#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rsf s SER 20 N 0.00 6.57 0.11 1.61 0.01 -1.23 -5.01 113.70 115.76 1rsf s SER 20 Ca 0.00 1.84 -0.30 0.00 1.31 0.00 0.00 55.95 58.80 1rsf s SER 20 Cb 0.00 -2.55 -0.06 0.00 0.21 0.00 0.00 66.02 63.62 1rsf s SER 20 CO 0.00 -0.62 1.04 -0.44 0.41 0.00 0.00 173.24 173.63 1rsf s SER 21 N -2.05 7.34 -0.00 2.44 0.01 -1.26 -4.78 113.70 115.40 1rsf s SER 21 Ca 0.65 1.90 -0.00 0.00 1.31 0.00 0.00 55.95 59.81 1rsf s SER 21 Cb -0.14 -2.59 -0.00 0.00 0.21 0.00 0.00 66.02 63.50 1rsf s SER 21 CO 0.17 -0.20 0.00 0.27 0.41 0.00 0.00 173.24 173.89 1rsf s ILE 22 N 0.22 0.00 0.23 1.44 -4.36 -1.26 -2.61 121.20 114.86 1rsf s ILE 22 Ca 0.50 -0.00 -0.11 0.00 -0.26 0.00 0.00 60.65 60.78 1rsf s ILE 22 Cb -0.26 -0.01 -0.07 0.00 1.25 0.00 0.00 42.46 43.37 1rsf s ILE 22 CO 0.31 -0.00 0.57 0.42 0.24 0.00 0.00 174.94 176.47 1rsf s THR 23 N -0.00 4.90 -0.34 8.37 -4.23 -1.08 -4.57 115.64 118.69 1rsf s THR 23 Ca -0.00 0.55 -0.21 0.00 -1.18 0.00 0.00 61.69 60.85 1rsf s THR 23 Cb -0.00 -3.63 0.03 0.00 1.34 0.00 0.00 72.50 70.24 1rsf s THR 23 CO -0.00 -0.05 0.44 0.41 -0.54 0.00 0.00 174.62 174.88 1rsf n THR 24 N -0.07 -6.74 0.00 3.99 -1.04 -1.26 -4.36 114.28 104.80 1rsf n THR 24 Ca 0.00 0.63 0.00 0.00 -2.04 0.00 0.00 64.05 62.64 1rsf n THR 24 Cb 0.52 -4.99 0.00 0.00 -1.82 0.00 0.00 70.33 64.05 1rsf n THR 24 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1rsf n PRO 25 N 0.17 0.00 -2.62 -2.82 -0.04 -1.26 -4.71 135.00 123.71 1rsf n PRO 25 Ca -0.00 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.04 1rsf n PRO 25 Cb 0.50 -0.40 -0.03 0.00 -0.04 0.00 0.00 33.50 33.53 1rsf n PRO 25 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1rsf s GLU 26 N -0.06 4.46 0.07 0.54 2.12 -1.26 0.14 118.70 124.71 1rsf s GLU 26 Ca 0.00 1.50 -0.05 0.00 0.36 0.00 0.00 54.97 56.78 1rsf s GLU 26 Cb 0.00 -3.49 -0.02 0.00 0.26 0.00 0.00 34.13 30.88 1rsf s GLU 26 CO 0.00 -0.24 0.09 -2.00 -0.54 0.00 0.00 175.26 172.57 1rsf s GLU 27 N 1.57 0.74 -0.04 4.30 2.12 0.66 -4.87 118.70 123.18 1rsf s GLU 27 Ca 0.52 -1.08 -0.01 0.00 0.36 0.00 0.00 54.97 54.76 1rsf s GLU 27 Cb -0.22 0.28 0.03 0.00 0.26 0.00 0.00 34.13 34.48 1rsf s GLU 27 CO 0.24 -0.20 0.05 -1.64 -0.54 0.00 0.00 175.26 173.17 1rsf s MET 28 N -3.89 -0.03 -0.15 4.30 -1.94 -1.26 -0.44 119.30 115.89 1rsf s MET 28 Ca 0.06 0.31 0.02 0.00 -1.71 0.00 0.00 55.69 54.37 1rsf s MET 28 Cb 0.06 -0.47 0.01 0.00 2.01 0.00 0.00 34.83 36.45 1rsf s MET 28 CO -0.11 -0.28 -0.21 0.42 -0.01 0.00 0.00 175.02 174.83 1rsf s ILE 29 N 1.85 2.06 -0.18 2.53 -1.09 0.36 -4.85 121.20 121.88 1rsf s ILE 29 Ca 0.01 -0.97 -0.02 0.00 -2.23 0.00 0.00 60.65 57.45 1rsf s ILE 29 Cb -0.12 -1.83 -0.01 0.00 -1.58 0.00 0.00 42.46 38.92 1rsf s ILE 29 CO -0.03 0.55 -0.10 -1.61 -1.23 0.00 0.00 174.94 172.52 1rsf s GLU 30 N 0.96 3.33 0.03 2.79 2.02 -1.26 0.13 118.70 126.70 1rsf s GLU 30 Ca -0.03 -0.67 -0.03 0.00 0.02 0.00 0.00 54.97 54.26 1rsf s GLU 30 Cb -0.15 -2.81 -0.02 0.00 0.10 0.00 0.00 34.13 31.25 1rsf s GLU 30 CO -0.05 -0.04 0.02 0.15 0.02 0.00 0.00 175.26 175.36 1rsf s LYS 31 N 1.02 0.50 0.33 1.61 -0.14 0.63 -4.95 119.74 118.74 1rsf s LYS 31 Ca -0.01 -0.83 -0.27 0.00 -1.36 0.00 0.00 55.97 53.51 1rsf s LYS 31 Cb -0.15 0.19 -0.09 0.00 -1.68 0.00 0.00 37.83 36.10 1rsf s LYS 31 CO -0.01 -0.11 1.01 0.00 -0.76 0.00 0.00 175.35 175.48 1rsf s ALA 32 N -2.58 3.23 0.37 5.17 0.00 -1.26 0.63 121.76 127.33 1rsf s ALA 32 Ca -0.05 0.68 -0.25 0.00 0.00 0.00 0.00 51.96 52.34 1rsf s ALA 32 Cb -0.02 -3.25 -0.13 0.00 0.00 0.00 0.00 23.12 19.73 1rsf s ALA 32 CO -0.05 -0.02 0.81 1.63 0.00 0.00 0.00 175.76 178.13 1rsf n LYS 33 N 0.64 0.97 0.00 0.00 5.02 -1.01 -1.54 118.16 122.23 1rsf n LYS 33 Ca 0.02 0.35 0.00 0.00 -2.02 0.00 0.00 58.31 56.65 1rsf n LYS 33 Cb 0.48 -1.72 0.00 0.00 -0.02 0.00 0.00 35.03 33.77 1rsf n LYS 33 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1rsf n GLY 34 N 1.47 2.74 3.87 0.72 0.00 -0.71 -4.68 105.19 108.60 1rsf n GLY 34 Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 1rsf n GLY 34 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1rsf s GLU 35 N 0.00 3.59 -0.06 1.61 0.41 -0.59 -3.20 118.70 120.45 1rsf s GLU 35 Ca 0.00 0.74 -0.24 0.00 -0.41 0.00 0.00 54.97 55.06 1rsf s GLU 35 Cb 0.00 -2.08 -0.04 0.00 -1.78 0.00 0.00 34.13 30.23 1rsf s GLU 35 CO 0.00 -0.58 0.74 0.99 -0.49 0.00 0.00 175.26 175.92 1rsf s THR 36 N -3.18 5.02 -0.29 3.63 2.01 -1.24 -1.66 115.64 119.93 1rsf s THR 36 Ca 0.55 1.53 -0.13 0.00 0.31 0.00 0.00 61.69 63.94 1rsf s THR 36 Cb -0.11 -4.08 -0.04 0.00 0.01 0.00 0.00 72.50 68.29 1rsf s THR 36 CO 0.54 0.24 0.30 0.00 -0.69 0.00 0.00 174.62 175.01 1rsf s ALA 37 N 0.83 3.54 0.00 7.40 0.00 0.63 -4.77 121.76 129.38 1rsf s ALA 37 Ca 0.39 -1.02 -0.30 0.00 0.00 0.00 0.00 51.96 51.03 1rsf s ALA 37 Cb -0.18 -2.65 -0.03 0.00 0.00 0.00 0.00 23.12 20.26 1rsf s ALA 37 CO 0.19 -0.72 1.00 -0.47 0.00 0.00 0.00 175.76 175.76 1rsf s TYR 38 N 1.93 3.64 -0.29 0.00 5.04 -1.26 0.10 117.35 126.51 1rsf s TYR 38 Ca 0.11 1.67 0.02 0.00 -2.44 0.00 0.00 57.07 56.42 1rsf s TYR 38 Cb -0.16 -3.14 0.08 0.00 0.35 0.00 0.00 41.96 39.09 1rsf s TYR 38 CO 0.11 -0.11 0.01 -0.51 -1.34 0.00 0.00 175.55 173.70 1rsf s LEU 39 N 1.02 3.32 -0.01 6.97 1.43 0.11 -4.95 118.68 126.57 1rsf s LEU 39 Ca 0.53 -1.63 -0.30 0.00 -1.03 0.00 0.00 54.13 51.70 1rsf s LEU 39 Cb -0.22 -1.30 -0.03 0.00 0.03 0.00 0.00 46.19 44.68 1rsf s LEU 39 CO 0.28 -0.32 0.99 -2.16 0.23 0.00 0.00 176.35 175.37 1rsf s PRO 40 N 1.25 4.54 -0.05 1.29 0.04 -1.26 -1.15 135.00 139.66 1rsf s PRO 40 Ca 0.03 1.43 -0.02 0.00 0.04 0.00 0.00 61.00 62.48 1rsf s PRO 40 Cb -0.19 -3.46 0.04 0.00 0.04 0.00 0.00 34.50 30.93 1rsf s PRO 40 CO -0.11 -0.08 0.09 0.00 0.04 0.00 0.00 177.00 176.94 1rsf s LYS 42 N 1.64 0.17 0.00 0.00 1.02 -1.26 -0.21 119.74 121.11 1rsf s LYS 42 Ca -0.03 -0.26 -0.00 0.00 0.02 0.00 0.00 55.97 55.70 1rsf s LYS 42 Cb -0.12 0.07 -0.00 0.00 -0.52 0.00 0.00 37.83 37.25 1rsf s LYS 42 CO -0.04 -0.03 -0.00 -0.59 -0.92 0.00 0.00 175.35 173.77 1rsf s PHE 43 N -0.69 0.03 0.08 3.18 -0.12 0.73 -2.62 117.98 118.57 1rsf s PHE 43 Ca -0.08 -0.06 -0.20 0.00 -0.05 0.00 0.00 56.93 56.54 1rsf s PHE 43 Cb -0.05 -0.02 -0.07 0.00 -0.63 0.00 0.00 43.02 42.25 1rsf s PHE 43 CO -0.00 -0.02 0.58 0.95 -0.05 0.00 0.00 175.22 176.68 1rsf s THR 44 N -0.18 4.72 -0.42 -4.49 -4.23 -1.07 -4.45 115.64 105.51 1rsf s THR 44 Ca -0.02 1.25 -0.17 0.00 -1.18 0.00 0.00 61.69 61.57 1rsf s THR 44 Cb -0.01 -3.92 0.02 0.00 1.34 0.00 0.00 72.50 69.93 1rsf s THR 44 CO -0.00 0.55 0.43 -0.22 -0.54 0.00 0.00 174.62 174.84 1rsf s LEU 45 N -1.09 4.88 0.11 4.79 0.20 -1.26 -4.75 118.68 121.56 1rsf s LEU 45 Ca 0.29 -0.69 -0.25 0.00 0.69 0.00 0.00 54.13 54.18 1rsf s LEU 45 Cb -0.20 -2.38 -0.07 0.00 -0.43 0.00 0.00 46.19 43.11 1rsf s LEU 45 CO 0.19 -0.58 0.77 -0.44 -0.29 0.00 0.00 176.35 176.00 1rsf s SER 46 N 1.81 7.31 0.46 3.68 0.01 -1.26 -4.93 113.70 120.78 1rsf s SER 46 Ca 0.12 1.55 0.31 0.00 1.31 0.00 0.00 55.95 59.24 1rsf s SER 46 Cb -0.17 -2.48 1.40 0.00 0.21 0.00 0.00 66.02 64.98 1rsf s SER 46 CO 0.13 0.13 1.69 -0.65 0.41 0.00 0.00 173.24 174.96 1rsf h PRO 47 N 4.89 0.14 0.07 12.44 0.11 -2.00 0.79 132.00 148.43 1rsf h PRO 47 Ca -0.46 -0.01 -0.29 0.00 0.11 0.00 0.00 66.00 65.36 1rsf h PRO 47 Cb 1.21 -0.03 0.03 0.00 0.11 0.00 0.00 31.00 32.31 1rsf h PRO 47 CO 0.68 0.09 -1.17 1.49 -0.21 0.00 0.00 178.00 178.88 1rsf h GLU 48 N 0.14 0.66 -4.82 1.05 4.81 -1.93 -3.37 114.58 111.12 1rsf h GLU 48 Ca 0.72 -0.81 -0.58 0.00 -0.13 0.00 0.00 59.36 58.56 1rsf h GLU 48 Cb 2.37 0.25 -0.00 0.00 0.63 0.00 0.00 28.75 32.00 1rsf h GLU 48 CO -0.26 1.36 2.09 -0.25 -0.73 0.00 0.00 179.01 181.22 1rsf n ASP 49 N -3.82 3.13 -0.87 1.04 8.00 0.27 -4.00 116.55 120.30 1rsf n ASP 49 Ca -0.13 -2.73 0.12 0.00 0.71 0.00 0.00 54.79 52.76 1rsf n ASP 49 Cb 0.95 -1.43 0.17 0.00 -0.02 0.00 0.00 41.12 40.79 1rsf n ASP 49 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1rsf n GLN 50 N 7.36 2.21 -1.26 -1.24 6.02 0.11 -4.40 117.38 126.19 1rsf n GLN 50 Ca 0.49 -1.76 -0.31 0.00 -0.01 0.00 0.00 57.00 55.42 1rsf n GLN 50 Cb 0.42 -1.46 0.11 0.00 1.02 0.00 0.00 30.24 30.33 1rsf n GLN 50 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1rsf s GLY 51 N -2.00 1.65 0.28 1.08 0.00 0.15 -4.88 107.32 103.60 1rsf s GLY 51 Ca 0.30 