 -0.08 0.00 -2.23 0.00 0.00 60.65 58.34 1eol s ILE 16 Cb 0.00 -1.00 -0.04 0.00 -1.58 0.00 0.00 42.46 39.84 1eol s ILE 16 CO 0.00 0.00 0.11 -0.69 -1.23 0.00 0.00 174.94 173.13 1eol s VAL 17 N 1.51 5.23 -1.41 2.92 1.01 0.41 -4.12 120.40 125.94 1eol s VAL 17 Ca -0.06 0.12 0.00 0.00 0.00 0.00 0.00 61.98 62.04 1eol s VAL 17 Cb -0.03 -3.34 0.00 0.00 0.00 0.00 0.00 36.38 33.01 1eol s VAL 17 CO -0.13 0.51 0.00 -0.62 0.00 0.00 0.00 175.10 174.85 1eol n GLU 18 N 3.00 -1.29 -0.12 2.72 -0.58 -1.26 -2.30 120.64 120.81 1eol n GLU 18 Ca -0.17 0.81 0.00 0.00 -0.42 0.00 0.00 57.16 57.37 1eol n GLU 18 Cb 0.53 -5.20 0.00 0.00 -0.57 0.00 0.00 31.44 26.20 1eol n GLU 18 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1eol n GLY 19 N -1.01 1.89 3.28 0.62 0.00 -1.26 -4.76 105.19 103.94 1eol n GLY 19 Ca -0.19 -2.05 -0.10 0.00 0.00 0.00 0.00 46.02 43.69 1eol n GLY 19 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1eol s SER 20 N -1.00 0.12 0.29 1.61 1.04 -0.63 -4.91 113.70 110.22 1eol s SER 20 Ca 0.00 -0.98 -0.30 0.00 0.48 0.00 0.00 55.95 55.16 1eol s SER 20 Cb 0.00 0.39 -0.11 0.00 0.10 0.00 0.00 66.02 66.40 1eol s SER 20 CO 0.00 -0.84 1.55 -1.81 0.98 0.00 0.00 173.24 173.12 1eol s ASP 21 N -2.99 6.44 0.54 7.02 1.11 -1.26 -0.41 116.67 127.11 1eol s ASP 21 Ca 0.19 2.89 -0.16 0.00 0.18 0.00 0.00 52.55 55.66 1eol s ASP 21 Cb 0.05 -2.63 -0.07 0.00 1.07 0.00 0.00 42.92 41.33 1eol s ASP 21 CO 0.01 -0.86 1.00 0.00 1.18 0.00 0.00 175.17 176.49 1eol s ALA 22 N -0.11 3.05 0.51 5.23 0.00 0.69 -4.79 121.76 126.34 1eol s ALA 22 Ca 0.61 0.15 -0.11 0.00 0.00 0.00 0.00 51.96 52.61 1eol s ALA 22 Cb -0.46 -3.12 -0.05 0.00 0.00 0.00 0.00 23.12 19.48 1eol s ALA 22 CO 0.48 -0.36 0.90 -1.21 0.00 0.00 0.00 175.76 175.57 1eol s GLU 23 N -4.26 3.72 0.21 0.00 2.02 -1.26 -4.90 118.70 114.22 1eol s GLU 23 Ca 0.59 0.61 -0.31 0.00 0.02 0.00 0.00 54.97 55.88 1eol s GLU 23 Cb -0.11 -2.24 -0.11 0.00 0.10 0.00 0.00 34.13 31.78 1eol s GLU 23 CO 0.36 -0.28 1.57 0.42 0.02 0.00 0.00 175.26 177.35 1eol s ILE 24 N -2.74 2.44 -0.22 -1.63 -1.09 -1.26 -2.23 121.20 114.47 1eol s ILE 24 Ca 0.53 0.34 0.00 0.00 -2.23 0.00 0.00 60.65 59.29 1eol s ILE 24 Cb -0.10 -3.21 0.00 0.00 -1.58 0.00 0.00 42.46 37.56 1eol s ILE 24 CO 0.41 0.04 0.00 0.61 -1.23 0.00 0.00 174.94 174.76 1eol n GLY 25 N 3.25 0.47 0.16 6.18 0.00 -1.26 -4.90 105.19 109.09 1eol n GLY 25 Ca 0.12 -0.15 0.01 0.00 0.00 0.00 0.00 46.02 46.00 1eol n GLY 25 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1eol h MET 26 N 0.45 0.00 -2.19 1.61 -1.53 -1.82 -3.36 114.93 108.09 1eol h MET 26 Ca -0.04 0.00 -0.58 0.00 -3.44 0.00 0.00 59.70 55.64 1eol h MET 26 Cb 0.45 0.00 -0.39 0.00 -0.55 0.00 0.00 31.60 31.11 1eol h MET 26 CO 0.06 0.51 -1.02 0.43 0.14 0.00 0.00 176.91 177.04 1eol n SER 27 N -3.74 0.16 0.00 1.39 7.64 -1.26 -4.98 113.62 112.82 1eol n SER 27 Ca -0.01 -2.61 0.06 0.00 1.01 0.00 0.00 58.87 57.32 1eol n SER 27 Cb 0.56 -0.61 0.31 0.00 -1.01 0.00 0.00 64.21 63.47 1eol n SER 27 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1eol n PRO 28 N 1.99 0.23 0.00 1.43 -0.04 -1.26 -2.07 135.00 135.27 1eol n PRO 28 Ca 0.25 0.13 0.11 0.00 -0.04 0.00 0.00 63.50 63.94 1eol n PRO 28 Cb 0.50 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.41 1eol n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1eol n TRP 29 N -1.21 0.00 -1.96 0.54 2.14 -1.03 -1.29 117.44 114.62 1eol n TRP 29 Ca 0.07 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.22 1eol n TRP 29 Cb 0.08 -0.00 -0.03 0.00 -0.81 0.00 0.00 31.31 30.55 1eol n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1eol s GLN 30 N -2.69 4.23 0.13 -2.67 2.00 -0.88 -0.10 119.66 119.69 1eol s GLN 30 Ca 0.14 2.33 0.09 0.00 -2.00 0.00 0.00 55.36 55.92 1eol s GLN 30 Cb 0.17 -3.17 -0.04 0.00 0.80 0.00 0.00 33.01 30.77 1eol s GLN 30 CO 0.69 -0.59 -0.21 0.08 -0.50 0.00 0.00 175.29 174.76 1eol s VAL 31 N 1.16 1.85 -0.26 1.34 1.01 -0.56 -4.17 120.40 120.78 1eol s VAL 31 Ca 0.69 -1.73 -0.05 0.00 0.00 0.00 0.00 61.98 60.90 1eol s VAL 31 Cb -0.43 -1.74 0.00 0.00 0.00 0.00 0.00 36.38 34.21 1eol s VAL 31 CO 0.31 -0.14 0.01 -0.32 0.00 0.00 0.00 175.10 174.96 1eol s MET 32 N -2.28 3.18 -0.32 2.72 1.75 -0.57 -1.92 119.30 121.85 1eol s MET 32 Ca 0.11 -0.77 -0.27 0.00 -1.25 0.00 0.00 55.69 53.51 1eol s MET 32 Cb -0.08 -3.16 0.01 0.00 2.84 0.00 0.00 34.83 34.44 1eol s MET 32 CO 0.06 -0.33 0.97 -1.17 -0.65 0.00 0.00 175.02 173.89 1eol s LEU 33 N 1.46 3.99 0.05 4.11 0.20 0.20 -1.64 118.68 127.05 1eol s LEU 33 Ca 0.03 0.86 0.09 0.00 0.69 0.00 0.00 54.13 55.80 1eol s LEU 33 Cb -0.16 -3.36 -0.03 0.00 -0.43 0.00 0.00 46.19 42.21 1eol s LEU 33 CO -0.01 -0.80 -0.26 0.12 -0.29 0.00 0.00 176.35 175.11 1eol s PHE 34 N 3.42 2.32 0.09 5.38 5.36 -0.11 -1.17 117.98 133.27 1eol s PHE 34 Ca 0.40 -0.41 -0.18 0.00 -0.96 0.00 0.00 56.93 55.78 1eol s PHE 34 Cb -0.13 -1.39 -0.07 0.00 -0.34 0.00 0.00 43.02 41.10 1eol s PHE 34 CO 0.15 0.13 0.55 1.03 -1.46 0.00 0.00 175.22 175.62 1eol s ARG 35 N -1.25 4.12 -0.08 10.12 0.52 0.36 -1.27 118.95 131.47 1eol s ARG 35 Ca 0.12 0.65 -0.19 0.00 -0.52 0.00 0.00 55.73 55.79 1eol s ARG 35 Cb -0.10 -3.16 -0.29 0.00 0.52 0.00 0.00 34.95 31.93 1eol s ARG 35 CO 0.02 0.60 0.69 0.87 0.02 0.00 0.00 175.30 177.50 1eol h LYS 36 N 4.30 0.26 0.00 3.54 1.57 -1.74 -3.18 116.57 121.31 1eol h LYS 36 Ca -0.50 -0.44 0.00 0.00 -1.87 0.00 0.00 60.65 57.84 1eol h LYS 36 Cb 1.21 0.16 0.00 0.00 0.08 0.00 0.00 32.23 33.68 1eol h LYS 36 CO 0.64 1.21 0.00 -1.13 -0.57 0.00 0.00 179.45 179.60 1eol n SER 36 N -4.02 0.00 -4.58 0.86 3.41 -1.26 -3.92 113.62 104.10 1eol n SER 36 Ca -0.20 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 57.99 1eol n SER 36 Cb 0.86 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.78 1eol n SER 36 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 1eol s PRO 37 N 0.00 3.27 -0.97 4.33 0.04 -1.26 -4.79 135.00 135.61 1eol s PRO 37 Ca 0.00 0.71 -0.18 0.00 0.04 0.00 0.00 61.00 61.57 1eol s PRO 37 Cb 0.00 -4.15 -0.28 0.00 0.04 0.00 0.00 34.50 30.11 1eol s PRO 37 CO 0.00 -1.95 2.36 0.94 0.04 0.00 0.00 177.00 178.38 1eol n GLN 38 N 8.58 0.06 -3.96 4.56 -0.06 -1.25 -4.69 117.38 120.61 1eol n GLN 38 Ca 0.16 -0.05 -0.09 0.00 -2.00 0.00 0.00 57.00 55.02 1eol n GLN 38 Cb 0.49 -1.39 -0.11 0.00 -4.06 0.00 0.00 30.24 25.18 1eol n GLN 38 CO 0.00 0.00 0.00 -1.21 -0.20 0.00 0.00 177.06 175.65 1eol s GLU 39 N 7.81 0.39 0.05 3.69 2.02 -1.20 -4.97 118.70 126.50 1eol s GLU 39 Ca 1.30 -0.62 -0.30 0.00 0.02 0.00 0.00 54.97 55.37 1eol s GLU 39 Cb -0.93 0.15 -0.05 0.00 0.10 0.00 0.00 34.13 33.40 1eol s GLU 39 CO 0.51 -0.08 1.04 -1.17 0.02 0.00 0.00 175.26 175.58 1eol s LEU 40 N -1.59 4.41 -0.15 1.80 0.20 -1.26 -0.49 118.68 121.60 1eol s LEU 40 Ca -0.13 1.81 -0.10 0.00 0.69 0.00 0.00 54.13 56.40 1eol s LEU 40 Cb -0.08 -3.58 -0.06 0.00 -0.43 0.00 0.00 46.19 42.04 1eol s LEU 40 CO -0.01 -0.26 -0.23 -0.11 -0.29 0.00 0.00 176.35 175.45 1eol n LEU 41 N 3.52 1.37 -3.89 -0.68 0.00 -0.32 -4.92 117.00 112.09 1eol n LEU 41 Ca 0.06 0.23 -0.09 0.00 0.00 0.00 0.00 56.01 56.20 1eol n LEU 41 Cb 0.49 -0.55 -0.01 0.00 0.00 0.00 0.00 43.42 43.36 1eol n LEU 41 CO 0.53 0.12 0.41 0.00 0.00 0.00 0.00 177.39 178.44 1eol s GLY 43 N -3.05 1.77 0.12 0.00 0.00 0.18 -0.63 107.32 105.72 1eol s GLY 43 Ca 0.17 -1.83 -0.17 0.00 0.00 0.00 0.00 44.72 42.89 1eol s GLY 43 CO 0.11 -1.36 0.83 0.00 0.00 0.00 0.00 173.10 172.68 1eol n ALA 44 N -2.50 -2.18 -3.12 3.20 0.00 -0.81 -3.48 120.51 111.63 1eol n ALA 44 Ca 0.14 -0.78 -0.11 0.00 0.00 0.00 0.00 53.44 52.69 1eol n ALA 44 Cb 0.61 0.41 -0.10 0.00 0.00 0.00 0.00 19.45 20.36 1eol n ALA 44 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1eol s SER 45 N -2.94 -0.01 -0.35 0.00 1.04 -0.39 -1.50 113.70 109.56 1eol s SER 45 Ca 0.18 -0.14 -0.21 0.00 0.48 0.00 0.00 55.95 56.27 1eol s SER 45 Cb -0.02 0.23 0.00 0.00 0.10 0.00 0.00 66.02 66.33 1eol s SER 45 CO 0.04 -0.36 0.64 -0.22 0.98 0.00 0.00 173.24 174.32 1eol s LEU 46 N -1.27 4.24 -0.00 2.42 2.96 0.86 -0.61 118.68 127.27 1eol s LEU 46 Ca -0.14 0.19 0.17 0.00 -0.22 0.00 0.00 54.13 54.13 1eol s LEU 46 Cb -0.07 -2.80 -0.19 0.00 0.50 0.00 