#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 7.53 0.19 1.61 0.01 -1.26 -4.88 113.70 116.90 1rsf s SER 20 Ca 0.00 2.01 -0.20 0.00 1.31 0.00 0.00 55.95 59.07 1rsf s SER 20 Cb 0.00 -2.61 0.04 0.00 0.21 0.00 0.00 66.02 63.66 1rsf s SER 20 CO 0.00 0.07 0.58 -0.44 0.41 0.00 0.00 173.24 173.85 1rsf s SER 21 N -1.15 -0.37 -0.00 2.44 0.01 -1.26 -5.03 113.70 108.33 1rsf s SER 21 Ca 0.43 -0.32 0.00 0.00 1.31 0.00 0.00 55.95 57.37 1rsf s SER 21 Cb -0.27 0.60 0.00 0.00 0.21 0.00 0.00 66.02 66.57 1rsf s SER 21 CO 0.33 -1.06 0.00 -0.51 0.41 0.00 0.00 173.24 172.41 1rsf s ILE 22 N -3.83 -0.00 0.26 1.44 2.07 -1.26 -2.06 121.20 117.82 1rsf s ILE 22 Ca 0.06 0.01 -0.06 0.00 -1.41 0.00 0.00 60.65 59.25 1rsf s ILE 22 Cb -0.02 -0.02 -0.06 0.00 0.13 0.00 0.00 42.46 42.50 1rsf s ILE 22 CO -0.05 0.01 0.54 0.42 -1.91 0.00 0.00 174.94 173.94 1rsf s THR 23 N 0.07 5.01 -0.27 4.00 -4.23 -1.09 -4.62 115.64 114.51 1rsf s THR 23 Ca -0.01 0.17 -0.24 0.00 -1.18 0.00 0.00 61.69 60.43 1rsf s THR 23 Cb -0.01 -3.69 0.04 0.00 1.34 0.00 0.00 72.50 70.18 1rsf s THR 23 CO -0.00 -0.23 0.41 0.41 -0.54 0.00 0.00 174.62 174.67 1rsf n THR 24 N -0.64 -3.05 0.00 3.99 -1.04 -1.26 -4.40 114.28 107.87 1rsf n THR 24 Ca -0.01 0.22 0.00 0.00 -2.04 0.00 0.00 64.05 62.22 1rsf n THR 24 Cb 0.53 -3.21 0.00 0.00 -1.82 0.00 0.00 70.33 65.83 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 0.37 0.00 -2.63 -2.82 -0.04 -1.26 -4.69 135.00 123.93 1rsf n PRO 25 Ca -0.05 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 62.98 1rsf n PRO 25 Cb 0.60 -0.53 -0.03 0.00 -0.04 0.00 0.00 33.50 33.50 1rsf n PRO 25 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 1rsf s GLU 26 N -0.10 4.47 0.07 0.54 -1.05 -1.26 0.20 118.70 121.58 1rsf s GLU 26 Ca 0.00 1.50 -0.06 0.00 -0.15 0.00 0.00 54.97 56.26 1rsf s GLU 26 Cb 0.00 -3.48 -0.02 0.00 -0.44 0.00 0.00 34.13 30.20 1rsf s GLU 26 CO 0.00 -0.21 0.10 -2.00 0.95 0.00 0.00 175.26 174.10 1rsf s GLU 27 N 1.45 0.75 -0.07 -4.83 2.56 0.67 -4.86 118.70 114.37 1rsf s GLU 27 Ca 0.53 -1.07 -0.03 0.00 0.00 0.00 0.00 54.97 54.40 1rsf s GLU 27 Cb -0.22 0.29 0.04 0.00 2.00 0.00 0.00 34.13 36.23 1rsf s GLU 27 CO 0.25 -0.20 0.07 -1.64 -0.56 0.00 0.00 175.26 173.18 1rsf s MET 28 N -3.89 -0.05 -0.11 4.30 -1.94 -1.26 -0.03 119.30 116.33 1rsf s MET 28 Ca 0.06 0.31 0.04 0.00 -1.71 0.00 0.00 55.69 54.39 1rsf s MET 28 Cb 0.06 -0.72 0.00 0.00 2.01 0.00 0.00 34.83 36.19 1rsf s MET 28 CO -0.11 -0.39 -0.23 0.42 -0.01 0.00 0.00 175.02 174.70 1rsf s ILE 29 N 2.17 2.06 -0.14 2.53 -1.09 0.45 -4.83 121.20 122.35 1rsf s ILE 29 Ca 0.04 -1.01 0.03 0.00 -2.23 0.00 0.00 60.65 57.48 1rsf s ILE 29 Cb -0.13 -1.79 0.01 0.00 -1.58 0.00 0.00 42.46 38.97 1rsf s ILE 29 CO -0.04 0.56 -0.22 -1.61 -1.23 0.00 0.00 174.94 172.39 1rsf s GLU 30 N 0.47 3.02 0.06 2.79 2.02 -1.26 0.19 118.70 125.99 1rsf s GLU 30 Ca -0.16 -0.86 -0.03 0.00 0.02 0.00 0.00 54.97 53.95 1rsf s GLU 30 Cb -0.17 -2.42 -0.03 0.00 0.10 0.00 0.00 34.13 31.60 1rsf s GLU 30 CO 0.06 -0.00 0.03 0.15 0.02 0.00 0.00 175.26 175.52 1rsf s LYS 31 N 0.78 0.67 0.13 1.61 -0.14 0.32 -4.95 119.74 118.17 1rsf s LYS 31 Ca -0.08 -1.15 -0.30 0.00 -1.36 0.00 0.00 55.97 53.08 1rsf s LYS 31 Cb -0.16 0.25 -0.07 0.00 -1.68 0.00 0.00 37.83 36.17 1rsf s LYS 31 CO -0.01 -0.15 1.07 0.00 -0.76 0.00 0.00 175.35 175.49 1rsf s ALA 32 N -3.90 3.33 0.16 5.17 0.00 -1.26 0.13 121.76 125.37 1rsf s ALA 32 Ca 0.06 0.74 -0.33 0.00 0.00 0.00 0.00 51.96 52.43 1rsf s ALA 32 Cb 0.07 -3.34 -0.16 0.00 0.00 0.00 0.00 23.12 19.68 1rsf s ALA 32 CO -0.10 -0.19 1.11 1.17 0.00 0.00 0.00 175.76 177.74 1rsf n LYS 33 N 2.78 0.96 0.00 0.00 4.81 0.22 -0.64 118.16 126.28 1rsf n LYS 33 Ca 0.04 0.34 0.00 0.00 -0.87 0.00 0.00 58.31 57.82 1rsf n LYS 33 Cb 0.47 -1.80 0.00 0.00 0.02 0.00 0.00 35.03 33.72 1rsf n LYS 33 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1rsf n GLY 34 N 1.97 3.01 3.87 3.14 0.00 -0.58 -4.51 105.19 112.08 1rsf n GLY 34 Ca 0.16 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.26 3.60 -0.13 1.61 2.02 0.19 -2.68 118.70 123.05 1rsf s GLU 35 Ca 0.00 0.75 -0.22 0.00 0.02 0.00 0.00 54.97 55.52 1rsf s GLU 35 Cb 0.00 -2.08 -0.03 0.00 0.10 0.00 0.00 34.13 32.12 1rsf s GLU 35 CO 0.00 -0.57 0.66 0.99 0.02 0.00 0.00 175.26 176.36 1rsf s THR 36 N -3.18 5.04 -0.32 3.63 2.01 -1.24 -1.91 115.64 119.67 1rsf s THR 36 Ca 0.55 1.31 -0.14 0.00 0.31 0.00 0.00 61.69 63.71 1rsf s THR 36 Cb -0.11 -3.99 -0.02 0.00 0.01 0.00 0.00 72.50 68.39 1rsf s THR 36 CO 0.54 0.19 0.33 0.00 -0.69 0.00 0.00 174.62 174.99 1rsf s ALA 37 N 1.31 3.51 -0.25 7.40 0.00 -0.07 -4.78 121.76 128.87 1rsf s ALA 37 Ca 0.33 -1.15 -0.29 0.00 0.00 0.00 0.00 51.96 50.85 1rsf s ALA 37 Cb -0.17 -2.75 0.01 0.00 0.00 0.00 0.00 23.12 20.22 1rsf s ALA 37 CO 