0.13 -0.29 0.00 0.00 0.00 0.00 44.72 44.85 1rsf s GLY 51 CO 0.31 0.53 1.22 -1.05 0.00 0.00 0.00 173.10 174.11 1rsf n PRO 52 N -3.64 1.76 -2.51 2.90 -0.02 -1.26 -3.96 135.00 128.27 1rsf n PRO 52 Ca 0.08 0.62 -0.42 0.00 -2.02 0.00 0.00 63.50 61.76 1rsf n PRO 52 Cb 0.54 -2.15 -0.02 0.00 -0.02 0.00 0.00 33.50 31.85 1rsf n PRO 52 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1rsf s LEU 53 N -0.07 3.48 -0.33 2.45 1.43 -1.24 -4.20 118.68 120.20 1rsf s LEU 53 Ca 0.62 0.27 0.03 0.00 -1.03 0.00 0.00 54.13 54.02 1rsf s LEU 53 Cb -0.66 -3.23 0.09 0.00 0.03 0.00 0.00 46.19 42.42 1rsf s LEU 53 CO 0.57 -1.50 0.03 -1.81 0.23 0.00 0.00 176.35 173.86 1rsf s ASP 54 N 3.35 4.74 -0.39 2.29 1.01 0.17 -4.36 116.67 123.48 1rsf s ASP 54 Ca 0.48 -1.96 -0.15 0.00 0.71 0.00 0.00 52.55 51.62 1rsf s ASP 54 Cb -0.09 -1.63 0.01 0.00 1.01 0.00 0.00 42.92 42.22 1rsf s ASP 54 CO 0.27 -0.35 0.33 -0.63 0.21 0.00 0.00 175.17 175.00 1rsf s ILE 55 N 0.97 5.22 -0.24 0.77 1.01 -0.96 0.19 121.20 128.16 1rsf s ILE 55 Ca 0.06 -0.45 -0.06 0.00 0.00 0.00 0.00 60.65 60.19 1rsf s ILE 55 Cb -0.20 -3.91 -0.02 0.00 0.01 0.00 0.00 42.46 38.34 1rsf s ILE 55 CO -0.07 -0.26 0.04 -0.70 0.00 0.00 0.00 174.94 173.95 1rsf s GLU 56 N 1.82 3.61 -0.27 2.79 2.12 0.32 -1.03 118.70 128.05 1rsf s GLU 56 Ca 0.07 -0.51 -0.16 0.00 0.36 0.00 0.00 54.97 54.74 1rsf s GLU 56 Cb -0.18 -3.24 -0.03 0.00 0.26 0.00 0.00 34.13 30.94 1rsf s GLU 56 CO 0.11 -0.16 0.41 -1.58 -0.54 0.00 0.00 175.26 173.50 1rsf s TRP 57 N 1.50 3.25 -0.08 5.30 0.52 0.15 -0.03 118.94 129.55 1rsf s TRP 57 Ca 0.06 0.47 -0.03 0.00 0.02 0.00 0.00 56.10 56.61 1rsf s TRP 57 Cb -0.15 -2.61 -0.04 0.00 -1.15 0.00 0.00 33.47 29.52 1rsf s TRP 57 CO 0.02 -0.24 0.07 -0.51 0.02 0.00 0.00 176.95 176.31 1rsf s LEU 58 N 2.13 3.95 -0.02 2.99 1.43 0.16 -1.75 118.68 127.57 1rsf s LEU 58 Ca 0.17 0.27 0.04 0.00 -1.03 0.00 0.00 54.13 53.57 1rsf s LEU 58 Cb -0.16 -2.01 -0.01 0.00 0.03 0.00 0.00 46.19 44.05 1rsf s LEU 58 CO 0.10 0.37 -0.13 -0.51 0.23 0.00 0.00 176.35 176.41 1rsf s ILE 59 N -1.00 1.02 -0.28 -0.59 2.07 -0.30 0.05 121.20 122.17 1rsf s ILE 59 Ca 0.16 -0.52 -0.01 0.00 -1.41 0.00 0.00 60.65 58.86 1rsf s ILE 59 Cb -0.12 -0.87 0.09 0.00 0.13 0.00 0.00 42.46 41.69 1rsf s ILE 59 CO 0.05 0.30 0.07 -0.55 -1.91 0.00 0.00 174.94 172.90 1rsf s SER 60 N -0.11 3.78 -0.18 4.50 0.15 -0.25 -2.33 113.70 119.26 1rsf s SER 60 Ca 0.01 -1.43 -0.29 0.00 0.70 0.00 0.00 55.95 54.95 1rsf s SER 60 Cb -0.07 -0.83 0.00 0.00 -1.71 0.00 0.00 66.02 63.41 1rsf s SER 60 CO 0.00 -0.38 1.02 -2.84 1.20 0.00 0.00 173.24 172.24 1rsf s PRO 61 N 1.65 4.32 0.39 5.44 0.02 -1.18 -1.21 135.00 144.44 1rsf s PRO 61 Ca 0.06 1.36 0.06 0.00 0.02 0.00 0.00 61.00 62.50 1rsf s PRO 61 Cb -0.17 -3.60 0.80 0.00 0.02 0.00 0.00 34.50 31.54 1rsf s PRO 61 CO -0.20 -0.51 2.04 0.00 -0.33 0.00 0.00 177.00 178.01 1rsf h ALA 62 N 7.32 1.67 -0.20 -1.55 0.00 -1.88 -0.49 119.26 124.13 1rsf h ALA 62 Ca -0.24 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1rsf h ALA 62 Cb 1.09 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1rsf h ALA 62 CO 0.93 0.31 0.00 -0.25 0.00 0.00 0.00 179.25 180.24 1rsf n ASP 63 N -4.46 1.53 -3.90 0.00 8.00 -1.26 -4.88 116.55 111.58 1rsf n ASP 63 Ca 0.04 -2.08 -0.08 0.00 0.71 0.00 0.00 54.79 53.37 1rsf n ASP 63 Cb 0.06 -0.27 -0.08 0.00 -0.02 0.00 0.00 41.12 40.81 1rsf n ASP 63 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 1rsf s ASN 64 N -0.76 0.19 0.54 -2.24 0.01 -0.19 -5.04 114.94 107.45 1rsf s ASN 64 Ca 0.15 -0.72 0.34 0.00 -0.71 0.00 0.00 52.86 51.92 1rsf s ASN 64 Cb 0.09 0.31 1.45 0.00 0.41 0.00 0.00 41.25 43.52 1rsf s ASN 64 CO 0.08 -0.71 2.00 1.56 -1.51 0.00 0.00 177.10 178.53 1rsf h GLN 65 N 2.82 0.00 -6.87 -0.60 1.08 -1.90 -3.42 115.11 106.22 1rsf h GLN 65 Ca -0.34 0.00 -0.52 0.00 -1.45 0.00 0.00 58.65 56.34 1rsf h GLN 65 Cb 1.19 0.00 0.06 0.00 -0.05 0.00 0.00 27.48 28.68 1rsf h GLN 65 CO 0.58 0.00 0.62 0.15 -0.95 0.00 0.00 178.83 179.23 1rsf s LYS 66 N -3.69 4.38 -0.21 1.46 1.02 -1.26 -5.02 119.74 116.42 1rsf s LYS 66 Ca 0.01 2.17 -0.11 0.00 0.02 0.00 0.00 55.97 58.05 1rsf s LYS 66 Cb 0.09 -3.08 0.07 0.00 -0.52 0.00 0.00 