0.00 46.19 43.63 1eol s LEU 46 CO 0.02 -0.59 0.67 2.30 -1.32 0.00 0.00 176.35 177.43 1eol n ILE 47 N 5.57 0.00 -3.75 6.68 -5.35 -0.75 -1.72 119.36 120.04 1eol n ILE 47 Ca -0.01 -0.14 -0.04 0.00 -0.27 0.00 0.00 62.75 62.29 1eol n ILE 47 Cb 0.49 0.90 0.02 0.00 -1.74 0.00 0.00 39.64 39.31 1eol n ILE 47 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1eol n SER 48 N -1.47 -1.58 0.29 7.28 3.41 -1.19 -4.70 113.62 115.66 1eol n SER 48 Ca 0.02 -1.94 0.19 0.00 -0.26 0.00 0.00 58.87 56.88 1eol n SER 48 Cb 0.28 2.59 0.86 0.00 -0.26 0.00 0.00 64.21 67.68 1eol n SER 48 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 1eol h ASP 49 N 1.60 0.00 0.00 4.04 2.03 -1.96 -3.25 116.42 118.87 1eol h ASP 49 Ca -0.24 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.06 1eol h ASP 49 Cb 0.98 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.48 1eol h ASP 49 CO 0.31 0.00 0.00 -1.14 -1.03 0.00 0.00 179.24 177.38 1eol n ARG 50 N -3.03 0.61 -4.82 4.15 0.63 -1.26 -0.73 116.66 112.20 1eol n ARG 50 Ca -0.01 -0.64 -0.26 0.00 -0.92 0.00 0.00 57.85 56.02 1eol n ARG 50 Cb 0.22 -0.70 -0.16 0.00 0.45 0.00 0.00 32.46 32.26 1eol n ARG 50 CO 0.00 0.00 0.00 -1.58 -2.51 0.00 0.00 177.63 173.54 1eol s TRP 51 N -0.25 1.76 -0.06 -0.14 0.52 -1.23 -0.55 118.94 118.99 1eol s TRP 51 Ca 0.00 -0.57 0.06 0.00 0.02 0.00 0.00 56.10 55.61 1eol s TRP 51 Cb 0.00 -1.20 -0.01 0.00 -1.15 0.00 0.00 33.47 31.11 1eol s TRP 51 CO 0.00 -0.22 -0.23 0.08 0.02 0.00 0.00 176.95 176.59 1eol s VAL 52 N 0.23 1.93 -0.11 4.03 1.01 -0.27 -1.82 120.40 125.41 1eol s VAL 52 Ca -0.08 -1.00 -0.04 0.00 0.00 0.00 0.00 61.98 60.86 1eol s VAL 52 Cb -0.13 -1.64 -0.04 0.00 0.00 0.00 0.00 36.38 34.57 1eol s VAL 52 CO 0.03 0.54 0.03 -0.22 0.00 0.00 0.00 175.10 175.49 1eol s LEU 53 N -0.10 3.75 0.00 3.92 2.96 0.22 -0.78 118.68 128.65 1eol s LEU 53 Ca -0.04 0.19 -0.08 0.00 -0.22 0.00 0.00 54.13 53.98 1eol s LEU 53 Cb -0.14 -1.88 0.03 0.00 0.50 0.00 0.00 46.19 44.70 1eol s LEU 53 CO 0.04 0.35 0.61 1.07 -1.32 0.00 0.00 176.35 177.09 1eol n THR 54 N 2.35 0.00 -3.16 3.68 5.66 -0.34 -1.26 114.28 121.20 1eol n THR 54 Ca -0.19 -1.35 -0.38 0.00 -3.05 0.00 0.00 64.05 59.09 1eol n THR 54 Cb 0.54 1.00 -0.06 0.00 -1.55 0.00 0.00 70.33 70.26 1eol n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1eol s ALA 55 N -2.39 3.52 0.38 1.79 0.00 -1.26 -0.73 121.76 123.07 1eol s ALA 55 Ca 0.22 0.14 0.18 0.00 0.00 0.00 0.00 51.96 52.50 1eol s ALA 55 Cb -0.03 -2.75 1.00 0.00 0.00 0.00 0.00 23.12 21.34 1eol s ALA 55 CO 0.16 0.36 1.93 0.00 0.00 0.00 0.00 175.76 178.21 1eol h ALA 56 N 4.20 1.39 0.00 0.00 0.00 -1.71 -2.61 119.26 120.53 1eol h ALA 56 Ca -0.48 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.20 1eol h ALA 56 Cb 1.21 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1eol h ALA 56 CO 0.65 0.31 0.00 1.12 0.00 0.00 0.00 179.25 181.33 1eol h HIS 57 N 0.00 0.00 0.00 0.00 2.07 -1.90 -0.17 115.15 115.15 1eol h HIS 57 Ca -0.00 0.00 -0.08 0.00 -2.85 0.00 0.00 60.37 57.44 1eol h HIS 57 Cb 0.50 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.47 1eol h HIS 57 CO 0.00 0.00 -0.36 0.00 -3.07 0.00 0.00 177.93 174.50 1eol n LEU 59 N -3.46 0.03 -3.61 0.00 4.77 -0.47 -4.84 117.00 109.41 1eol n LEU 59 Ca 0.00 -0.00 -0.17 0.00 -0.03 0.00 0.00 56.01 55.81 1eol n LEU 59 Cb 0.53 0.38 -0.14 0.00 -2.33 0.00 0.00 43.42 41.85 1eol n LEU 59 CO 0.37 0.39 -0.20 -0.22 -1.33 0.00 0.00 177.39 176.39 1eol s LEU 60 N -5.16 -0.14 0.15 2.23 2.96 -0.20 -0.26 118.68 118.27 1eol s LEU 60 Ca -0.08 0.22 -0.16 0.00 -0.22 0.00 0.00 54.13 53.89 1eol s LEU 60 Cb 0.05 0.41 0.03 0.00 0.50 0.00 0.00 46.19 47.17 1eol s LEU 60 CO 0.64 -0.27 0.44 -0.47 -1.32 0.00 0.00 176.35 175.37 1eol s TYR 60 N 2.33 -0.14 0.00 5.38 5.04 0.65 -4.17 117.35 126.45 1eol s TYR 60 Ca 0.04 -0.19 0.00 0.00 -2.44 0.00 0.00 57.07 54.48 1eol s TYR 60 Cb -0.13 0.29 0.00 0.00 0.35 0.00 0.00 41.96 42.47 1eol s TYR 60 CO -0.08 -0.78 0.00 -2.30 -1.34 0.00 0.00 175.55 171.04 1eol n PRO 60 N -0.27 0.00 -0.32 4.97 -0.02 -1.26 -2.42 135.00 135.68 1eol n PRO 60 Ca -0.13 0.00 0.07 0.00 -2.02 0.00 0.00 63.50 61.42 1eol n PRO 60 Cb 0.63 0.00 0.21 0.00 -0.02 0.00 0.00 33.50 34.32 1eol n PRO 60 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 1eol n TRP 60 N 0.00 0.74 -3.58 6.00 7.02 -1.26 -4.98 117.44 121.38 1eol n TRP 60 Ca 0.00 -0.67 -0.22 0.00 -1.02 0.00 0.00 57.50 55.58 1eol n TRP 60 Cb 0.00 -0.17 0.08 0.00 -2.42 0.00 0.00 31.31 28.80 1eol n TRP 60 CO 0.00 0.00 0.00 -0.25 -2.02 0.00 0.00 177.69 175.42 1eol n ASP 60 N 0.09 -4.85 -4.33 -0.99 8.00 -1.15 -5.00 116.55 108.32 1eol n ASP 60 Ca 0.17 -0.59 -0.34 0.00 0.71 0.00 0.00 54.79 54.73 1eol n ASP 60 Cb 0.66 -4.93 -0.14 0.00 -0.02 0.00 0.00 41.12 36.69 1eol n ASP 60 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1eol s LYS 60 N -6.06 3.38 -0.48 -1.24 -0.14 -1.02 -5.02 119.74 109.16 1eol s LYS 60 Ca 0.41 -0.64 0.07 0.00 -1.36 0.00 0.00 55.97 54.44 1eol s LYS 60 Cb -0.18 -2.88 0.18 0.00 -1.68 0.00 0.00 37.83 33.27 1eol s LYS 60 CO 0.74 -0.06 0.66 1.21 -0.76 0.00 0.00 175.35 177.14 1eol s ASN 60 N 1.09 -1.08 0.25 2.83 2.47 -1.24 -0.25 114.94 119.01 1eol s ASN 60 Ca 0.01 -1.67 -0.22 0.00 0.42 0.00 0.00 52.86 51.40 1eol s ASN 60 Cb -0.15 1.63 -0.09 0.00 -1.45 0.00 0.00 41.25 41.20 1eol s ASN 60 CO -0.01 -0.09 0.80 -0.36 -3.72 0.00 0.00 177.10 173.71 1eol s PHE 60 N 1.01 3.69 0.44 0.43 0.08 0.64 -5.01 117.98 119.26 1eol s PHE 60 Ca 0.27 1.54 0.07 0.00 0.12 0.00 0.00 56.93 58.93 1eol s PHE 60 Cb -0.01 -2.73 -0.03 0.00 -0.57 0.00 0.00 43.02 39.68 1eol s PHE 60 CO -0.07 0.31 0.24 0.95 -0.10 0.00 0.00 175.22 176.55 1eol s THR 60 N -1.52 2.18 0.28 0.64 -4.23 -1.26 -4.87 115.64 106.86 1eol s THR 60 Ca 0.45 -1.63 0.02 0.00 -1.18 0.00 0.00 61.69 59.35 1eol s THR 60 Cb -0.18 -2.81 0.27 0.00 1.34 0.00 0.00 72.50 71.12 1eol s THR 60 CO 0.22 0.00 1.73 -0.33 -0.54 0.00 0.00 174.62 175.70 1eol h GLU 61 N 1.25 0.51 0.00 3.99 3.07 -1.93 -1.74 114.58 119.72 1eol h GLU 61 Ca -0.42 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.41 1eol h GLU 61 Cb 1.27 -0.11 0.00 0.00 -0.84 0.00 0.00 28.75 29.06 1eol h GLU 61 CO 0.66 0.34 0.00 0.09 -1.40 0.00 0.00 179.01 178.70 1eol n ASN 62 N -4.95 0.00 -0.10 1.42 3.02 -1.26 -2.78 115.26 110.60 1eol n ASN 62 Ca 0.20 -0.60 0.11 0.00 -0.03 0.00 0.00 54.58 54.27 1eol n ASN 62 Cb 0.56 -0.11 0.08 0.00 -0.61 0.00 0.00 39.78 39.70 1eol n ASN 62 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1eol n ASP 63 N -1.11 0.99 -4.28 6.41 8.00 -0.66 -4.93 116.55 120.98 1eol n ASP 63 Ca 0.18 -0.82 -0.15 0.00 0.71 0.00 0.00 54.79 54.71 1eol n ASP 63 Cb 0.15 0.58 -0.10 0.00 -0.02 0.00 0.00 41.12 41.72 1eol n ASP 63 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1eol s LEU 64 N -2.86 2.20 0.01 0.64 1.43 -1.12 -2.06 118.68 116.92 1eol s LEU 64 Ca 0.12 -1.17 -0.15 0.00 -1.03 0.00 0.00 54.13 51.91 1eol s LEU 64 Cb 0.17 -0.19 0.02 0.00 0.03 0.00 0.00 46.19 46.23 1eol s LEU 64 CO 0.73 -0.51 0.32 -1.48 0.23 0.00 0.00 176.35 175.64 1eol s LEU 65 N -3.23 0.81 -0.07 1.79 2.34 -0.40 -4.36 118.68 115.56 1eol s LEU 65 Ca 0.25 -0.01 0.01 0.00 0.06 0.00 0.00 54.13 54.43 1eol s LEU 65 Cb 0.05 1.35 -0.03 0.00 -0.56 0.00 0.00 46.19 47.01 1eol s LEU 65 CO 0.05 -0.53 -0.07 0.68 -1.06 0.00 0.00 176.35 175.43 1eol s VAL 66 N -1.85 3.71 -0.26 1.48 -7.23 -0.58 -0.94 120.40 114.74 1eol s VAL 66 Ca -0.10 -0.47 -0.02 0.00 -1.81 0.00 0.00 61.98 59.58 1eol s VAL 66 Cb -0.03 -2.52 0.03 0.00 0.56 0.00 0.00 36.38 34.41 1eol s VAL 66 CO 0.01 0.59 -0.04 -0.13 -0.31 0.00 0.00 175.10 175.22 1eol s ARG 67 N -0.74 2.81 -0.05 4.82 0.52 -0.65 -1.06 118.95 124.60 1eol s ARG 67 Ca 0.11 -1.00 0.02 0.00 -0.52 0.00 0.00 55.73 54.35 1eol s ARG 67 Cb -0.11 -3.04 -0.03 0.00 0.52 0.00 0.00 34.95 32.29 1eol s ARG 67 CO 0.02 -0.43 -0.09 0.42 0.02 0.00 0.00 175.30 175.24 1eol s ILE 68 N 1.33 3.48 0.00 1.52 1.01 0.18 -1.52 121.20 127.21 1eol s ILE 68 Ca -0.00 -0.61 0.00 0.00 0.00 0.00 0.00 60.65 60.04 1eol s ILE 68 Cb -0.17 -2.42 0.00 0.00 0.01 0.00 0.00 42.46 39.88 1eol s ILE 68 CO -0.04 0.57 0.00 0.61 0.00 0.00 0.00 174.94 176.08 1eol n GLY 69 N 2.15 0.90 3.87 