0.14 -0.93 1.10 -0.47 0.00 0.00 0.00 175.76 175.59 1rsf s TYR 38 N 1.97 3.17 -0.41 0.00 5.04 -1.26 0.11 117.35 125.97 1rsf s TYR 38 Ca 0.11 1.28 -0.13 0.00 -2.44 0.00 0.00 57.07 55.90 1rsf s TYR 38 Cb -0.16 -3.48 0.05 0.00 0.35 0.00 0.00 41.96 38.72 1rsf s TYR 38 CO 0.11 -0.81 0.28 -0.51 -1.34 0.00 0.00 175.55 173.28 1rsf s LEU 39 N 3.46 5.10 -0.22 6.97 1.43 0.30 -4.94 118.68 130.78 1rsf s LEU 39 Ca 0.47 -1.15 -0.27 0.00 -1.03 0.00 0.00 54.13 52.14 1rsf s LEU 39 Cb -0.15 -2.08 0.00 0.00 0.03 0.00 0.00 46.19 43.99 1rsf s LEU 39 CO 0.11 -0.49 0.94 -2.16 0.23 0.00 0.00 176.35 174.98 1rsf s PRO 40 N 1.58 4.24 -0.05 1.29 0.04 -1.26 -1.01 135.00 139.83 1rsf s PRO 40 Ca 0.03 1.17 -0.02 0.00 0.04 0.00 0.00 61.00 62.22 1rsf s PRO 40 Cb -0.21 -3.63 0.03 0.00 0.04 0.00 0.00 34.50 30.73 1rsf s PRO 40 CO 0.07 -0.54 0.08 0.00 0.04 0.00 0.00 177.00 176.64 1rsf s LYS 42 N 1.78 0.46 0.01 0.00 1.02 -1.26 0.12 119.74 121.87 1rsf s LYS 42 Ca -0.01 -0.80 0.00 0.00 0.02 0.00 0.00 55.97 55.19 1rsf s LYS 42 Cb -0.12 0.17 -0.01 0.00 -0.52 0.00 0.00 37.83 37.34 1rsf s LYS 42 CO -0.04 -0.09 -0.02 -0.59 -0.92 0.00 0.00 175.35 173.69 1rsf s PHE 43 N -2.38 0.18 0.20 3.18 -0.71 0.17 -2.66 117.98 115.97 1rsf s PHE 43 Ca -0.07 -0.30 -0.28 0.00 -1.04 0.00 0.00 56.93 55.24 1rsf s PHE 43 Cb -0.03 -0.12 -0.09 0.00 -1.21 0.00 0.00 43.02 41.57 1rsf s PHE 43 CO -0.04 -0.10 0.86 0.95 -1.34 0.00 0.00 175.22 175.54 1rsf s THR 44 N -0.83 4.22 0.19 -4.49 -4.23 -0.87 -4.43 115.64 105.19 1rsf s THR 44 Ca -0.09 1.89 -0.12 0.00 -1.18 0.00 0.00 61.69 62.20 1rsf s THR 44 Cb -0.06 -4.23 -0.07 0.00 1.34 0.00 0.00 72.50 69.48 1rsf s THR 44 CO -0.01 0.51 0.55 -0.76 -0.54 0.00 0.00 174.62 174.37 1rsf s LEU 45 N -1.18 4.25 -0.23 4.79 1.43 -1.26 -4.63 118.68 121.85 1rsf s LEU 45 Ca 0.39 1.00 -0.22 0.00 -1.03 0.00 0.00 54.13 54.27 1rsf s LEU 45 Cb -0.24 -3.48 0.06 0.00 0.03 0.00 0.00 46.19 42.56 1rsf s LEU 45 CO 0.29 0.01 0.62 -0.94 0.23 0.00 0.00 176.35 176.57 1rsf s SER 46 N -2.04 -0.65 0.58 2.29 1.04 -1.26 -5.01 113.70 108.66 1rsf s SER 46 Ca 0.43 1.26 0.33 0.00 0.48 0.00 0.00 55.95 58.44 1rsf s SER 46 Cb -0.13 1.27 1.34 0.00 0.10 0.00 0.00 66.02 68.60 1rsf s SER 46 CO 0.20 -0.22 1.62 1.55 0.98 0.00 0.00 173.24 177.37 1rsf h PRO 47 N 5.16 0.00 0.00 4.02 0.13 -2.00 0.72 132.00 140.03 1rsf h PRO 47 Ca -0.28 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.69 