37.83 34.39 1rsf s LYS 66 CO 0.51 -0.15 0.51 0.14 -0.92 0.00 0.00 175.35 175.45 1rsf s VAL 67 N -1.14 -0.08 -1.59 3.17 -7.23 -1.26 -3.10 120.40 109.16 1rsf s VAL 67 Ca 0.48 0.06 -0.04 0.00 -1.81 0.00 0.00 61.98 60.68 1rsf s VAL 67 Cb -0.39 -0.76 0.00 0.00 0.56 0.00 0.00 36.38 35.80 1rsf s VAL 67 CO 0.52 0.03 0.56 0.47 -0.31 0.00 0.00 175.10 176.36 1rsf n ASP 68 N 4.39 -6.16 -4.84 4.85 8.00 -1.10 -4.94 116.55 116.74 1rsf n ASP 68 Ca -0.21 -0.26 -0.37 0.00 0.71 0.00 0.00 54.79 54.66 1rsf n ASP 68 Cb 0.56 -4.99 -0.06 0.00 -0.02 0.00 0.00 41.12 36.61 1rsf n ASP 68 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1rsf s GLN 69 N -5.65 3.90 0.18 -1.24 -0.21 -0.98 -4.76 119.66 110.90 1rsf s GLN 69 Ca 0.28 0.38 -0.31 0.00 0.02 0.00 0.00 55.36 55.73 1rsf s GLN 69 Cb -0.12 -3.12 -0.09 0.00 1.00 0.00 0.00 33.01 30.68 1rsf s GLN 69 CO 0.34 0.62 1.47 0.08 -2.12 0.00 0.00 175.29 175.68 1rsf s VAL 70 N -1.23 2.85 0.01 1.09 1.01 -1.26 -1.15 120.40 121.72 1rsf s VAL 70 Ca 0.29 0.64 0.00 0.00 0.00 0.00 0.00 61.98 62.91 1rsf s VAL 70 Cb -0.16 -3.41 0.00 0.00 0.00 0.00 0.00 36.38 32.81 1rsf s VAL 70 CO 0.16 0.07 0.00 0.00 0.00 0.00 0.00 175.10 175.33 1rsf n ILE 71 N 3.43 0.06 -3.73 2.22 0.00 -0.71 -4.50 119.36 116.12 1rsf n ILE 71 Ca 0.11 0.02 -0.17 0.00 0.00 0.00 0.00 62.75 62.71 1rsf n ILE 71 Cb 0.40 -1.29 -0.17 0.00 0.00 0.00 0.00 39.64 38.58 1rsf n ILE 71 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 176.55 176.04 1rsf s ILE 72 N -2.00 -0.08 0.05 9.51 -1.16 -1.20 -4.50 121.20 121.82 1rsf s ILE 72 Ca 0.00 0.31 -0.01 0.00 -0.51 0.00 0.00 60.65 60.44 1rsf s ILE 72 Cb 0.00 -0.11 -0.04 0.00 0.61 0.00 0.00 42.46 42.92 1rsf s ILE 72 CO 0.00 0.13 -0.03 -0.22 -2.81 0.00 0.00 174.94 172.01 1rsf s LEU 73 N 1.54 2.48 -0.20 8.50 0.20 0.03 0.31 118.68 131.55 1rsf s LEU 73 Ca -0.03 -1.00 -0.03 0.00 0.69 0.00 0.00 54.13 53.76 1rsf s LEU 73 Cb -0.13 0.21 0.06 0.00 -0.43 0.00 0.00 46.19 45.90 1rsf s LEU 73 CO -0.03 -0.60 0.06 -0.47 -0.29 0.00 0.00 176.35 175.02 1rsf s TYR 74 N -3.91 0.77 0.07 5.38 5.04 -0.20 0.36 117.35 124.85 1rsf s TYR 74 Ca 0.07 -0.73 -0.04 0.00 -2.44 0.00 0.00 57.07 53.93 1rsf s TYR 74 Cb 0.08 -0.95 -0.02 0.00 0.35 0.00 0.00 41.96 41.42 1rsf s TYR 74 CO -0.10 -0.60 0.06 -1.54 -1.34 0.00 0.00 175.55 172.03 1rsf s SER 75 N 1.94 0.34 -1.52 4.32 1.04 -0.40 -2.27 113.70 117.15 1rsf s SER 75 Ca 0.01 -0.86 -0.13 0.00 0.48 0.00 0.00 55.95 55.44 1rsf s SER 75 Cb -0.17 0.26 0.09 0.00 0.10 0.00 0.00 66.02 66.30 1rsf s SER 75 CO -0.10 -0.65 0.89 0.61 0.98 0.00 0.00 173.24 174.97 1rsf n GLY 76 N 0.04 -0.49 2.40 7.32 0.00 -1.26 0.12 105.19 113.31 1rsf n GLY 76 Ca -0.14 0.17 -0.21 0.00 0.00 0.00 0.00 46.02 45.84 1rsf n GLY 76 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1rsf n ASP 77 N -2.73 -5.96 -3.80 1.61 -0.08 -1.26 -4.96 116.55 99.36 1rsf n ASP 77 Ca 0.03 -0.02 -0.29 0.00 -1.51 0.00 0.00 54.79 53.01 1rsf n ASP 77 Cb 0.53 -4.96 -0.16 0.00 2.34 0.00 0.00 41.12 38.87 1rsf n ASP 77 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 1rsf s LYS 78 N -5.05 0.98 -0.27 -0.67 1.02 0.12 -5.09 119.74 110.78 1rsf s LYS 78 Ca 0.00 -0.68 -0.29 0.00 0.02 0.00 0.00 55.97 55.02 1rsf s LYS 78 Cb -0.00 -2.26 0.01 0.00 -0.52 0.00 0.00 37.83 35.06 1rsf s LYS 78 CO 0.00 -0.66 1.06 0.96 -0.92 0.00 0.00 175.35 175.79 1rsf s ILE 79 N 1.68 4.60 -0.15 2.17 -5.25 -1.26 -1.28 121.20 121.71 1rsf s ILE 79 Ca -0.01 1.90 -0.08 0.00 -0.99 0.00 0.00 60.65 61.47 1rsf s ILE 79 Cb -0.18 -4.35 -0.04 0.00 2.95 0.00 0.00 42.46 40.84 1rsf s ILE 79 CO -0.09 -0.30 0.12 -0.31 -1.79 0.00 0.00 174.94 172.57 1rsf s TYR 80 N 3.40 3.48 0.20 1.37 2.02 1.12 -4.83 117.35 124.11 1rsf s TYR 80 Ca 0.45 0.41 0.00 0.00 -0.37 0.00 0.00 57.07 57.56 1rsf s TYR 80 Cb -0.14 -2.01 0.00 0.00 -0.40 0.00 0.00 41.96 39.41 1rsf s TYR 80 CO 0.10 0.54 0.00 -0.40 -1.57 0.00 0.00 175.55 174.22 1rsf n ASP 81 N 2.59 -1.79 0.19 2.29 5.75 -1.26 -0.79 116.55 123.53 1rsf n ASP 81 Ca -0.18 0.48 0.13 0.00 -0.01 0.00 0.00 54.79 55.20 1rsf n ASP 81 Cb 0.54 1.89 0.26 0.00 -1.03 0.00 0.00 41.12 42.78 1rsf n ASP 81 CO 0.00 0.00 0.00 -0.78 -0.11 0.00 0.00 177.20 176.31 1rsf h ASP 82 