6.18 0.00 -1.26 -0.75 105.19 116.28 1eol n GLY 69 Ca -0.17 -0.02 -0.31 0.00 0.00 0.00 0.00 46.02 45.52 1eol n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1eol s LYS 70 N -0.76 3.63 0.00 1.61 1.02 -1.26 -4.37 119.74 119.61 1eol s LYS 70 Ca 0.00 0.69 0.00 0.00 0.02 0.00 0.00 55.97 56.68 1eol s LYS 70 Cb 0.00 -2.13 0.00 0.00 -0.52 0.00 0.00 37.83 35.18 1eol s LYS 70 CO 0.00 -0.48 0.00 1.58 -0.92 0.00 0.00 175.35 175.53 1eol n HIS 71 N -2.53 0.00 -2.62 3.18 -0.00 -1.26 -4.95 115.22 107.04 1eol n HIS 71 Ca 0.05 0.00 -0.40 0.00 -0.00 0.00 0.00 57.72 57.37 1eol n HIS 71 Cb 0.54 0.41 -0.05 0.00 -0.00 0.00 0.00 29.99 30.89 1eol n HIS 71 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1eol s SER 72 N -4.92 7.46 -0.04 0.26 0.15 -1.26 -0.93 113.70 114.41 1eol s SER 72 Ca 0.00 2.07 -0.20 0.00 0.70 0.00 0.00 55.95 58.52 1eol s SER 72 Cb 0.00 -2.61 -0.14 0.00 -1.71 0.00 0.00 66.02 61.56 1eol s SER 72 CO 0.00 -0.01 0.83 -0.09 1.20 0.00 0.00 173.24 175.17 1eol h ARG 73 N 4.25 -0.29 0.00 5.44 2.43 -1.56 -3.39 114.38 121.25 1eol h ARG 73 Ca -0.45 0.02 -0.20 0.00 -0.81 0.00 0.00 59.98 58.54 1eol h ARG 73 Cb 1.21 0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 30.79 1eol h ARG 73 CO 0.68 0.07 -1.44 1.79 -1.51 0.00 0.00 179.97 179.56 1eol h THR 74 N -0.92 0.61 -3.55 0.20 1.35 -1.89 -3.48 112.91 105.24 1eol h THR 74 Ca -0.03 -2.19 -0.52 0.00 -0.55 0.00 0.00 66.41 63.12 1eol h THR 74 Cb 0.49 2.15 -0.01 0.00 -1.73 0.00 0.00 68.15 69.06 1eol h THR 74 CO 0.05 0.35 0.43 -0.13 -0.25 0.00 0.00 175.52 175.97 1eol s ARG 75 N -2.84 4.64 -0.55 4.72 3.00 -1.26 -4.98 118.95 121.67 1eol s ARG 75 Ca -0.03 1.59 -0.28 0.00 0.00 0.00 0.00 55.73 57.01 1eol s ARG 75 Cb 0.08 -3.33 0.02 0.00 0.00 0.00 0.00 34.95 31.73 1eol s ARG 75 CO 0.81 0.13 1.34 -0.47 0.00 0.00 0.00 175.30 177.11 1eol s TYR 76 N -0.07 2.40 -1.15 -0.53 5.04 -1.26 -4.83 117.35 116.96 1eol s TYR 76 Ca 0.49 0.48 -0.21 0.00 -2.44 0.00 0.00 57.07 55.39 1eol s TYR 76 Cb -0.27 -4.42 0.04 0.00 0.35 0.00 0.00 41.96 37.66 1eol s TYR 76 CO 0.32 -1.84 1.64 -1.21 -1.34 0.00 0.00 175.55 173.12 1eol s GLU 77 N 5.26 3.62 0.17 4.97 2.02 -1.26 -4.97 118.70 128.51 1eol s GLU 77 Ca 0.50 -1.45 -0.33 0.00 0.02 0.00 0.00 54.97 53.71 1eol s GLU 77 Cb -0.10 -5.41 -0.13 0.00 0.10 0.00 0.00 34.13 28.59 1eol s GLU 77 CO 0.26 -2.43 1.62 -2.13 0.02 0.00 0.00 175.26 172.60 1eol n ARG 77 N 8.63 2.32 -0.75 1.61 0.63 -1.26 -1.38 116.66 126.46 1eol n ARG 77 Ca 0.41 0.84 0.00 0.00 -0.92 0.00 0.00 57.85 58.18 1eol n ARG 77 Cb 0.48 -2.63 0.00 0.00 0.45 0.00 0.00 32.46 30.77 1eol n ARG 77 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1eol n ASN 78 N 3.64 0.00 0.03 6.15 5.03 -1.26 -4.78 115.26 124.06 1eol n ASN 78 Ca 0.17 0.00 -0.01 0.00 0.87 0.00 0.00 54.58 55.60 1eol n ASN 78 Cb 0.30 -0.42 -0.00 0.00 -1.02 0.00 0.00 39.78 38.64 1eol n ASN 78 CO 0.00 0.00 0.00 -0.38 -1.83 0.00 0.00 177.26 175.05 1eol n ILE 79 N -2.00 1.11 -2.42 2.41 5.41 -0.78 -5.07 119.36 118.03 1eol n ILE 79 Ca 0.00 0.32 -0.32 0.00 1.00 0.00 0.00 62.75 63.75 1eol n ILE 79 Cb 0.00 -1.66 -0.03 0.00 -0.71 0.00 0.00 39.64 37.24 1eol n ILE 79 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 176.55 174.72 1eol s GLU 80 N -2.10 3.88 -0.00 0.38 -1.05 -0.48 -4.80 118.70 114.53 1eol s GLU 80 Ca -0.03 0.84 0.06 0.00 -0.15 0.00 0.00 54.97 55.68 1eol s GLU 80 Cb 0.01 -2.18 -0.02 0.00 -0.44 0.00 0.00 34.13 31.50 1eol s GLU 80 CO 0.05 -0.26 -0.18 0.15 0.95 0.00 0.00 175.26 175.97 1eol s LYS 81 N -4.16 1.38 -0.09 -4.83 -0.14 0.07 -4.91 119.74 107.07 1eol s LYS 81 Ca 0.57 -0.68 0.01 0.00 -1.36 0.00 0.00 55.97 54.51 1eol s LYS 81 Cb -0.10 -1.36 -0.02 0.00 -1.68 0.00 0.00 37.83 34.66 1eol s LYS 81 CO 0.34 0.37 -0.10 0.42 -0.76 0.00 0.00 175.35 175.61 1eol s ILE 82 N -0.50 3.37 0.10 2.17 1.01 -1.26 -0.65 121.20 125.44 1eol s ILE 82 Ca 0.06 -0.59 0.06 0.00 0.00 0.00 0.00 60.65 60.18 1eol s ILE 82 Cb -0.07 -2.38 -0.03 0.00 0.01 0.00 0.00 42.46 39.99 1eol s ILE 82 CO -0.00 0.57 -0.14 -0.44 0.00 0.00 0.00 174.94 174.92 1eol s SER 83 N -0.37 1.87 0.08 3.58 0.01 -0.22 -4.98 113.70 113.67 1eol s SER 83 Ca 0.05 -0.73 0.01 0.00 1.31 0.00 0.00 55.95 56.59 1eol s SER 83 Cb -0.12 -0.06 -0.04 0.00 0.21 0.00 0.00 66.02 66.01 1eol s SER 83 CO 0.02 -0.11 0.20 -0.04 0.41 0.00 0.00 173.24 173.72 1eol s MET 84 N -2.27 3.31 0.05 12.44 -1.94 -1.26 -1.52 119.30 128.11 1eol s MET 84 Ca 0.04 -0.54 -0.22 0.00 -1.71 0.00 0.00 55.69 53.27 1eol s MET 84 Cb -0.07 -2.95 -0.06 0.00 2.01 0.00 0.00 34.83 33.76 1eol s MET 84 CO 0.03 0.58 0.65 -0.51 -0.01 0.00 0.00 175.02 175.75 1eol s LEU 85 N -2.65 4.48 -0.21 -0.03 1.43 -1.26 -0.34 118.68 120.10 1eol s LEU 85 Ca 0.34 1.31 0.07 0.00 -1.03 0.00 0.00 54.13 54.81 1eol s LEU 85 Cb -0.12 -3.03 -0.21 0.00 0.03 0.00 0.00 46.19 42.86 1eol s LEU 85 CO 0.27 0.14 0.01 1.21 0.23 0.00 0.00 176.35 178.21 1eol n GLU 86 N 2.33 0.67 -3.63 1.70 2.13 0.96 -4.68 120.64 120.12 1eol n GLU 86 Ca -0.07 0.13 -0.14 0.00 0.66 0.00 0.00 57.16 57.75 1eol n GLU 86 Cb 0.50 -1.57 -0.07 0.00 0.27 0.00 0.00 31.44 30.58 1eol n GLU 86 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 1eol s LYS 87 N -2.52 0.80 -0.09 5.31 2.36 -1.18 -5.00 119.74 119.42 1eol s LYS 87 Ca -0.23 0.93 0.01 0.00 -2.55 0.00 0.00 55.97 54.13 1eol s LYS 87 Cb 0.08 0.39 -0.02 0.00 -1.05 0.00 0.00 37.83 37.23 1eol s LYS 87 CO 0.71 -0.10 -0.12 0.42 1.55 0.00 0.00 175.35 177.81 1eol s ILE 88 N 0.32 3.25 -0.19 5.43 1.01 -1.26 -0.74 121.20 129.03 1eol s ILE 88 Ca 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 60.65 60.03 1eol s ILE 88 Cb -0.05 -2.33 0.04 0.00 0.01 0.00 0.00 42.46 40.13 1eol s ILE 88 CO 0.00 0.56 -0.09 -0.31 0.00 0.00 0.00 174.94 175.11 1eol s TYR 89 N -0.24 2.16 -0.11 3.97 1.51 0.35 -5.00 117.35 119.99 1eol s TYR 89 Ca 0.02 -1.41 -0.05 0.00 -1.01 0.00 0.00 57.07 54.63 1eol s TYR 89 Cb -0.13 -1.53 -0.04 0.00 -0.11 0.00 0.00 41.96 40.16 1eol s TYR 89 CO 0.03 -0.70 0.07 0.42 -1.11 0.00 0.00 175.55 174.26 1eol s ILE 90 N 1.48 4.87 0.10 2.71 1.01 -1.26 -0.38 121.20 129.72 1eol s ILE 90 Ca -0.00 -0.03 -0.34 0.00 0.00 0.00 0.00 60.65 60.27 1eol s ILE 90 Cb -0.16 -3.10 -0.14 0.00 0.01 0.00 0.00 42.46 39.08 1eol s ILE 90 CO -0.08 0.59 1.62 1.57 0.00 0.00 0.00 174.94 178.65 1eol n HIS 91 N 2.24 2.21 0.02 3.97 -0.00 -1.04 -4.84 115.22 117.78 1eol n HIS 91 Ca -0.19 0.25 0.18 0.00 -0.00 0.00 0.00 57.72 57.96 1eol n HIS 91 Cb 0.54 -2.55 0.67 0.00 -0.00 0.00 0.00 29.99 28.65 1eol n HIS 91 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 1eol h PRO 92 N 6.49 0.03 -0.67 1.57 0.13 -1.94 -1.86 132.00 135.74 1eol h PRO 92 Ca -0.46 -0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.36 1eol h PRO 92 Cb 1.27 -0.01 -0.18 0.00 0.13 0.00 0.00 31.00 32.21 1eol h PRO 92 CO 0.89 0.02 0.28 0.54 -0.23 0.00 0.00 178.00 179.50 1eol n ARG 93 N -4.40 2.43 -1.91 0.86 1.74 -1.26 -4.98 116.66 109.14 1eol n ARG 93 Ca 0.08 -3.08 -0.42 0.00 -0.77 0.00 0.00 57.85 53.67 1eol n ARG 93 Cb 0.54 -2.04 -0.03 0.00 -1.02 0.00 0.00 32.46 29.91 1eol n ARG 93 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 1eol s TYR 94 N -3.19 2.01 -1.13 -1.55 5.04 -0.70 -4.69 117.35 113.13 1eol s TYR 94 Ca 0.51 0.11 -0.09 0.00 -2.44 0.00 0.00 57.07 55.16 1eol s TYR 94 Cb 0.44 -4.00 0.27 0.00 0.35 0.00 0.00 41.96 39.02 1eol s TYR 94 CO 0.07 -4.22 1.18 -1.71 -1.34 0.00 0.00 175.55 169.53 1eol n ASN 95 N 6.62 5.57 0.19 4.32 2.85 0.31 -4.82 115.26 130.29 1eol n ASN 95 Ca 0.17 -3.06 0.07 0.00 -0.11 0.00 0.00 54.58 51.65 1eol n ASN 95 Cb 0.42 -1.39 0.25 0.00 1.24 0.00 0.00 39.78 40.29 1eol n ASN 95 CO 0.00 0.00 0.00 4.11 -2.11 0.00 0.00 177.26 179.26 1eol h TRP 96 N 6.59 0.00 -0.04 1.20 5.08 -1.92 0.17 115.95 127.02 1eol h TRP 96 Ca 0.19 0.00 -0.05 0.00 1.08 0.00 0.00 58.89 60.11 1eol h TRP 96 Cb 0.85 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 27.00 1eol h TRP 96 CO 0.80 0.33 -0.23 0.00 -1.28 0.00 0.00 178.44 178.06 1eol h ARG 97 N 0.00 0.07 0.00 0.12 3.08 -2.00 -3.43 114.38 112.22 1eol h ARG 97 Ca -0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1eol h ARG 97 Cb 1.04 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.08 