1rsf h PRO 47 Cb 1.17 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.27 1rsf h PRO 47 CO 0.11 0.00 -0.74 1.05 -0.23 0.00 0.00 178.00 178.19 1rsf h GLU 48 N 0.00 0.00 -4.33 0.86 4.11 -1.95 -3.38 114.58 109.88 1rsf h GLU 48 Ca 0.49 0.00 -0.53 0.00 0.07 0.00 0.00 59.36 59.39 1rsf h GLU 48 Cb 2.42 0.00 0.06 0.00 0.50 0.00 0.00 28.75 31.73 1rsf h GLU 48 CO -0.01 0.74 2.07 -0.40 0.07 0.00 0.00 179.01 181.48 1rsf n ASP 49 N -3.47 2.48 -0.26 3.06 5.75 0.25 -3.49 116.55 120.87 1rsf n ASP 49 Ca 0.00 -2.52 0.11 0.00 -0.01 0.00 0.00 54.79 52.38 1rsf n ASP 49 Cb 0.77 -0.94 0.07 0.00 -1.03 0.00 0.00 41.12 39.99 1rsf n ASP 49 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1rsf n GLN 50 N 6.47 0.68 -1.67 0.11 6.02 0.76 -4.84 117.38 124.91 1rsf n GLN 50 Ca 0.44 -0.52 -0.32 0.00 -0.01 0.00 0.00 57.00 56.59 1rsf n GLN 50 Cb 0.32 -1.49 0.04 0.00 1.02 0.00 0.00 30.24 30.13 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 -2.68 1.82 0.17 1.08 0.00 0.23 -4.86 107.32 103.08 1rsf s GLY 51 Ca 0.16 0.22 -0.33 0.00 0.00 0.00 0.00 44.72 44.76 1rsf s GLY 51 CO 0.66 0.54 1.58 -1.55 0.00 0.00 0.00 173.10 174.33 1rsf n PRO 52 N -2.83 2.21 -2.55 2.90 -0.04 -1.26 -3.92 135.00 129.51 1rsf n PRO 52 Ca 0.08 0.80 -0.43 0.00 -0.04 0.00 0.00 63.50 63.91 1rsf n PRO 52 Cb 0.53 -2.57 -0.02 0.00 -0.04 0.00 0.00 33.50 31.40 1rsf n PRO 52 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1rsf s LEU 53 N 0.87 4.14 -0.27 1.53 0.20 -1.18 -4.01 118.68 119.96 1rsf s LEU 53 Ca 0.78 1.52 -0.03 0.00 0.69 0.00 0.00 54.13 57.09 1rsf s LEU 53 Cb -0.66 -3.54 0.09 0.00 -0.43 0.00 0.00 46.19 41.65 1rsf s LEU 53 CO 0.38 -0.72 0.10 -1.81 -0.29 0.00 0.00 176.35 174.02 1rsf s ASP 54 N 1.57 3.45 -0.40 3.68 1.11 0.35 -4.25 116.67 122.19 1rsf s ASP 54 Ca 0.49 -1.24 -0.17 0.00 0.18 0.00 0.00 52.55 51.81 1rsf s ASP 54 Cb -0.18 -0.53 0.01 0.00 1.07 0.00 0.00 42.92 43.29 1rsf s ASP 54 CO 0.10 -0.40 0.42 -0.63 1.18 0.00 0.00 175.17 175.84 1rsf s ILE 55 N 1.92 5.10 -0.26 0.77 1.01 -0.97 0.21 121.20 128.98 1rsf s ILE 55 Ca 0.07 -0.24 -0.06 0.00 0.00 0.00 0.00 60.65 60.42 1rsf s ILE 55 Cb -0.17 -3.99 -0.01 0.00 0.01 0.00 0.00 42.46 38.31 1rsf s ILE 55 CO -0.26 -0.34 0.04 -1.61 0.00 0.00 0.00 174.94 172.77 1rsf s GLU 56 N 2.12 3.32 -0.29 2.79 2.02 0.24 -1.00 118.70 127.90 1rsf s GLU 56 Ca 0.12 -0.69 -0.16 0.00 0.02 0.00 