N 0.00 0.00 1.09 -1.12 1.82 -1.85 -2.81 116.42 113.55 1rsf h ASP 82 Ca 0.00 0.00 -0.18 0.00 -0.39 0.00 0.00 57.03 56.46 1rsf h ASP 82 Cb 0.00 0.00 -0.03 0.00 0.68 0.00 0.00 39.33 39.98 1rsf h ASP 82 CO 0.00 0.00 -0.93 0.22 -1.61 0.00 0.00 179.24 176.92 1rsf h TYR 83 N 0.00 0.00 -3.51 0.28 3.20 -1.90 -3.41 116.97 111.62 1rsf h TYR 83 Ca 0.00 0.00 -0.60 0.00 3.14 0.00 0.00 58.73 61.27 1rsf h TYR 83 Cb 0.90 0.00 -0.10 0.00 1.54 0.00 0.00 36.73 39.07 1rsf h TYR 83 CO 0.00 0.83 0.49 0.71 -1.64 0.00 0.00 178.16 178.54 1rsf s TYR 84 N -2.79 3.09 0.32 -3.82 2.02 -1.07 -4.93 117.35 110.17 1rsf s TYR 84 Ca 0.01 0.65 0.09 0.00 -0.37 0.00 0.00 57.07 57.45 1rsf s TYR 84 Cb 0.09 -3.53 0.93 0.00 -0.40 0.00 0.00 41.96 39.06 1rsf s TYR 84 CO 0.80 -0.78 1.64 -1.35 -1.57 0.00 0.00 175.55 174.29 1rsf h PRO 85 N 8.49 0.22 -6.05 -1.71 0.11 -1.84 -1.69 132.00 129.53 1rsf h PRO 85 Ca -0.24 -0.01 -0.53 0.00 0.11 0.00 0.00 66.00 65.32 1rsf h PRO 85 Cb 1.09 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.12 1rsf h PRO 85 CO 0.95 0.14 1.37 -0.51 -0.21 0.00 0.00 178.00 179.74 1rsf s ASP 86 N -4.95 5.43 -1.31 -2.05 1.01 -1.26 -2.67 116.67 110.86 1rsf s ASP 86 Ca -0.11 0.96 0.00 0.00 0.71 0.00 0.00 52.55 54.11 1rsf s ASP 86 Cb 0.29 -2.52 0.00 0.00 1.01 0.00 0.00 42.92 41.69 1rsf s ASP 86 CO 0.78 -2.14 0.00 0.18 0.21 0.00 0.00 175.17 174.20 1rsf n LEU 87 N 12.09 -1.17 -4.67 1.23 4.77 -1.25 -4.39 117.00 123.60 1rsf n LEU 87 Ca 0.24 0.22 -0.47 0.00 -0.03 0.00 0.00 56.01 55.97 1rsf n LEU 87 Cb 0.50 -2.01 -0.04 0.00 -2.33 0.00 0.00 43.42 39.53 1rsf n LEU 87 CO 0.70 -0.51 1.22 2.29 -1.33 0.00 0.00 177.39 179.75 1rsf n LYS 88 N -2.50 2.09 -0.21 3.23 2.85 -0.63 -2.13 118.16 120.85 1rsf n LYS 88 Ca -0.14 0.75 0.00 0.00 -1.05 0.00 0.00 58.31 57.87 1rsf n LYS 88 Cb 0.49 -2.53 0.00 0.00 -0.65 0.00 0.00 35.03 32.35 1rsf n LYS 88 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1rsf n GLY 89 N 3.49 0.89 1.29 2.58 0.00 -1.24 -4.83 105.19 107.37 1rsf n GLY 89 Ca 0.18 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1rsf n GLY 89 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1rsf n ARG 90 N -2.21 0.00 -2.58 1.61 1.85 -0.90 -4.61 116.66 109.82 1rsf n ARG 90 Ca 0.00 0.00 -0.43 0.00 -1.00 0.00 0.00 57.85 56.42 1rsf n ARG 90 Cb 0.00 -0.16 -0.00 0.00 -1.05 0.00 0.00 32.46 31.25 1rsf n ARG 90 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 1rsf s VAL 91 N -1.64 4.10 -0.17 8.89 0.11 -1.21 0.30 120.40 130.77 1rsf s VAL 91 Ca 0.00 -1.81 -0.11 0.00 -2.93 0.00 0.00 61.98 57.13 1rsf s VAL 91 Cb 0.00 -5.18 -0.05 0.00 -1.53 0.00 0.00 36.38 29.62 1rsf s VAL 91 CO 0.00 -2.02 0.18 -1.00 -3.33 0.00 0.00 175.10 168.94 1rsf s HIS 92 N 4.33 3.47 -0.11 1.54 3.76 0.37 -4.61 115.29 124.04 1rsf s HIS 92 Ca 0.53 0.46 -0.30 0.00 -0.15 0.00 0.00 55.06 55.60 1rsf s HIS 92 Cb 0.04 -2.17 -0.03 0.00 1.11 0.00 0.00 32.58 31.52 1rsf s HIS 92 CO 0.06 0.36 1.38 -0.06 -0.85 0.00 0.00 174.74 175.64 1rsf s PHE 93 N 0.10 2.64 -0.81 1.40 0.08 -1.25 0.18 117.98 120.32 1rsf s PHE 93 Ca 0.12 0.77 0.17 0.00 0.12 0.00 0.00 56.93 58.12 1rsf s PHE 93 Cb -0.12 -3.63 0.73 0.00 -0.57 0.00 0.00 43.02 39.43 1rsf s PHE 93 CO 0.01 -2.36 1.54 -2.37 -0.10 0.00 0.00 175.22 171.94 1rsf n THR 94 N 5.25 0.97 -3.37 0.64 5.66 0.86 -4.59 114.28 119.71 1rsf n THR 94 Ca 0.14 0.26 -0.39 0.00 -3.05 0.00 0.00 64.05 61.01 1rsf n THR 94 Cb 0.44 -1.09 -0.09 0.00 -1.55 0.00 0.00 70.33 68.05 1rsf n THR 94 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 175.07 171.58 1rsf s SER 95 N -3.45 6.28 0.00 1.09 0.01 -1.23 -4.93 113.70 111.47 1rsf s SER 95 Ca 0.06 0.32 0.20 0.00 1.31 0.00 0.00 55.95 57.84 1rsf s SER 95 Cb 0.09 -2.22 0.68 0.00 0.21 0.00 0.00 66.02 64.78 1rsf s SER 95 CO 0.30 -0.20 1.51 -0.46 0.41 0.00 0.00 173.24 174.80 1rsf n ASN 96 N 5.36 1.85 -3.05 2.44 6.94 -1.26 -4.22 115.26 123.32 1rsf n ASN 96 Ca -0.08 -1.76 -0.18 0.00 -0.02 0.00 0.00 54.58 52.55 1rsf n ASN 96 Cb 0.51 -0.13 -0.02 0.00 -2.36 0.00 0.00 39.78 37.78 1rsf n ASN 96 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 1rsf n ASP 97 N 0.45 -0.60 -0.08 0.53 8.00 -1.26 -4.98 116.55 118.61 1rsf n ASP 97 Ca 0.16 -2.98 