1eol h ARG 97 CO 0.04 0.30 0.00 -1.91 -1.07 0.00 0.00 179.97 177.33 1eol n GLU 97 N -4.24 0.00 -0.18 0.04 2.13 -1.22 -5.01 120.64 112.17 1eol n GLU 97 Ca -0.02 0.00 0.03 0.00 0.66 0.00 0.00 57.16 57.83 1eol n GLU 97 Cb 0.30 -0.09 0.04 0.00 0.27 0.00 0.00 31.44 31.97 1eol n GLU 97 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 1eol n ASN 98 N -2.69 1.08 -3.34 4.31 6.94 -1.21 -4.98 115.26 115.37 1eol n ASN 98 Ca 0.00 -2.12 -0.24 0.00 -0.02 0.00 0.00 54.58 52.20 1eol n ASN 98 Cb 0.00 -0.19 0.05 0.00 -2.36 0.00 0.00 39.78 37.28 1eol n ASN 98 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 1eol n LEU 99 N -0.52 -2.83 -4.75 -4.53 4.77 0.59 -4.95 117.00 104.78 1eol n LEU 99 Ca 0.05 -0.43 -0.41 0.00 -0.03 0.00 0.00 56.01 55.18 1eol n LEU 99 Cb 0.56 -2.89 -0.03 0.00 -2.33 0.00 0.00 43.42 38.73 1eol n LEU 99 CO 0.00 0.40 0.96 -0.62 -1.33 0.00 0.00 177.39 176.80 1eol s ASP 100 N -2.98 6.89 -1.08 -1.43 2.15 -1.22 -2.87 116.67 116.13 1eol s ASP 100 Ca 0.45 2.50 -0.04 0.00 0.43 0.00 0.00 52.55 55.89 1eol s ASP 100 Cb -0.20 -2.63 0.00 0.00 -0.30 0.00 0.00 42.92 39.79 1eol s ASP 100 CO 0.55 -0.48 0.93 0.54 -0.17 0.00 0.00 175.17 176.54 1eol n ARG 101 N 1.74 -6.20 -2.51 4.34 1.74 -1.26 -0.53 116.66 113.97 1eol n ARG 101 Ca 0.03 0.71 -0.41 0.00 -0.77 0.00 0.00 57.85 57.41 1eol n ARG 101 Cb 0.43 -5.35 -0.01 0.00 -1.02 0.00 0.00 32.46 26.50 1eol n ARG 101 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1eol s ASP 102 N -3.69 6.58 -0.08 0.55 2.15 -1.14 -4.40 116.67 116.65 1eol s ASP 102 Ca 0.26 -2.28 -0.14 0.00 0.43 0.00 0.00 52.55 50.82 1eol s ASP 102 Cb -0.11 -2.58 0.03 0.00 -0.30 0.00 0.00 42.92 39.96 1eol s ASP 102 CO 0.62 -1.44 0.35 -0.51 -0.17 0.00 0.00 175.17 174.01 1eol s ILE 103 N 5.16 0.03 -0.07 4.11 2.07 -1.26 -3.99 121.20 127.24 1eol s ILE 103 Ca 0.55 -0.21 -0.18 0.00 -1.41 0.00 0.00 60.65 59.40 1eol s ILE 103 Cb 0.03 -0.57 0.04 0.00 0.13 0.00 0.00 42.46 42.09 1eol s ILE 103 CO 0.07 -0.12 0.41 0.00 -1.91 0.00 0.00 174.94 173.40 1eol s ALA 104 N -0.52 -1.04 0.07 1.50 0.00 0.10 -2.50 121.76 119.35 1eol s ALA 104 Ca -0.06 0.78 0.07 0.00 0.00 0.00 0.00 51.96 52.74 1eol s ALA 104 Cb -0.04 -0.19 -0.04 0.00 0.00 0.00 0.00 23.12 22.86 1eol s ALA 104 CO 0.02 -0.26 -0.13 -0.51 0.00 0.00 0.00 175.76 174.88 1eol s LEU 105 N -0.81 2.86 -0.07 0.00 1.43 0.49 -1.20 118.68 121.39 1eol s LEU 105 Ca -0.09 -0.39 0.01 0.00 -1.03 0.00 0.00 54.13 52.63 1eol s LEU 105 Cb -0.04 -1.68 0.02 0.00 0.03 0.00 0.00 46.19 44.52 1eol s LEU 105 CO 0.04 0.22 -0.07 -0.04 0.23 0.00 0.00 176.35 176.73 1eol s MET 106 N -1.81 1.17 -0.22 1.70 -1.94 0.04 -0.49 119.30 117.74 1eol s MET 106 Ca 0.18 -0.19 -0.15 0.00 -1.71 0.00 0.00 55.69 53.82 1eol s MET 106 Cb -0.11 -1.15 -0.04 0.00 2.01 0.00 0.00 34.83 35.55 1eol s MET 106 CO 0.09 -0.11 0.36 0.21 -0.01 0.00 0.00 175.02 175.56 1eol s LYS 107 N 1.11 4.12 0.31 2.03 2.20 0.08 -1.11 119.74 128.48 1eol s LYS 107 Ca -0.07 0.09 -0.28 0.00 -0.36 0.00 0.00 55.97 55.35 1eol s LYS 107 Cb -0.14 -3.57 -0.09 0.00 -1.51 0.00 0.00 37.83 32.52 1eol s LYS 107 CO -0.01 -0.09 1.05 -0.51 -0.36 0.00 0.00 175.35 175.44 1eol s LEU 108 N 1.47 4.42 0.32 5.43 1.43 0.29 -0.03 118.68 132.02 1eol s LEU 108 Ca 0.16 2.13 0.01 0.00 -1.03 0.00 0.00 54.13 55.40 1eol s LEU 108 Cb -0.15 -3.83 0.54 0.00 0.03 0.00 0.00 46.19 42.79 1eol s LEU 108 CO 0.08 -0.21 1.96 0.50 0.23 0.00 0.00 176.35 178.91 1eol h LYS 109 N 3.40 0.88 -4.44 1.70 3.64 -0.96 -3.42 116.57 117.37 1eol h LYS 109 Ca -0.47 -0.08 -0.30 0.00 -1.27 0.00 0.00 60.65 58.52 1eol h LYS 109 Cb 1.21 -0.18 -0.25 0.00 -0.41 0.00 0.00 32.23 32.60 1eol h LYS 109 CO 0.65 0.63 -0.75 0.15 -2.27 0.00 0.00 179.45 177.87 1eol s LYS 110 N -5.63 0.48 0.43 1.90 3.01 -1.26 -4.98 119.74 113.68 1eol s LYS 110 Ca -0.10 -0.45 -0.26 0.00 -1.01 0.00 0.00 55.97 54.15 1eol s LYS 110 Cb 0.17 -0.37 -0.09 0.00 -1.01 0.00 0.00 37.83 36.54 1eol s LYS 110 CO 0.78 0.09 1.40 -2.14 0.51 0.00 0.00 175.35 175.98 1eol s PRO 111 N -0.78 3.81 0.06 -1.68 0.02 -1.26 -4.88 135.00 130.29 1eol s PRO 111 Ca -0.03 2.36 -0.10 0.00 0.02 0.00 0.00 61.00 63.25 1eol s PRO 111 Cb -0.06 -2.72 -0.06 0.00 0.02 0.00 0.00 34.50 31.69 1eol s PRO 111 CO 0.00 -0.69 0.39 0.54 -0.33 0.00 0.00 177.00 176.90 1eol s VAL 112 N -1.21 5.11 0.02 3.83 0.11 0.09 -5.01 120.40 123.34 1eol s VAL 112 Ca 0.59 0.46 -0.20 0.00 -2.93 0.00 0.00 61.98 59.90 1eol s VAL 112 Cb -0.42 -3.64 -0.06 0.00 -1.53 0.00 0.00 36.38 30.73 1eol s VAL 112 CO 0.55 0.33 0.57 0.00 -3.33 0.00 0.00 175.10 173.22 1eol s ALA 113 N -1.35 3.54 0.68 1.54 0.00 -1.26 -4.80 121.76 120.10 1eol s ALA 113 Ca 0.31 0.01 -0.11 0.00 0.00 0.00 0.00 51.96 52.17 1eol s ALA 113 Cb -0.14 -2.68 -0.00 0.00 0.00 0.00 0.00 23.12 20.30 1eol s ALA 113 CO 0.17 0.27 1.06 -0.06 0.00 0.00 0.00 175.76 177.20 1eol s PHE 114 N -0.56 3.36 0.00 0.00 0.08 -1.26 -4.90 117.98 114.70 1eol s PHE 114 Ca 0.30 1.24 0.00 0.00 0.12 0.00 0.00 56.93 58.59 1eol s PHE 114 Cb -0.18 -2.89 0.00 0.00 -0.57 0.00 0.00 43.02 39.38 1eol s PHE 114 CO 0.17 -1.04 0.00 -1.13 -0.10 0.00 0.00 175.22 173.12 1eol n SER 115 N -2.97 0.00 0.24 1.36 3.41 -0.38 -4.94 113.62 110.34 1eol n SER 115 Ca 0.07 -0.34 0.11 0.00 -0.26 0.00 0.00 58.87 58.44 1eol n SER 115 Cb 0.55 0.00 0.54 0.00 -0.26 0.00 0.00 64.21 65.04 1eol n SER 115 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1eol h ASP 116 N 0.00 0.00 -0.01 4.04 3.32 -1.98 -3.19 116.42 118.60 1eol h ASP 116 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1eol h ASP 116 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1eol h ASP 116 CO 0.00 0.19 -0.31 -1.22 -1.72 0.00 0.00 179.24 176.18 1eol n TYR 117 N -3.44 0.00 -3.93 4.55 4.01 -1.26 -4.43 117.16 112.65 1eol n TYR 117 Ca -0.00 0.00 -0.28 0.00 -0.16 0.00 0.00 57.90 57.45 1eol n TYR 117 Cb 0.37 0.00 -0.17 0.00 -0.31 0.00 0.00 39.34 39.24 1eol n TYR 117 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1eol s ILE 118 N -1.68 1.22 -0.28 -0.72 1.01 -1.21 -4.24 121.20 115.31 1eol s ILE 118 Ca 0.09 -0.55 -0.21 0.00 0.00 0.00 0.00 60.65 59.98 1eol s ILE 118 Cb 0.10 -1.28 0.10 0.00 0.01 0.00 0.00 42.46 41.39 1eol s ILE 118 CO 0.35 0.27 0.85 -2.28 0.00 0.00 0.00 174.94 174.13 1eol s HIS 119 N 1.61 -0.73 0.60 3.97 2.46 -0.41 -1.25 115.29 121.54 1eol s HIS 119 Ca 0.03 1.60 -0.17 0.00 0.47 0.00 0.00 55.06 56.99 1eol s HIS 119 Cb -0.14 0.41 -0.03 0.00 -0.13 0.00 0.00 32.58 32.69 1eol s HIS 119 CO -0.08 -0.36 1.10 -1.25 -2.47 0.00 0.00 174.74 171.68 1eol s PRO 120 N 0.88 3.15 0.26 2.88 0.04 -1.26 -2.47 135.00 138.47 1eol s PRO 120 Ca -0.04 1.40 0.04 0.00 0.04 0.00 0.00 61.00 62.44 1eol s PRO 120 Cb -0.05 -2.00 -0.03 0.00 0.04 0.00 0.00 34.50 32.47 1eol s PRO 120 CO -0.10 -0.98 0.39 0.54 0.04 0.00 0.00 177.00 176.90 1eol s VAL 121 N -2.19 5.20 0.26 -0.36 0.11 -0.70 -1.57 120.40 121.15 1eol s VAL 121 Ca 0.68 -0.91 -0.13 0.00 -2.93 0.00 0.00 61.98 58.69 1eol s VAL 121 Cb -0.20 -3.85 -0.08 0.00 -1.53 0.00 0.00 36.38 30.72 1eol s VAL 121 CO 0.35 -0.36 0.64 0.00 -3.33 0.00 0.00 175.10 172.40 1eol s LEU 123 N -2.77 4.34 0.65 0.00 1.43 -1.26 -0.89 118.68 120.18 1eol s LEU 123 Ca 0.49 0.69 -0.16 0.00 -1.03 0.00 0.00 54.13 54.13 1eol s LEU 123 Cb -0.11 -2.44 -0.01 0.00 0.03 0.00 0.00 46.19 43.66 1eol s LEU 123 CO 0.19 0.21 1.12 -2.16 0.23 0.00 0.00 176.35 175.94 1eol s PRO 124 N -0.23 2.84 0.36 1.29 0.04 -1.26 -4.93 135.00 133.09 1eol s PRO 124 Ca 0.20 1.46 0.08 0.00 0.04 0.00 0.00 61.00 62.78 1eol s PRO 124 Cb -0.14 -1.95 -0.03 0.00 0.04 0.00 0.00 34.50 32.41 1eol s PRO 124 CO 0.08 -1.23 0.24 0.16 0.04 0.00 0.00 177.00 176.28 1eol s ASP 125 N -2.40 4.93 0.25 6.66 1.47 -1.26 -4.88 116.67 121.44 1eol s ASP 125 Ca 0.69 -0.70 -0.11 0.00 1.18 0.00 0.00 52.55 53.61 1eol s ASP 125 Cb -0.22 -0.77 0.37 0.00 -0.34 0.00 0.00 42.92 41.97 1eol s ASP 125 CO 0.39 -0.39 1.58 -0.09 0.68 0.00 0.00 175.17 177.34 1eol h ARG 126 N 1.35 -0.01 -0.37 2.11 9.65 -1.97 -1.00 114.38 124.13 1eol h ARG 126 Ca -0.44 0.00 -0.12 0.00 -1.10 0.00 0.00 59.98 58.33 1eol h ARG 126 Cb 1.25 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.82 1eol h ARG 126 CO 0.61 -0.01 -0.25 1.05 2.80 