0.05 0.00 0.71 0.00 0.00 54.79 52.72 1rsf n ASP 97 Cb 0.35 0.14 0.39 0.00 -0.02 0.00 0.00 41.12 41.98 1rsf n ASP 97 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1rsf h LEU 98 N 3.70 0.56 0.00 0.64 4.07 -1.73 -0.59 115.31 121.96 1rsf h LEU 98 Ca 0.01 -0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1rsf h LEU 98 Cb 0.95 -0.13 0.00 0.00 1.08 0.00 0.00 40.66 42.56 1rsf h LEU 98 CO 0.41 0.39 0.00 0.29 -1.08 0.00 0.00 178.44 178.45 1rsf n LYS 99 N -4.47 0.09 -0.00 1.13 5.02 -1.26 -0.75 118.16 117.92 1rsf n LYS 99 Ca 0.06 0.21 0.14 0.00 -2.02 0.00 0.00 58.31 56.71 1rsf n LYS 99 Cb 0.13 -1.50 0.52 0.00 -0.02 0.00 0.00 35.03 34.16 1rsf n LYS 99 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1rsf n SER 100 N -1.27 1.51 0.00 4.39 7.64 -0.23 -4.92 113.62 120.74 1rsf n SER 100 Ca 0.03 -1.50 0.00 0.00 1.01 0.00 0.00 58.87 58.41 1rsf n SER 100 Cb 0.05 -0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.25 1rsf n SER 100 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1rsf n GLY 101 N 1.18 3.05 3.48 0.23 0.00 0.07 -5.00 105.19 108.19 1rsf n GLY 101 Ca 0.19 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.78 1rsf n GLY 101 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1rsf s ASP 102 N -1.35 6.21 -0.22 1.61 1.01 -1.23 -0.19 116.67 122.51 1rsf s ASP 102 Ca 0.00 -0.69 0.13 0.00 0.71 0.00 0.00 52.55 52.70 1rsf s ASP 102 Cb 0.00 -2.24 0.46 0.00 1.01 0.00 0.00 42.92 42.15 1rsf s ASP 102 CO 0.00 -0.64 1.36 0.00 0.21 0.00 0.00 175.17 176.10 1rsf n ALA 103 N 5.72 3.51 -1.75 5.23 0.00 0.71 -3.72 120.51 130.21 1rsf n ALA 103 Ca -0.07 -2.87 -0.39 0.00 0.00 0.00 0.00 53.44 50.12 1rsf n ALA 103 Cb 0.47 -0.61 0.04 0.00 0.00 0.00 0.00 19.45 19.36 1rsf n ALA 103 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1rsf n SER 104 N -1.03 2.76 -4.03 0.00 2.88 -0.99 -4.63 113.62 108.58 1rsf n SER 104 Ca 0.25 0.98 -0.19 0.00 -1.33 0.00 0.00 58.87 58.58 1rsf n SER 104 Cb 0.87 -1.59 -0.15 0.00 -0.75 0.00 0.00 64.21 62.60 1rsf n SER 104 CO 0.00 0.00 0.00 0.27 -1.23 0.00 0.00 175.04 174.08 1rsf s ILE 105 N -1.28 0.77 0.10 2.46 -5.25 -0.30 -0.10 121.20 117.59 1rsf s ILE 105 Ca 0.71 -0.41 0.10 0.00 -0.99 0.00 0.00 60.65 60.06 1rsf s ILE 105 Cb -0.42 -0.64 -0.04 0.00 2.95 0.00 0.00 42.46 44.32 1rsf s ILE 105 CO 0.49 0.22 -0.23 0.54 -1.79 0.00 0.00 174.94 174.17 1rsf s ASN 106 N -0.22 3.56 -0.26 4.36 4.22 0.48 0.06 114.94 127.14 1rsf s ASN 106 Ca 0.04 -0.62 -0.14 0.00 -2.14 0.00 0.00 52.86 50.00 1rsf s ASN 106 Cb -0.04 -0.40 -0.04 0.00 1.28 0.00 0.00 41.25 42.06 1rsf s ASN 106 CO -0.00 0.20 0.31 -0.69 -2.04 0.00 0.00 177.10 174.88 1rsf s VAL 107 N -1.03 5.23 0.27 3.54 1.01 0.28 0.14 120.40 129.84 1rsf s VAL 107 Ca 0.15 0.46 -0.20 0.00 0.00 0.00 0.00 61.98 62.39 1rsf s VAL 107 Cb -0.10 -3.64 -0.09 0.00 0.00 0.00 0.00 36.38 32.54 1rsf s VAL 107 CO 0.07 0.22 0.79 0.42 0.00 0.00 0.00 175.10 176.59 1rsf s THR 108 N 1.75 4.49 -1.06 3.92 -4.23 0.15 -0.27 115.64 120.39 1rsf s THR 108 Ca 0.13 1.37 -0.15 0.00 -1.18 0.00 0.00 61.69 61.85 1rsf s THR 108 Cb -0.15 -3.84 -0.02 0.00 1.34 0.00 0.00 72.50 69.83 1rsf s THR 108 CO 0.09 0.10 0.79 0.59 -0.54 0.00 0.00 174.62 175.65 1rsf n ASN 109 N 0.43 -5.76 -3.94 3.99 3.02 -1.22 -4.63 115.26 107.15 1rsf n ASN 109 Ca 0.00 -0.87 -0.26 0.00 -0.03 0.00 0.00 54.58 53.42 1rsf n ASN 109 Cb 0.51 -3.71 0.11 0.00 -0.61 0.00 0.00 39.78 36.08 1rsf n ASN 109 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1rsf n LEU 110 N -3.69 -2.19 -3.61 3.41 4.77 -0.67 -4.54 117.00 110.50 1rsf n LEU 110 Ca -0.10 -0.16 -0.01 0.00 -0.03 0.00 0.00 56.01 55.71 1rsf n LEU 110 Cb 0.59 -0.72 -0.01 0.00 -2.33 0.00 0.00 43.42 40.94 1rsf n LEU 110 CO 0.64 -2.85 1.11 0.00 -1.33 0.00 0.00 177.39 174.96 1rsf s GLN 111 N -2.91 0.19 0.30 3.23 -2.07 -1.26 -1.73 119.66 115.40 1rsf s GLN 111 Ca 0.39 -0.09 -0.02 0.00 -1.82 0.00 0.00 55.36 53.82 1rsf s GLN 111 Cb -0.03 0.08 0.43 0.00 -1.09 0.00 0.00 33.01 32.40 1rsf s GLN 111 CO 0.49 -0.09 1.96 -0.07 -1.32 0.00 0.00 175.29 176.27 1rsf h LEU 112 N 2.00 0.96 -0.43 2.60 3.38 -1.95 -1.81 115.31 120.06 1rsf h LEU 112 Ca -0.15 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.79 1rsf h LEU 112 Cb 1.16 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.67 1rsf h LEU 112 CO 0.24 0.70 0.00 -0.24 0.09 0.00 0.00 178.44 179.23 1rsf n SER 113 N -4.41 0.64 0.26 -0.43 2.88 -1.26 -2.40 113.62 108.91 1rsf n SER 113 Ca 0.09 0.62 0.16 0.00 -1.33 0.00 0.00 58.87 58.42 1rsf n SER 113 Cb 0.03 -0.77 0.55 0.00 -0.75 0.00 0.00 64.21 63.26 1rsf n SER 113 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 1rsf h ASP 114 N 0.00 0.00 -2.43 -3.46 3.32 -1.72 -3.46 116.42 108.67 1rsf h ASP 114 Ca 0.00 0.00 -0.60 0.00 0.02 0.00 0.00 57.03 56.45 1rsf h ASP 114 Cb 0.47 0.00 0.15 0.00 0.22 0.00 0.00 39.33 40.17 1rsf h ASP 114 CO 0.00 0.01 -0.44 0.00 -1.72 0.00 0.00 179.24 177.09 1rsf n ILE 115 N -3.10 1.74 0.00 0.35 3.06 -1.01 -4.91 119.36 115.50 1rsf n ILE 115 Ca 0.01 -0.50 0.00 0.00 -2.50 0.00 0.00 62.75 59.76 1rsf n ILE 115 Cb 0.37 -0.54 0.00 0.00 0.54 0.00 0.00 39.64 40.01 1rsf n ILE 115 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 1rsf n GLY 116 N 1.82 4.78 3.76 4.50 0.00 -1.07 -3.83 105.19 115.15 1rsf n GLY 116 Ca 0.11 -1.12 -0.41 0.00 0.00 0.00 0.00 46.02 44.59 1rsf n GLY 116 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1rsf n THR 117 N -1.98 1.66 -5.23 2.61 -1.04 -0.35 -2.56 114.28 107.39 1rsf n THR 117 Ca 0.00 -0.41 -0.32 0.00 -2.04 0.00 0.00 64.05 61.28 1rsf n THR 117 Cb 0.00 -1.93 -0.17 0.00 -1.82 0.00 0.00 70.33 66.41 1rsf n THR 117 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1rsf s TYR 118 N -0.73 2.54 -0.17 -1.42 1.51 0.68 -1.09 117.35 118.67 1rsf s TYR 118 Ca 0.57 -0.98 0.01 0.00 -1.01 0.00 0.00 57.07 55.66 1rsf s TYR 118 Cb -0.49 -1.69 0.02 0.00 -0.11 0.00 0.00 41.96 39.69 1rsf s TYR 118 CO 0.58 -0.38 -0.18 -1.14 -1.11 0.00 0.00 175.55 173.33 1rsf s GLN 119 N 0.24 2.74 -0.40 -0.62 0.74 0.11 0.15 119.66 122.62 1rsf s GLN 119 Ca -0.16 -0.74 -0.15 0.00 0.05 0.00 0.00 55.36 54.36 1rsf s GLN 119 Cb -0.17 -2.41 0.01 0.00 1.10 0.00 0.00 33.01 31.54 1rsf s GLN 119 CO 0.08 -0.22 0.31 0.00 -0.55 0.00 0.00 175.29 174.90 1rsf s LYS 121 N 1.75 2.60 -0.45 0.00 1.02 0.96 -1.68 119.74 123.95 1rsf s LYS 121 Ca 0.06 -1.46 -0.22 0.00 0.02 0.00 0.00 55.97 54.36 1rsf s LYS 121 Cb -0.18 -3.79 0.02 0.00 -0.52 0.00 0.00 37.83 33.36 1rsf s LYS 121 CO 0.11 -0.96 0.75 0.08 -0.92 0.00 0.00 175.35 174.40 1rsf s VAL 122 N 1.43 4.70 -0.24 3.17 1.01 0.19 0.12 120.40 130.77 1rsf s VAL 122 Ca 0.03 0.36 -0.15 0.00 0.00 0.00 0.00 61.98 62.22 1rsf s VAL 122 Cb -0.23 -4.29 -0.04 0.00 0.00 0.00 0.00 36.38 31.82 1rsf s VAL 122 CO 0.02 -0.68 0.35 -0.75 0.00 0.00 0.00 175.10 174.04 1rsf s LYS 123 N 3.16 4.09 -0.27 2.72 2.20 0.52 -0.66 119.74 131.50 1rsf s LYS 123 Ca 0.28 0.06 -0.03 0.00 -0.36 0.00 0.00 55.97 55.92 1rsf s LYS 123 Cb -0.13 -3.59 0.10 0.00 -1.51 0.00 0.00 37.83 32.71 1rsf s LYS 123 CO 0.22 -0.13 0.16 0.15 -0.36 0.00 0.00 175.35 175.39 1rsf s LYS 124 N 1.61 0.20 0.20 4.03 -0.14 -0.96 0.44 119.74 125.11 1rsf s LYS 124 Ca 0.16 -0.38 -0.33 0.00 -1.36 0.00 0.00 55.97 54.06 1rsf s LYS 124 Cb -0.15 -1.13 -0.14 0.00 -1.68 0.00 0.00 37.83 34.73 1rsf s LYS 124 CO 0.08 -0.97 1.46 0.00 -0.76 0.00 0.00 175.35 175.16 1rsf n ALA 125 N 5.27 1.01 -1.78 5.17 0.00 -1.25 0.23 120.51 129.16 1rsf n ALA 125 Ca -0.05 0.43 -0.39 0.00 0.00 0.00 0.00 53.44 53.43 1rsf n ALA 125 Cb 0.44 -2.28 0.05 0.00 0.00 0.00 0.00 19.45 17.66 1rsf n ALA 125 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1rsf n PRO 126 N 2.58 2.74 -3.45 0.00 -0.04 -1.26 0.29 135.00 135.86 1rsf n PRO 126 Ca 0.14 -3.47 -0.20 0.00 -0.04 0.00 0.00 63.50 59.94 1rsf n PRO 126 Cb 0.29 -2.27 -0.12 0.00 -0.04 0.00 0.00 33.50 31.36 1rsf n PRO 126 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1rsf s GLY 127 N -1.26 0.01 0.26 0.55 0.00 0.64 -5.00 107.32 102.52 1rsf s GLY 127 Ca 0.55 -0.25 -0.09 0.00 0.00 0.00 0.00 44.72 44.92 1rsf s GLY 127 CO -0.32 2.39 0.59 0.14 0.00 0.00 0.00 173.10 175.89 1rsf s VAL 128 N 2.31 4.91 0.02 1.40 1.01 -1.26 -2.27 120.40 126.52 1rsf s VAL 128 Ca 0.09 0.46 -0.03 0.00 0.00 0.00 0.00 61.98 62.50 1rsf s VAL 128 Cb -0.15 -3.64 -0.02 0.00 0.00 0.00 0.00 36.38 32.57 1rsf s VAL 128 CO -0.27 -0.16 0.03 0.00 