0.00 0.00 179.97 184.18 1eol h GLU 127 N -0.01 0.76 -1.05 0.20 9.09 -2.04 -0.91 114.58 120.62 1eol h GLU 127 Ca 0.41 -0.32 0.00 0.00 0.05 0.00 0.00 59.36 59.50 1eol h GLU 127 Cb 0.64 -0.03 0.00 0.00 -1.65 0.00 0.00 28.75 27.72 1eol h GLU 127 CO -0.92 0.93 0.00 2.41 0.05 0.00 0.00 179.01 181.48 1eol n THR 128 N -4.10 0.21 0.00 -1.06 -1.04 -0.38 -1.96 114.28 105.94 1eol n THR 128 Ca -0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1eol n THR 128 Cb 0.45 -0.46 0.00 0.00 -1.82 0.00 0.00 70.33 68.50 1eol n THR 128 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1eol n ALA 129 N 0.58 0.00 0.09 2.41 0.00 -0.35 -1.35 120.51 121.89 1eol n ALA 129 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.38 1eol n ALA 129 Cb 0.15 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.58 1eol n ALA 129 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1eol h SER 129 N 0.00 0.06 0.28 0.00 4.64 -1.67 -3.37 113.55 113.49 1eol h SER 129 Ca 0.00 -0.06 -0.33 0.00 -0.47 0.00 0.00 61.79 60.93 1eol h SER 129 Cb 0.00 -0.02 -0.03 0.00 -0.31 0.00 0.00 62.40 62.04 1eol h SER 129 CO 0.00 0.90 -1.86 -0.07 -0.87 0.00 0.00 176.83 174.93 1eol h LEU 129 N 0.02 0.26 -6.61 5.97 3.38 -1.46 -3.41 115.31 113.46 1eol h LEU 129 Ca -0.02 -0.57 -0.65 0.00 0.09 0.00 0.00 57.88 56.72 1eol h LEU 129 Cb 1.53 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 42.18 1eol h LEU 129 CO 0.12 1.51 2.56 0.18 0.09 0.00 0.00 178.44 182.90 1eol n LEU 130 N -3.32 5.38 -4.12 1.67 4.77 -1.26 -4.83 117.00 115.30 1eol n LEU 130 Ca -0.25 -3.64 -0.20 0.00 -0.03 0.00 0.00 56.01 51.89 1eol n LEU 130 Cb 1.05 -1.51 -0.14 0.00 -2.33 0.00 0.00 43.42 40.49 1eol n LEU 130 CO 0.44 0.25 -0.46 -1.10 -1.33 0.00 0.00 177.39 175.19 1eol s GLN 131 N 4.20 0.94 0.19 3.23 -0.21 -1.26 -4.96 119.66 121.79 1eol s GLN 131 Ca 0.53 -0.65 -0.33 0.00 0.02 0.00 0.00 55.36 54.93 1eol s GLN 131 Cb 0.11 -0.92 -0.14 0.00 1.00 0.00 0.00 33.01 33.06 1eol s GLN 131 CO 0.02 0.24 1.40 0.00 -2.12 0.00 0.00 175.29 174.82 1eol n ALA 132 N 2.17 0.57 0.00 6.09 0.00 -1.26 -1.18 120.51 126.89 1eol n ALA 132 Ca -0.17 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.71 1eol n ALA 132 Cb 0.55 -2.22 0.00 0.00 0.00 0.00 0.00 19.45 17.78 1eol n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1eol n GLY 133 N 2.49 3.09 3.74 0.00 0.00 0.82 -4.92 105.19 110.41 1eol n GLY 133 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 1eol n GLY 133 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1eol s TYR 134 N -2.41 3.43 0.10 1.61 1.51 -0.33 -4.57 117.35 116.68 1eol s TYR 134 Ca 0.00 1.47 -0.12 0.00 -1.01 0.00 0.00 57.07 57.41 1eol s TYR 134 Cb 0.00 -3.42 -0.06 0.00 -0.11 0.00 0.00 41.96 38.37 1eol s TYR 134 CO 0.00 -1.13 0.46 0.15 -1.11 0.00 0.00 175.55 173.92 1eol s LYS 135 N -0.56 3.87 0.47 -0.62 1.02 -1.26 -0.26 119.74 122.40 1eol s LYS 135 Ca 0.51 0.33 0.02 0.00 0.02 0.00 0.00 55.97 56.86 1eol s LYS 135 Cb -0.33 -3.00 -0.02 0.00 -0.52 0.00 0.00 37.83 33.95 1eol s LYS 135 CO 0.38 0.55 0.04 0.20 -0.92 0.00 0.00 175.35 175.60 1eol s GLY 136 N -1.65 2.85 -0.04 -3.33 0.00 0.26 -4.86 107.32 100.55 1eol s GLY 136 Ca 0.34 -0.81 0.03 0.00 0.00 0.00 0.00 44.72 44.27 1eol s GLY 136 CO 0.18 -2.08 -0.13 -1.60 0.00 0.00 0.00 173.10 169.47 1eol s ARG 137 N -3.82 1.39 -0.03 2.90 3.52 0.04 -0.56 118.95 122.39 1eol s ARG 137 Ca 0.14 -0.44 0.07 0.00 -0.13 0.00 0.00 55.73 55.37 1eol s ARG 137 Cb 0.03 -1.23 -0.02 0.00 -1.56 0.00 0.00 34.95 32.16 1eol s ARG 137 CO 0.08 0.15 -0.24 0.08 -0.81 0.00 0.00 175.30 174.56 1eol s VAL 138 N 0.20 2.25 0.07 7.11 1.01 -0.02 -1.20 120.40 129.82 1eol s VAL 138 Ca -0.05 -1.03 0.04 0.00 0.00 0.00 0.00 61.98 60.94 1eol s VAL 138 Cb -0.11 -1.80 -0.03 0.00 0.00 0.00 0.00 36.38 34.44 1eol s VAL 138 CO 0.02 0.58 -0.12 0.42 0.00 0.00 0.00 175.10 176.00 1eol s THR 139 N -0.56 0.95 0.00 3.92 -4.23 -1.25 -1.35 115.64 113.12 1eol s THR 139 Ca 0.08 -1.30 0.00 0.00 -1.18 0.00 0.00 61.69 59.29 1eol s THR 139 Cb -0.11 -1.00 0.00 0.00 1.34 0.00 0.00 72.50 72.74 1eol s THR 139 CO -0.00 -0.31 0.00 0.61 -0.54 0.00 0.00 174.62 174.38 1eol n GLY 140 N 1.22 1.10 1.30 3.99 0.00 -0.74 -4.65 105.19 107.41 1eol n GLY 140 Ca -0.21 -0.89 0.08 0.00 0.00 0.00 0.00 46.02 45.01 1eol n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1eol n TRP 141 N -0.38 1.36 -1.19 1.61 8.01 -1.26 -1.94 117.44 123.65 1eol n TRP 141 Ca 0.00 -0.76 -0.22 0.00 -1.31 0.00 0.00 57.50 55.22 1eol n TRP 141 Cb 0.00 -0.34 0.17 0.00 -2.01 0.00 0.00 31.31 29.13 1eol n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1eol n GLY 142 N 0.19 -2.22 3.71 6.99 0.00 -1.26 -4.55 105.19 108.06 1eol n GLY 142 Ca 0.23 -1.56 -0.40 0.00 0.00 0.00 0.00 46.02 44.29 1eol n GLY 142 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1eol n ASN 143 N -4.10 2.60 -0.06 1.61 5.03 0.16 -3.29 115.26 117.22 1eol n ASN 143 Ca 0.12 1.07 0.13 0.00 0.87 0.00 0.00 54.58 56.76 1eol n ASN 143 Cb 0.43 -1.53 0.39 0.00 -1.02 0.00 0.00 39.78 38.05 1eol n ASN 143 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 1eol n LEU 144 N -0.15 0.50 -3.65 3.41 4.77 -0.59 -0.68 117.00 120.61 1eol n LEU 144 Ca 0.07 0.04 -0.13 0.00 -0.03 0.00 0.00 56.01 55.96 1eol n LEU 144 Cb 0.41 -0.26 -0.06 0.00 -2.33 0.00 0.00 43.42 41.18 1eol n LEU 144 CO 0.57 0.11 0.18 -0.75 -1.33 0.00 0.00 177.39 176.17 1eol s LYS 145 N -2.84 0.94 0.00 3.23 2.47 -1.26 -4.41 119.74 117.87 1eol s LYS 145 Ca 0.16 -0.32 0.00 0.00 -1.56 0.00 0.00 55.97 54.26 1eol s LYS 145 Cb 0.18 0.42 0.00 0.00 -1.46 0.00 0.00 37.83 36.97 1eol s LYS 145 CO 0.61 -0.32 0.46 -1.91 0.16 0.00 0.00 175.35 174.35 1eol n GLU 146 N 0.52 0.49 0.00 4.03 2.13 -1.26 -4.94 120.64 121.61 1eol n GLU 146 Ca -0.19 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.63 1eol n GLU 146 Cb 0.60 -1.25 0.00 0.00 0.27 0.00 0.00 31.44 31.05 1eol n GLU 146 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1eol n GLY 150 N 0.70 0.04 3.76 8.31 0.00 -1.26 -4.98 105.19 111.75 1eol n GLY 150 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 1eol n GLY 150 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1eol s GLN 151 N 1.20 2.89 0.57 1.61 -1.52 -1.26 -1.55 119.66 121.61 1eol s GLN 151 Ca 0.00 -0.64 -0.11 0.00 -1.95 0.00 0.00 55.36 52.66 1eol s GLN 151 Cb 0.00 -2.74 -0.05 0.00 -0.22 0.00 0.00 33.01 30.00 1eol s GLN 151 CO 0.00 0.59 0.97 -2.14 -0.25 0.00 0.00 175.29 174.47 1eol s PRO 152 N -2.09 3.66 0.04 2.91 0.02 -1.26 -4.95 135.00 133.33 1eol s PRO 152 Ca 0.26 0.69 0.02 0.00 0.02 0.00 0.00 61.00 61.99 1eol s PRO 152 Cb -0.12 -2.15 -0.25 0.00 0.02 0.00 0.00 34.50 32.00 1eol s PRO 152 CO 0.18 -0.44 0.99 0.66 -0.33 0.00 0.00 177.00 178.06 1eol h SER 153 N 0.06 0.22 -3.98 2.53 4.64 -1.97 -3.43 113.55 111.61 1eol h SER 153 Ca -0.45 -0.29 -0.43 0.00 -0.47 0.00 0.00 61.79 60.15 1eol h SER 153 Cb 1.19 -0.07 -0.14 0.00 -0.31 0.00 0.00 62.40 63.07 1eol h SER 153 CO 0.62 1.24 -0.59 0.68 -0.87 0.00 0.00 176.83 177.91 1eol s VAL 154 N -2.65 0.69 0.16 0.95 -7.23 -1.26 -1.55 120.40 109.51 1eol s VAL 154 Ca -0.05 -2.00 -0.34 0.00 -1.81 0.00 0.00 61.98 57.78 1eol s VAL 154 Cb 0.08 -2.61 -0.14 0.00 0.56 0.00 0.00 36.38 34.27 1eol s VAL 154 CO 0.84 0.00 1.54 -0.11 -0.31 0.00 0.00 175.10 177.06 1eol n LEU 155 N -0.62 2.96 -4.92 1.32 7.94 -0.11 -4.85 117.00 118.72 1eol n LEU 155 Ca -0.01 1.09 -0.23 0.00 -1.11 0.00 0.00 56.01 55.75 1eol n LEU 155 Cb 0.66 -1.40 -0.03 0.00 0.53 0.00 0.00 43.42 43.17 1eol n LEU 155 CO 0.38 -0.38 -0.10 -1.10 -1.11 0.00 0.00 177.39 175.09 1eol s GLN 156 N 0.77 3.30 -0.04 1.96 -1.52 -0.82 -0.22 119.66 123.08 1eol s GLN 156 Ca 0.78 -0.77 -0.04 0.00 -1.95 0.00 0.00 55.36 53.39 1eol s GLN 156 Cb -0.70 -2.83 0.01 0.00 -0.22 0.00 0.00 33.01 29.26 1eol s GLN 156 CO 0.40 0.46 0.11 0.54 -0.25 0.00 0.00 175.29 176.54 1eol s VAL 157 N -1.91 0.00 -0.06 1.09 0.11 0.45 -1.80 120.40 118.29 1eol s VAL 157 Ca 0.34 -0.01 -0.05 0.00 -2.93 0.00 0.00 61.98 59.32 1eol s VAL 157 Cb -0.10 -0.16 0.02 0.00 -1.53 0.00 0.00 36.38 34.62 1eol s VAL 157 CO 0.28 -0.01 0.16 0.54 -3.33 0.00 0.00 175.10 172.74 1eol s VAL 158 N 0.03 -0.01 -0.21 2.04 0.11 -0.46 -1.61 120.40 120.31 1eol s VAL 158 Ca -0.00 0.03 -0.09 0.00 -2.93 0.00 0.00 61.98 58.99 1eol s VAL 158 Cb -0.01 -0.24 -0.04 0.00 -1.53 0.00 0.00 36.38 34.56 1eol s VAL 158 CO 0.00 0.01 0.10 0.20 -3.33 0.00 0.00 175.10 172.08 1eol s ASN 159 N 0.27 5.82 0.01 3.54 0.01 -1.26 -0.84 114.94 122.50 1eol s ASN 159 Ca -0.02 0.09 0.04 0.00 -0.71 0.00 0.00 52.86 52.27 1eol s ASN 159 Cb -0.03 -2.02 -0.01 0.00 0.41 0.00 0.00 41.25 39.60 1eol s ASN 159 CO -0.01 0.13 -0.11 -0.76 -1.51 0.00 0.00 177.10 174.84 1eol s LEU 160 N 0.64 2.10 0.36 0.60 1.43 0.27 -4.92 118.68 119.16 1eol s LEU 160 Ca 0.05 -0.32 -0.25 0.00 -1.03 0.00 0.00 54.13 52.59 1eol s LEU 160 Cb -0.13 -0.52 -0.10 0.00 0.03 0.00 0.00 46.19 45.48 1eol s LEU 160 CO 0.01 0.06 0.98 -2.16 0.23 0.00 0.00 176.35 175.47 1eol s PRO 161 N -0.69 4.40 0.29 1.29 0.04 -1.26 -0.57 135.00 138.49 1eol s PRO 161 Ca 0.02 1.35 -0.29 0.00 0.04 0.00 0.00 61.00 62.12 1eol s PRO 161 Cb -0.06 -2.61 -0.09 0.00 0.04 0.00 0.00 34.50 31.77 1eol s PRO 161 CO 0.00 0.10 1.08 0.42 0.04 0.00 0.00 177.00 178.64 1eol s ILE 162 N -1.73 3.54 0.06 0.56 1.01 0.64 -1.35 121.20 123.93 1eol s ILE 162 Ca 0.55 1.53 0.03 0.00 0.00 0.00 0.00 60.65 62.76 1eol s ILE 162 Cb -0.18 -3.96 -0.04 0.00 0.01 0.00 0.00 42.46 38.29 1eol s ILE 162 CO 0.23 0.34 0.02 -0.69 0.00 0.00 0.00 174.94 174.84 1eol s VAL 163 N -1.20 4.17 0.33 2.92 1.01 -0.90 -0.13 120.40 126.61 1eol s VAL 163 Ca 0.45 -0.81 -0.29 0.00 0.00 0.00 0.00 61.98 61.33 1eol s VAL 163 Cb -0.31 -2.95 -0.11 0.00 0.00 0.00 0.00 36.38 33.01 1eol s VAL 163 CO 0.39 0.21 1.55 -0.62 0.00 0.00 0.00 175.10 176.64 1eol n GLU 164 N 0.84 2.69 -0.28 2.72 4.71 -1.26 -4.63 120.64 125.42 1eol n GLU 164 Ca -0.12 0.95 0.07 0.00 -0.01 0.00 0.00 57.16 58.06 1eol n GLU 164 Cb 0.52 -2.71 0.22 0.00 -1.01 0.00 0.00 31.44 28.45 1eol n GLU 164 CO 0.00 0.00 0.00 -0.09 0.09 0.00 0.00 177.13 177.13 1eol h ARG 165 N 4.08 0.48 -0.95 3.49 2.43 -1.98 -1.12 114.38 120.80 1eol h ARG 165 Ca -0.48 -0.03 0.02 0.00 -0.81 0.00 0.00 59.98 58.68 1eol h ARG 165 Cb 1.23 -0.11 -0.05 0.00 -0.42 0.00 0.00 29.97 30.62 1eol h ARG 165 CO 0.73 0.31 0.63 -1.35 -1.51 0.00 0.00 179.97 178.79 1eol h PRO 166 N 0.49 1.23 -0.56 0.20 0.11 -1.99 -0.22 132.00 131.25 1eol h PRO 166 Ca 0.45 -0.07 -0.08 0.00 0.11 0.00 0.00 66.00 66.41 1eol h PRO 166 Cb 0.70 -0.28 -0.02 0.00 0.11 0.00 0.00 31.00 31.51 1eol h PRO 166 CO -0.41 0.81 0.02 0.28 -0.21 0.00 0.00 178.00 178.49 1eol h VAL 167 N 1.27 1.26 -0.05 3.15 2.07 -1.61 -0.59 116.25 121.74 1eol h VAL 167 Ca 0.36 -1.07 -0.00 0.00 0.82 0.00 0.00 66.70 66.81 1eol h VAL 167 Cb -0.10 0.80 -0.00 0.00 -1.52 0.00 0.00 31.29 30.47 1eol h VAL 167 CO -0.09 0.39 0.02 0.00 0.02 0.00 0.00 177.57 177.90 1eol h LYS 169 N -0.08 0.37 0.00 0.00 1.57 -0.89 -2.74 116.57 114.79 1eol h LYS 169 Ca 0.02 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1eol h LYS 169 Cb 0.17 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.40 1eol h LYS 169 CO -0.00 0.24 0.00 -0.25 -0.57 0.00 0.00 179.45 178.87 1eol n ASP 170 N -4.90 0.00 -0.53 0.86 8.00 -0.25 -2.69 116.55 117.04 1eol n ASP 170 Ca -0.01 -0.35 0.10 0.00 0.71 0.00 0.00 54.79 55.24 1eol n ASP 170 Cb 0.03 -0.07 0.01 0.00 -0.02 0.00 0.00 41.12 41.07 1eol n ASP 170 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1eol n SER 171 N -1.07 2.08 -3.92 -2.24 3.41 -1.03 -5.00 113.62 105.84 1eol n SER 171 Ca 0.11 -1.54 -0.09 0.00 -0.26 0.00 0.00 58.87 57.08 1eol n SER 171 Cb 0.07 0.41 -0.07 0.00 -0.26 0.00 0.00 64.21 64.36 1eol n SER 171 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1eol s THR 172 N -2.29 0.09 -0.75 6.66 -1.32 -1.10 -4.87 115.64 112.07 1eol s THR 172 Ca 0.19 -1.32 0.23 0.00 -1.21 0.00 0.00 61.69 59.58 1eol s THR 172 Cb 0.17 -1.67 -0.09 0.00 -1.51 0.00 0.00 72.50 69.40 1eol s THR 172 CO 0.50 -0.42 1.11 0.54 -2.21 0.00 0.00 174.62 174.14 1eol n ARG 173 N -0.16 0.19 -2.30 7.08 1.74 -1.26 -4.93 116.66 117.03 1eol n ARG 173 Ca -0.10 0.00 -0.41 0.00 -0.77 0.00 0.00 57.85 56.57 1eol n ARG 173 Cb 0.63 -1.57 -0.03 0.00 -1.02 0.00 0.00 32.46 30.47 1eol n ARG 173 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1eol s ILE 174 N -3.13 3.22 -0.35 0.55 -1.09 -1.26 -4.97 121.20 114.17 1eol s ILE 174 Ca 0.06 1.13 -0.29 0.00 -2.23 0.00 0.00 60.65 59.32 1eol s ILE 174 Cb 0.15 -3.72 0.00 0.00 -1.58 0.00 0.00 42.46 37.31 1eol s ILE 174 CO 0.78 0.23 1.41 -0.60 -1.23 0.00 0.00 174.94 175.53 1eol s ARG 175 N -1.01 3.71 0.08 2.79 3.52 -1.26 -5.00 118.95 121.77 1eol s ARG 175 Ca 0.50 1.13 -0.12 0.00 -0.13 0.00 0.00 55.73 57.11 1eol s ARG 175 Cb -0.35 -3.98 -0.06 0.00 -1.56 0.00 0.00 34.95 29.00 1eol s ARG 175 CO 0.43 -1.39 0.44 0.96 -0.81 0.00 0.00 175.30 174.92 1eol s ILE 176 N 5.09 5.02 0.51 4.11 -4.36 -1.26 -4.84 121.20 125.47 1eol s ILE 176 Ca 0.61 0.62 0.04 0.00 -0.26 0.00 0.00 60.65 61.67 1eol s ILE 176 Cb -0.16 -3.68 0.04 0.00 1.25 0.00 0.00 42.46 39.91 1eol s ILE 176 CO 0.29 0.34 0.35 0.35 0.24 0.00 0.00 174.94 176.51 1eol n THR 177 N 1.07 0.00 0.50 8.37 -2.24 -1.26 -5.01 114.28 115.71 1eol n THR 177 Ca -0.09 -2.04 0.12 0.00 -2.27 0.00 0.00 64.05 59.77 1eol n THR 177 Cb 0.52 -0.02 0.46 0.00 -2.10 0.00 0.00 70.33 69.19 1eol n THR 177 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1eol n ASP 178 N -1.80 0.62 -0.77 3.42 8.00 -1.26 -2.77 116.55 121.99 1eol n ASP 178 Ca -0.03 0.62 0.03 0.00 0.71 0.00 0.00 54.79 56.12 1eol n ASP 178 Cb 0.58 -0.76 0.14 0.00 -0.02 0.00 0.00 41.12 41.05 1eol n ASP 178 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1eol n ASN 179 N -2.15 2.12 -4.12 -2.24 3.02 -1.26 -4.86 115.26 105.78 1eol n ASN 179 Ca 0.03 -2.18 -0.08 0.00 -0.03 0.00 0.00 54.58 52.32 1eol n ASN 179 Cb 0.29 -0.38 -0.10 0.00 -0.61 0.00 0.00 39.78 38.97 1eol n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1eol s MET 180 N -1.64 0.70 0.05 3.52 -1.94 -1.11 -0.77 119.30 118.11 1eol s MET 180 Ca 0.19 -1.27 -0.14 0.00 -1.71 0.00 0.00 55.69 52.76 1eol s MET 180 Cb 0.12 0.09 0.02 0.00 2.01 0.00 0.00 34.83 37.08 1eol s MET 180 CO 0.09 -0.10 0.31 -0.59 -0.01 0.00 0.00 175.02 174.73 1eol s PHE 181 N -3.84 -0.11 0.19 -0.03 -0.12 -0.73 -4.81 117.98 108.52 1eol s PHE 181 Ca 0.10 -0.04 0.11 0.00 -0.05 0.00 0.00 56.93 57.05 1eol s PHE 181 Cb 0.07 0.11 -0.04 0.00 -0.63 0.00 0.00 43.02 42.53 1eol s PHE 181 CO -0.07 -0.52 -0.22 0.00 -0.05 0.00 0.00 175.22 174.35 1eol s ALA 183 N -1.69 -0.08 0.00 0.00 0.00 -0.37 -2.11 121.76 117.52 1eol s ALA 183 Ca 0.21 -0.48 0.00 0.00 0.00 0.00 0.00 51.96 51.69 1eol s ALA 183 Cb -0.08 0.20 0.00 0.00 0.00 0.00 0.00 23.12 23.24 1eol s ALA 183 CO 0.11 -0.27 0.00 0.41 0.00 0.00 0.00 175.76 176.01 1eol n GLY 184 N 1.04 2.77 3.84 0.00 0.00 -0.46 -2.39 105.19 110.00 1eol n GLY 184 Ca -0.21 -1.58 -0.34 0.00 0.00 0.00 0.00 46.02 43.89 1eol n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1eol s TYR 184 N -1.95 3.54 0.46 1.61 2.02 -1.26 -4.48 117.35 117.29 1eol s TYR 184 Ca 0.00 1.12 -0.15 0.00 -0.37 0.00 0.00 57.07 57.68 1eol s TYR 184 Cb 0.00 -2.43 -0.08 0.00 -0.40 0.00 0.00 41.96 39.05 1eol s TYR 184 CO 0.00 0.32 0.89 0.15 -1.57 0.00 0.00 175.55 175.35 1eol s LYS 185 N -2.29 3.92 0.41 -0.62 1.02 -1.26 -4.82 119.74 116.10 1eol s LYS 185 Ca 0.43 0.79 0.21 0.00 0.02 0.00 0.00 55.97 57.42 1eol s LYS 185 Cb -0.14 -2.25 1.17 0.00 -0.52 0.00 0.00 37.83 36.10 1eol s LYS 185 CO 0.20 -0.14 1.75 -1.35 -0.92 0.00 0.00 175.35 174.89 1eol h PRO 186 N 1.22 0.32 0.00 -1.68 0.11 -1.96 0.41 132.00 130.42 1eol h PRO 186 Ca -0.47 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1eol h PRO 186 Cb 1.18 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1eol h PRO 186 CO 0.62 0.21 -0.09 0.38 -0.21 0.00 0.00 178.00 178.92 1eol h ASP 186 N 0.33 0.00 0.38 -2.05 2.03 -1.96 -3.32 116.42 111.83 1eol h ASP 186 Ca 0.63 -0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.92 1eol h ASP 186 Cb 1.69 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 40.19 1eol h ASP 186 CO -0.30 0.00 0.00 -0.62 -1.03 0.00 0.00 179.24 177.29 1eol n GLU 186 N -2.95 0.01 0.00 4.15 1.02 0.14 -4.90 120.64 118.11 1eol n GLU 186 Ca 0.04 0.29 0.00 0.00 -0.02 0.00 0.00 57.16 57.47 1eol n GLU 186 