0.00 0.00 0.00 175.10 174.71 1rsf s ALA 129 N -1.92 0.02 0.01 5.51 0.00 0.17 -3.12 121.76 122.43 1rsf s ALA 129 Ca 0.48 -0.55 -0.10 0.00 0.00 0.00 0.00 51.96 51.79 1rsf s ALA 129 Cb -0.11 0.18 0.01 0.00 0.00 0.00 0.00 23.12 23.19 1rsf s ALA 129 CO 0.23 -0.23 0.20 0.54 0.00 0.00 0.00 175.76 176.50 1rsf s ASN 130 N -1.75 -0.01 0.10 0.00 2.20 -1.26 0.54 114.94 114.76 1rsf s ASN 130 Ca -0.11 -0.21 -0.08 0.00 -0.94 0.00 0.00 52.86 51.52 1rsf s ASN 130 Cb -0.06 0.26 -0.01 0.00 -2.00 0.00 0.00 41.25 39.45 1rsf s ASN 130 CO -0.02 -0.46 0.18 -1.59 -2.94 0.00 0.00 177.10 172.27 1rsf s LYS 131 N -1.85 0.89 -0.11 3.55 0.00 -0.68 -4.95 119.74 116.60 1rsf s LYS 131 Ca -0.11 -1.04 -0.05 0.00 0.00 0.00 0.00 55.97 54.77 1rsf s LYS 131 Cb -0.05 0.33 -0.04 0.00 0.00 0.00 0.00 37.83 38.08 1rsf s LYS 131 CO 0.00 -0.28 0.08 0.15 0.00 0.00 0.00 175.35 175.30 1rsf s LYS 132 N -3.89 3.25 -0.19 1.78 1.02 0.36 -1.68 119.74 120.39 1rsf s LYS 132 Ca 0.08 -0.24 -0.04 0.00 0.02 0.00 0.00 55.97 55.79 1rsf s LYS 132 Cb 0.05 -3.03 0.08 0.00 -0.52 0.00 0.00 37.83 34.41 1rsf s LYS 132 CO -0.08 0.75 0.19 0.42 -0.92 0.00 0.00 175.35 175.70 1rsf s ILE 133 N -0.97 -0.27 -0.28 2.17 1.01 0.39 0.24 121.20 123.50 1rsf s ILE 133 Ca 0.14 -0.10 -0.12 0.00 0.00 0.00 0.00 60.65 60.57 1rsf s ILE 133 Cb -0.12 -0.63 -0.05 0.00 0.01 0.00 0.00 42.46 41.68 1rsf s ILE 133 CO 0.03 -0.20 0.26 -1.00 0.00 0.00 0.00 174.94 174.03 1rsf s HIS 134 N 2.28 3.23 -0.17 3.97 3.76 0.41 0.25 115.29 129.02 1rsf s HIS 134 Ca 0.05 0.22 -0.23 0.00 -0.15 0.00 0.00 55.06 54.96 1rsf s HIS 134 Cb -0.16 -2.45 -0.02 0.00 1.11 0.00 0.00 32.58 31.06 1rsf s HIS 134 CO -0.11 -0.18 0.72 -1.17 -0.85 0.00 0.00 174.74 173.15 1rsf s LEU 135 N 1.87 4.18 -0.13 0.89 1.98 -1.06 0.14 118.68 126.54 1rsf s LEU 135 Ca 0.10 1.02 0.03 0.00 -2.89 0.00 0.00 54.13 52.38 1rsf s LEU 135 Cb -0.16 -3.06 0.00 0.00 0.66 0.00 0.00 46.19 43.64 1rsf s LEU 135 CO 0.11 -0.31 -0.21 -0.69 -1.89 0.00 0.00 176.35 173.35 1rsf s VAL 136 N 1.89 2.18 -0.20 1.68 1.01 0.34 -2.59 120.40 124.71 1rsf s VAL 136 Ca 0.34 -0.95 -0.14 0.00 0.00 0.00 0.00 61.98 61.22 1rsf s VAL 136 Cb -0.16 -1.86 -0.04 0.00 0.00 0.00 0.00 36.38 34.31 1rsf s VAL 136 CO 0.12 0.55 0.31 -0.69 0.00 0.00 0.00 175.10 175.38 1rsf s VAL 137 N 0.64 5.27 0.21 2.92 1.01 -1.26 -0.26 120.40 128.92 1rsf s VAL 137 Ca -0.11 0.53 -0.16 0.00 0.00 0.00 0.00 61.98 62.23 1rsf s VAL 137 Cb -0.16 -3.64 -0.08 0.00 0.00 0.00 0.00 36.38 32.50 1rsf s VAL 137 CO 0.02 0.32 0.65 -0.76 0.00 0.00 0.00 175.10 175.33 1rsf s LEU 138 N 0.98 4.29 0.14 3.92 1.43 0.20 -4.92 118.68 124.73 1rsf s LEU 138 Ca 0.15 1.25 -0.30 0.00 -1.03 0.00 0.00 54.13 54.20 1rsf s LEU 138 Cb -0.14 -3.54 -0.07 0.00 0.03 0.00 0.00 46.19 42.48 1rsf s LEU 138 CO 0.06 0.02 1.05 0.54 0.23 0.00 0.00 176.35 178.24 1rsf s VAL 139 N -1.58 4.17 0.18 -1.59 0.11 -1.26 -2.41 120.40 118.02 1rsf s VAL 139 Ca 0.43 1.81 -0.24 0.00 -2.93 0.00 0.00 61.98 61.04 1rsf s VAL 139 Cb -0.15 -4.15 0.05 0.00 -1.53 0.00 0.00 36.38 30.60 1rsf s VAL 139 CO 0.20 0.28 0.90 -1.59 -3.33 0.00 0.00 175.10 171.56 1rsf s LYS 140 N -0.09 1.34 1.00 1.54 0.00 -1.26 -4.90 119.74 117.37 1rsf s LYS 140 Ca 0.49 -0.74 -0.26 0.00 0.00 0.00 0.00 55.97 55.46 1rsf s LYS 140 Cb -0.27 0.46 -0.18 0.00 0.00 0.00 0.00 37.83 37.84 1rsf s LYS 140 CO 0.32 -0.61 -1.38 -0.35 0.00 0.00 0.00 175.35 173.33 1rsf n PRO 141 N -0.47 -0.03 0.00 1.78 -0.04 -1.26 -4.82 135.00 130.16 1rsf n PRO 141 Ca -0.06 -0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.40 1rsf n PRO 141 Cb 0.60 -1.02 0.00 0.00 -0.04 0.00 0.00 33.50 33.05 1rsf n PRO 141 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1rsf n SER 142 N 3.39 0.00 0.00 3.54 7.64 -1.26 -4.54 113.62 122.39 1rsf n SER 142 Ca -0.02 0.33 0.00 0.00 1.01 0.00 0.00 58.87 60.19 1rsf n SER 142 Cb 0.72 -0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.91 1rsf n SER 142 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1rsf n GLY 143 N -0.83 -0.30 2.72 0.23 0.00 -1.26 -4.71 105.19 101.04 1rsf n GLY 143 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1rsf n GLY 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32