Cb 0.52 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.44 1eol n GLU 186 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1eol n GLY 186 N -0.32 1.64 3.73 0.62 0.00 -1.25 -4.96 105.19 104.65 1eol n GLY 186 Ca 0.03 -0.08 -0.33 0.00 0.00 0.00 0.00 46.02 45.63 1eol n GLY 186 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1eol s LYS 186 N 0.00 2.19 0.42 1.61 1.02 -1.26 -5.06 119.74 118.66 1eol s LYS 186 Ca 0.00 1.62 0.04 0.00 0.02 0.00 0.00 55.97 57.64 1eol s LYS 186 Cb 0.00 -1.85 -0.01 0.00 -0.52 0.00 0.00 37.83 35.44 1eol s LYS 186 CO 0.00 -1.76 0.13 0.54 -0.92 0.00 0.00 175.35 173.33 1eol n ARG 187 N -2.84 0.60 0.00 1.68 1.74 -1.26 -4.70 116.66 111.88 1eol n ARG 187 Ca 0.12 -3.47 0.00 0.00 -0.77 0.00 0.00 57.85 53.73 1eol n ARG 187 Cb 0.51 1.77 0.00 0.00 -1.02 0.00 0.00 32.46 33.72 1eol n ARG 187 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1eol n GLY 188 N -0.82 4.77 3.63 -0.13 0.00 -1.26 -4.93 105.19 106.45 1eol n GLY 188 Ca -0.08 -1.09 -0.01 0.00 0.00 0.00 0.00 46.02 44.84 1eol n GLY 188 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1eol s ASP 189 N 0.00 -0.10 0.80 1.61 2.15 -0.97 -4.67 116.67 115.48 1eol s ASP 189 Ca 0.00 -0.13 -0.08 0.00 0.43 0.00 0.00 52.55 52.77 1eol s ASP 189 Cb 0.00 0.21 0.13 0.00 -0.30 0.00 0.00 42.92 42.96 1eol s ASP 189 CO 0.00 -0.37 1.11 0.00 -0.17 0.00 0.00 175.17 175.74 1eol s ALA 190 N -2.56 3.06 0.24 3.66 0.00 -1.26 -0.44 121.76 124.45 1eol s ALA 190 Ca 0.12 -1.33 -0.08 0.00 0.00 0.00 0.00 51.96 50.68 1eol s ALA 190 Cb 0.03 -2.43 0.03 0.00 0.00 0.00 0.00 23.12 20.75 1eol s ALA 190 CO -0.03 -1.74 0.46 0.00 0.00 0.00 0.00 175.76 174.44 1eol n GLU 192 N -0.33 1.79 0.00 0.00 4.71 -1.26 -1.15 120.64 124.40 1eol n GLU 192 Ca -0.05 0.64 0.00 0.00 -0.01 0.00 0.00 57.16 57.74 1eol n GLU 192 Cb 0.36 -2.22 0.00 0.00 -1.01 0.00 0.00 31.44 28.57 1eol n GLU 192 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1eol n GLY 193 N 1.86 3.28 0.09 0.62 0.00 -1.26 -0.66 105.19 109.11 1eol n GLY 193 Ca 0.11 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.08 1eol n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1eol h ASP 194 N 0.00 0.00 -2.97 1.61 3.32 -1.46 -3.30 116.42 113.62 1eol h ASP 194 Ca 0.00 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 56.47 1eol h ASP 194 Cb 0.00 0.00 0.16 0.00 0.22 0.00 0.00 39.33 39.71 1eol h ASP 194 CO 0.00 0.82 -0.27 -1.54 -1.72 0.00 0.00 179.24 176.53 1eol n SER 195 N -3.03 -0.56 0.00 6.45 3.41 -1.25 -1.69 113.62 116.94 1eol n SER 195 Ca -0.11 0.80 0.00 0.00 -0.26 0.00 0.00 58.87 59.29 1eol n SER 195 Cb 0.95 -1.21 0.00 0.00 -0.26 0.00 0.00 64.21 63.69 1eol n SER 195 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1eol n GLY 196 N 1.66 2.80 3.72 5.00 0.00 -0.26 -0.65 105.19 117.47 1eol n GLY 196 Ca 0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 1eol n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1eol s GLY 197 N -1.95 1.59 0.17 -0.02 0.00 -0.68 -3.48 107.32 102.94 1eol s GLY 197 Ca 0.00 -0.30 -0.16 0.00 0.00 0.00 0.00 44.72 44.25 1eol s GLY 197 CO 0.00 0.25 0.61 2.56 0.00 0.00 0.00 173.10 176.52 1eol s PRO 198 N -5.04 4.09 -0.27 2.90 0.04 -1.26 -0.29 135.00 135.16 1eol s PRO 198 Ca 0.64 0.64 -0.02 0.00 0.04 0.00 0.00 61.00 62.30 1eol s PRO 198 Cb -0.17 -2.93 0.03 0.00 0.04 0.00 0.00 34.50 31.47 1eol s PRO 198 CO 0.56 0.46 -0.02 0.12 0.04 0.00 0.00 177.00 178.15 1eol s PHE 199 N -1.46 3.14 0.28 0.56 2.19 -0.32 -3.90 117.98 118.47 1eol s PHE 199 Ca 0.39 -1.59 0.12 0.00 0.33 0.00 0.00 56.93 56.18 1eol s PHE 199 Cb -0.16 -2.10 -0.05 0.00 -1.31 0.00 0.00 43.02 39.40 1eol s PHE 199 CO 0.20 -0.74 -0.19 0.14 1.83 0.00 0.00 175.22 176.46 1eol s VAL 200 N 1.32 2.52 0.02 3.12 -7.23 -0.34 -1.01 120.40 118.81 1eol s VAL 200 Ca -0.01 -2.38 0.01 0.00 -1.81 0.00 0.00 61.98 57.78 1eol s VAL 200 Cb -0.18 -2.33 -0.02 0.00 0.56 0.00 0.00 36.38 34.42 1eol s VAL 200 CO -0.03 -0.39 -0.05 -0.04 -0.31 0.00 0.00 175.10 174.28 1eol s MET 201 N -3.52 0.36 -0.26 4.82 -1.94 -0.16 -0.78 119.30 117.83 1eol s MET 201 Ca 0.30 -0.55 -0.12 0.00 -1.71 0.00 0.00 55.69 53.61 1eol s MET 201 Cb -0.05 -0.11 -0.05 0.00 2.01 0.00 0.00 34.83 36.64 1eol s MET 201 CO 0.15 0.01 0.24 0.21 -0.01 0.00 0.00 175.02 175.62 1eol s LYS 202 N -1.19 4.02 0.07 2.03 2.20 -1.26 -0.52 119.74 125.09 1eol s LYS 202 Ca -0.10 -0.18 -0.31 0.00 -0.36 0.00 0.00 55.97 55.02 1eol s LYS 202 Cb -0.08 -3.62 -0.07 0.00 -1.51 0.00 0.00 37.83 32.56 1eol s LYS 202 CO -0.00 -0.12 1.34 0.45 -0.36 0.00 0.00 175.35 176.65 1eol s SER 203 N 1.48 6.90 0.00 1.43 0.15 -0.17 -4.90 113.70 118.59 1eol s SER 203 Ca 0.10 2.18 0.28 0.00 0.70 0.00 0.00 55.95 59.20 1eol s SER 203 Cb -0.15 -2.58 1.38 0.00 -1.71 0.00 0.00 66.02 62.96 1eol s SER 203 CO 0.09 -0.62 1.95 -0.81 1.20 0.00 0.00 173.24 175.04 1eol n PRO 204 N 4.37 0.36 -0.02 5.44 -0.04 -1.26 -1.27 135.00 142.58 1eol n PRO 204 Ca 0.11 0.02 -0.22 0.00 -0.04 0.00 0.00 63.50 63.38 1eol n PRO 204 Cb 0.44 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.26 1eol n PRO 204 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 1eol h PHE 204 N 0.00 0.37 0.00 0.54 0.04 -1.97 -3.42 116.94 112.51 1eol h PHE 204 Ca 0.00 -0.27 0.00 0.00 2.80 0.00 0.00 57.97 60.50 1eol h PHE 204 Cb 0.28 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.41 1eol h PHE 204 CO 0.00 1.69 0.00 0.27 -0.60 0.00 0.00 178.31 179.67 1eol n ASN 204 N -3.76 1.12 -1.38 2.17 0.23 -1.25 -5.03 115.26 107.37 1eol n ASN 204 Ca -0.31 -1.36 -0.18 0.00 -0.53 0.00 0.00 54.58 52.20 1eol n ASN 204 Cb 0.95 0.00 -0.08 0.00 -2.08 0.00 0.00 39.78 38.57 1eol n ASN 204 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1eol n ASN 205 N -0.18 -5.20 -4.94 0.53 4.13 -0.40 -5.00 115.26 104.20 1eol n ASN 205 Ca 0.00 0.44 -0.26 0.00 1.68 0.00 0.00 54.58 56.44 1eol n ASN 205 Cb 0.18 -4.28 -0.03 0.00 -1.54 0.00 0.00 39.78 34.11 1eol n ASN 205 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 1eol s ARG 206 N -3.52 3.45 -0.05 3.52 0.52 -1.26 -4.81 118.95 116.81 1eol s ARG 206 Ca 0.00 -0.55 -0.18 0.00 -0.52 0.00 0.00 55.73 54.49 1eol s ARG 206 Cb 0.00 -2.95 -0.05 0.00 0.52 0.00 0.00 34.95 32.47 1eol s ARG 206 CO 0.00 0.50 0.48 -1.58 0.02 0.00 0.00 175.30 174.73 1eol s TRP 207 N -1.75 3.63 -0.02 -0.53 0.52 -0.78 -1.00 118.94 119.00 1eol s TRP 207 Ca 0.35 1.00 0.07 0.00 0.02 0.00 0.00 56.10 57.54 1eol s TRP 207 Cb -0.11 -2.48 -0.02 0.00 -1.15 0.00 0.00 33.47 29.71 1eol s TRP 207 CO 0.29 0.37 -0.23 0.71 0.02 0.00 0.00 176.95 178.10 1eol s TYR 208 N -0.13 2.09 -0.46 -1.98 1.51 0.33 -2.38 117.35 116.33 1eol s TYR 208 Ca 0.26 -0.41 -0.22 0.00 -1.01 0.00 0.00 57.07 55.69 1eol s TYR 208 Cb -0.16 -1.35 0.03 0.00 -0.11 0.00 0.00 41.96 40.37 1eol s TYR 208 CO 0.13 -0.05 0.74 -1.14 -1.11 0.00 0.00 175.55 174.12 1eol s GLN 209 N -0.51 3.33 -0.02 -0.62 0.74 -0.07 -0.99 119.66 121.52 1eol s GLN 209 Ca 0.08 -0.26 0.13 0.00 0.05 0.00 0.00 55.36 55.36 1eol s GLN 209 Cb -0.09 -3.96 -0.21 0.00 1.10 0.00 0.00 33.01 29.84 1eol s GLN 209 CO -0.01 -1.12 0.71 0.52 -0.55 0.00 0.00 175.29 174.85 1eol h MET 210 N 8.97 0.00 -4.34 1.67 2.86 -1.40 -3.38 114.93 119.31 1eol h MET 210 Ca -0.25 0.00 -0.21 0.00 -2.06 0.00 0.00 59.70 57.18 1eol h MET 210 Cb 1.09 0.00 -0.13 0.00 0.06 0.00 0.00 31.60 32.62 1eol h MET 210 CO 0.95 0.47 -0.46 0.20 1.06 0.00 0.00 176.91 179.13 1eol s GLY 211 N -5.04 1.26 -0.08 8.32 0.00 -0.91 -2.09 107.32 108.77 1eol s GLY 211 Ca -0.04 -1.50 0.02 0.00 0.00 0.00 0.00 44.72 43.20 1eol s GLY 211 CO 0.82 -1.18 -0.16 -0.42 0.00 0.00 0.00 173.10 172.16 1eol s ILE 212 N -4.02 1.43 -0.18 0.90 1.01 -1.10 -1.17 121.20 118.06 1eol s ILE 212 Ca 0.34 -0.64 -0.32 0.00 0.00 0.00 0.00 60.65 60.04 1eol s ILE 212 Cb 0.04 -1.29 -0.09 0.00 0.01 0.00 0.00 42.46 41.14 1eol s ILE 212 CO 0.13 0.42 2.09 0.52 0.00 0.00 0.00 174.94 178.10 1eol n VAL 213 N 3.86 0.43 0.00 2.92 0.31 0.60 -1.43 118.33 125.01 1eol n VAL 213 Ca -0.21 -0.28 0.00 0.00 -0.01 0.00 0.00 64.34 63.84 1eol n VAL 213 Cb 0.52 -2.13 0.00 0.00 -0.91 0.00 0.00 33.84 31.31 1eol n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1eol n SER 214 N 9.38 0.00 -4.34 4.52 2.88 -0.53 -1.10 113.62 124.43 1eol n SER 214 Ca 0.29 0.00 -0.19 0.00 -1.33 0.00 0.00 58.87 57.65 1eol n SER 214 Cb 0.35 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.71 1eol n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1eol s TRP 215 N 0.01 1.69 -0.02 0.66 1.48 -1.08 -4.82 118.94 116.86 1eol s TRP 215 Ca 0.00 -1.12 -0.29 0.00 -1.06 0.00 0.00 56.10 53.62 1eol s TRP 215 Cb 0.00 -1.03 0.11 0.00 -1.16 0.00 0.00 33.47 31.38 1eol s TRP 215 CO 0.00 -0.23 0.92 0.20 -4.06 0.00 0.00 176.95 173.77 1eol s GLY 216 N -3.38 -0.45 -0.73 3.67 0.00 -1.26 -0.13 107.32 105.04 1eol s GLY 216 Ca 0.37 1.09 -0.14 0.00 0.00 0.00 0.00 44.72 46.03 1eol s GLY 216 CO 0.14 0.37 0.67 -0.54 0.00 0.00 0.00 173.10 173.75 1eol s GLU 217 N -3.01 3.38 1.51 2.90 2.02 -1.26 -4.93 118.70 119.30 1eol s GLU 217 Ca 0.05 -2.22 0.00 0.00 0.02 0.00 0.00 54.97 52.82 1eol s GLU 217 Cb -0.01 -4.37 0.00 0.00 0.10 0.00 0.00 34.13 29.85 1eol s GLU 217 CO -0.08 -1.30 0.00 0.41 0.02 0.00 0.00 175.26 174.31 1eol n GLY 219 N 4.38 -1.71 2.88 -1.39 0.00 -1.26 -4.70 105.19 103.39 1eol n GLY 219 Ca 0.05 -1.42 -0.21 0.00 0.00 0.00 0.00 46.02 44.44 1eol n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1eol n ASP 221 N 4.21 -5.11 -4.75 0.00 2.03 -1.26 -4.61 116.55 107.05 1eol n ASP 221 Ca -0.22 0.14 -0.40 0.00 0.52 0.00 0.00 54.79 54.82 1eol n ASP 221 Cb 0.51 -4.34 -0.05 0.00 -0.72 0.00 0.00 41.12 36.52 1eol n ASP 221 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1eol s ARG 221 N -4.72 4.71 0.30 -0.67 0.52 -1.26 -4.92 118.95 112.90 1eol s ARG 221 Ca 0.00 1.65 -0.30 0.00 -0.52 0.00 0.00 55.73 56.57 1eol s ARG 221 Cb 0.00 -3.25 -0.11 0.00 0.52 0.00 0.00 34.95 32.11 1eol s ARG 221 CO 0.00 0.29 1.55 -0.51 0.02 0.00 0.00 175.30 176.65 1eol s ASP 222 N -0.76 6.42 0.00 0.23 1.01 -1.26 -1.86 116.67 120.45 1eol s ASP 222 Ca 0.44 2.92 0.00 0.00 0.71 0.00 0.00 52.55 56.62 1eol s ASP 222 Cb -0.29 -2.64 0.00 0.00 1.01 0.00 0.00 42.92 41.00 1eol s ASP 222 CO 0.36 -0.87 0.00 0.61 0.21 0.00 0.00 175.17 175.48 1eol n GLY 223 N 1.87 1.94 3.76 0.21 0.00 -1.26 -5.01 105.19 106.70 1eol n GLY 223 Ca 0.07 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.85 1eol n GLY 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1eol s LYS 224 N -0.01 2.71 0.05 1.61 -0.14 -0.78 -4.80 119.74 118.38 1eol s LYS 224 Ca 0.00 -1.13 0.02 0.00 -1.36 0.00 0.00 55.97 53.50 1eol s LYS 224 Cb 0.00 -2.45 -0.03 0.00 -1.68 0.00 0.00 37.83 33.67 1eol s LYS 224 CO 0.00 0.41 -0.07 0.71 -0.76 0.00 0.00 175.35 175.64 1eol s TYR 225 N -2.10 0.69 0.25 3.18 2.02 -1.26 -4.76 117.35 115.38 1eol s TYR 225 Ca 0.32 -0.61 -0.27 0.00 -0.37 0.00 0.00 57.07 56.13 1eol s TYR 225 Cb -0.08 -0.42 -0.09 0.00 -0.40 0.00 0.00 41.96 40.97 1eol s TYR 225 CO 0.23 -0.11 0.90 0.20 -1.57 0.00 0.00 175.55 175.19 1eol s GLY 226 N -1.95 2.95 -0.03 0.71 0.00 -1.00 -4.51 107.32 103.48 1eol s GLY 226 Ca -0.05 0.52 -0.00 0.00 0.00 0.00 0.00 44.72 45.19 1eol s GLY 226 CO -0.01 1.02 0.02 -1.36 0.00 0.00 0.00 173.10 172.77 1eol s PHE 227 N -1.34 3.15 0.04 1.90 0.40 0.81 -1.24 117.98 121.70 1eol s PHE 227 Ca 0.43 0.15 0.05 0.00 -0.60 0.00 0.00 56.93 56.96 1eol s PHE 227 Cb -0.22 -1.73 -0.02 0.00 0.51 0.00 0.00 43.02 41.56 1eol s PHE 227 CO 0.28 0.48 -0.14 0.71 0.70 0.00 0.00 175.22 177.26 1eol s TYR 228 N -1.03 1.18 0.12 0.36 1.51 0.65 -1.45 117.35 118.68 1eol s TYR 228 Ca 0.18 -0.36 -0.31 0.00 -1.01 0.00 0.00 57.07 55.58 1eol s TYR 228 Cb -0.12 -0.70 -0.07 0.00 -0.11 0.00 0.00 41.96 40.96 1eol s TYR 228 CO 0.08 0.03 1.30 0.99 -1.11 0.00 0.00 175.55 176.84 1eol s THR 229 N -0.87 3.53 -0.92 -0.71 2.01 -0.52 -1.78 115.64 116.39 1eol s THR 229 Ca 0.01 1.14 -0.24 0.00 0.31 0.00 0.00 61.69 62.91 1eol s THR 229 Cb -0.08 -3.73 0.03 0.00 0.01 0.00 0.00 72.50 68.73 1eol s THR 229 CO 0.01 0.11 1.47 -2.28 -0.69 0.00 0.00 174.62 173.24 1eol s HIS 230 N 0.81 2.36 0.20 4.92 2.46 0.05 -2.72 115.29 123.37 1eol s HIS 230 Ca 0.60 -0.43 -0.11 0.00 0.47 0.00 0.00 55.06 55.60 1eol s HIS 230 Cb -0.34 -4.60 0.25 0.00 -0.13 0.00 0.00 32.58 27.77 1eol s HIS 230 CO 0.32 -1.97 1.71 0.28 -2.47 0.00 0.00 174.74 172.61 1eol h VAL 231 N 6.65 0.68 -0.73 0.89 2.07 -1.74 -2.70 116.25 121.36 1eol h VAL 231 Ca 0.05 -0.09 0.02 0.00 0.82 0.00 0.00 66.70 67.49 1eol h VAL 231 Cb 1.03 0.39 -0.04 0.00 -1.52 0.00 0.00 31.29 31.15 1eol h VAL 231 CO 1.36 0.05 0.48 0.15 0.02 0.00 0.00 177.57 179.63 1eol h PHE 232 N 0.27 0.90 0.00 1.57 3.57 -1.87 -1.90 116.94 119.47 1eol h PHE 232 Ca 0.29 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.81 1eol h PHE 232 Cb 0.41 -0.30 -0.00 0.00 2.79 0.00 0.00 35.95 38.85 1eol h PHE 232 CO -0.23 0.54 -0.00 0.00 -2.23 0.00 0.00 178.31 176.39 1eol h ARG 233 N 0.96 0.00 -0.35 1.11 3.08 -1.86 -1.21 114.38 116.10 1eol h ARG 233 Ca 0.28 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.33 1eol h ARG 233 Cb -0.06 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.99 1eol h ARG 233 CO -0.08 0.00 0.00 1.28 -1.07 0.00 0.00 179.97 180.10 1eol n LEU 234 N -3.12 2.94 -0.23 3.04 4.77 -0.78 -4.67 117.00 118.96 1eol n LEU 234 Ca -0.02 -1.81 0.05 0.00 -0.03 0.00 0.00 56.01 54.19 1eol n LEU 234 Cb 0.11 -0.23 0.30 0.00 -2.33 0.00 0.00 43.42 41.27 1eol n LEU 234 CO 0.22 0.71 1.23 0.50 -1.33 0.00 0.00 177.39 178.72 1eol h LYS 235 N 2.52 0.86 -0.49 3.23 3.64 -0.51 -1.55 116.57 124.26 1eol h LYS 235 Ca 0.00 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.31 1eol h LYS 235 Cb 0.74 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 32.34 1eol h LYS 235 CO 0.00 0.57 0.22 0.87 -2.27 0.00 0.00 179.45 178.83 1eol h LYS 236 N 0.89 0.70 -0.45 1.90 6.56 -1.83 -0.19 116.57 124.15 1eol h LYS 236 Ca 0.33 -0.09 -0.09 0.00 -1.06 0.00 0.00 60.65 59.74 1eol h LYS 236 Cb 0.18 -0.13 -0.02 0.00 -0.57 0.00 0.00 32.23 31.69 1eol h LYS 236 CO -0.11 0.56 -0.06 2.35 -2.06 0.00 0.00 179.45 180.14 1eol h TRP 237 N 0.70 0.93 0.60 -1.35 7.01 -1.64 -1.13 115.95 121.06 1eol h TRP 237 Ca 0.17 -0.18 -0.02 0.00 2.11 0.00 0.00 58.89 60.97 1eol h TRP 237 Cb 0.11 -0.23 -0.01 0.00 -2.10 0.00 0.00 29.16 26.93 1eol h TRP 237 CO 0.01 0.91 -0.39 0.82 -2.79 0.00 0.00 178.44 177.00 1eol h ILE 238 N 0.68 0.21 -0.76 2.65 2.04 -0.93 -1.62 117.51 119.78 1eol h ILE 238 Ca 0.12 0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.09 1eol h ILE 238 Cb 0.58 0.21 -0.08 0.00 -0.74 0.00 0.00 36.82 36.79 1eol h ILE 238 CO 0.03 0.00 0.39 1.56 0.00 0.00 0.00 178.15 180.13 1eol h GLN 239 N -0.94 0.61 -0.50 2.37 4.20 -1.03 -1.62 115.11 118.20 1eol h GLN 239 Ca -0.07 -0.04 0.02 0.00 0.06 0.00 0.00 58.65 58.63 1eol h GLN 239 Cb 0.77 -0.14 -0.03 0.00 0.30 0.00 0.00 27.48 28.38 1eol h GLN 239 CO 0.06 0.40 0.29 -0.22 -0.67 0.00 0.00 178.83 178.69 1eol h LYS 240 N 0.63 0.57 -0.28 1.46 3.64 -1.00 0.18 116.57 121.77 1eol h LYS 240 Ca 0.38 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.70 1eol h LYS 240 Cb 0.44 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.12 1eol h LYS 240 CO -0.29 0.37 0.07 0.28 -2.27 0.00 0.00 179.45 177.62 1eol h VAL 241 N 0.58 1.21 0.00 2.00 2.07 -0.43 -2.50 116.25 119.18 1eol h VAL 241 Ca 0.20 -0.69 -0.08 0.00 0.82 0.00 0.00 66.70 66.96 1eol h VAL 241 Cb 0.03 1.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 1eol h VAL 241 CO -0.10 0.23 -0.36 0.40 0.02 0.00 0.00 177.57 177.76 1eol h ILE 242 N 0.28 0.92 -0.00 4.57 2.04 -1.10 -0.94 117.51 123.28 1eol h ILE 242 Ca 0.09 -1.41 0.00 0.00 1.00 0.00 0.00 64.86 64.54 1eol h ILE 242 Cb 0.27 1.84 0.00 0.00 -0.74 0.00 0.00 36.82 38.19 1eol h ILE 242 CO -0.00 0.35 -0.11 0.47 0.00 0.00 0.00 178.15 178.86 1eol n ASP 243 N -3.63 0.54 0.00 1.72 9.92 0.61 -4.11 116.55 121.60 1eol n ASP 243 Ca -0.01 -0.64 0.00 0.00 -0.53 0.00 0.00 54.79 53.61 1eol n ASP 243 Cb 0.47 -0.05 0.00 0.00 -0.64 0.00 0.00 41.12 40.90 1eol n ASP 243 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1eol n GLN 244 N -0.89 3.90 0.00 -1.24 6.02 -0.96 -5.05 117.38 119.16 1eol n GLN 244 Ca 0.15 0.00 0.04 0.00 -0.01 0.00 0.00 57.00 57.18 1eol n GLN 244 Cb 0.28 -0.99 0.04 0.00 1.02 0.00 0.00 30.24 30.59 1eol n GLN 244 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24