0.00 54.97 54.26 1rsf s GLU 56 Cb -0.17 -3.25 -0.03 0.00 0.10 0.00 0.00 34.13 30.78 1rsf s GLU 56 CO 0.13 -0.30 0.40 -1.58 0.02 0.00 0.00 175.26 173.93 1rsf s TRP 57 N 1.52 3.23 -0.07 1.61 0.52 0.48 -0.88 118.94 125.35 1rsf s TRP 57 Ca 0.04 0.32 0.00 0.00 0.02 0.00 0.00 56.10 56.49 1rsf s TRP 57 Cb -0.16 -2.65 -0.03 0.00 -1.15 0.00 0.00 33.47 29.48 1rsf s TRP 57 CO 0.01 -0.31 -0.06 -0.51 0.02 0.00 0.00 176.95 176.10 1rsf s LEU 58 N 2.12 3.23 -0.06 2.99 1.43 0.27 -2.55 118.68 126.11 1rsf s LEU 58 Ca 0.15 0.00 0.02 0.00 -1.03 0.00 0.00 54.13 53.28 1rsf s LEU 58 Cb -0.16 -1.71 0.01 0.00 0.03 0.00 0.00 46.19 44.37 1rsf s LEU 58 CO 0.11 0.36 -0.11 -0.51 0.23 0.00 0.00 176.35 176.44 1rsf s ILE 59 N -0.82 1.00 -0.37 -0.59 2.07 -0.66 0.16 121.20 121.99 1rsf s ILE 59 Ca 0.13 -0.40 -0.01 0.00 -1.41 0.00 0.00 60.65 58.95 1rsf s ILE 59 Cb -0.11 -0.93 0.09 0.00 0.13 0.00 0.00 42.46 41.64 1rsf s ILE 59 CO 0.02 0.33 0.13 -0.44 -1.91 0.00 0.00 174.94 173.06 1rsf s SER 60 N 0.71 5.09 -0.44 4.50 0.01 0.19 -1.19 113.70 122.57 1rsf s SER 60 Ca -0.14 -1.86 -0.29 0.00 1.31 0.00 0.00 55.95 54.97 1rsf s SER 60 Cb -0.15 -1.77 0.02 0.00 0.21 0.00 0.00 66.02 64.33 1rsf s SER 60 CO 0.03 -0.45 1.19 -2.16 0.41 0.00 0.00 173.24 172.26 1rsf s PRO 61 N 1.13 3.75 0.41 12.44 0.04 -1.21 -0.94 135.00 150.63 1rsf s PRO 61 Ca 0.05 0.73 0.07 0.00 0.04 0.00 0.00 61.00 61.89 1rsf s PRO 61 Cb -0.21 -3.91 0.87 0.00 0.04 0.00 0.00 34.50 31.28 1rsf s PRO 61 CO -0.04 -1.35 2.06 0.00 0.04 0.00 0.00 177.00 177.71 1rsf h ALA 62 N 9.37 1.71 -0.24 8.56 0.00 -1.84 -0.75 119.26 136.08 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 1.07 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1rsf h ALA 62 CO 1.11 0.27 0.00 -0.40 0.00 0.00 0.00 179.25 180.22 1rsf n ASP 63 N -4.47 2.46 -3.88 0.00 5.75 -1.26 -4.88 116.55 110.26 1rsf n ASP 63 Ca 0.03 -2.26 -0.09 0.00 -0.01 0.00 0.00 54.79 52.46 1rsf n ASP 63 Cb 0.06 -0.47 -0.07 0.00 -1.03 0.00 0.00 41.12 39.62 1rsf n ASP 63 CO 0.00 0.00 0.00 0.20 -0.11 0.00 0.00 177.20 177.29 1rsf s ASN 64 N -0.49 0.03 0.55 -1.12 0.01 -0.29 -5.03 114.94 108.60 1rsf s ASN 64 Ca 0.20 -0.73 0.34 0.00 -0.71 0.00 0.00 52.86 51.97 1rsf s ASN 64 Cb 0.14 0.41 1.45 0.00 0.41 0.00 0.00 41.25 43.67 1rsf s ASN 64 CO 0.08 -0.84 2.01 1.56 -1.51 0.00 0.00 177.10 178.40 1rsf h GLN 65 N 2.58 0.00 -7.13 -0.60 4.20 -1.90 -3.44 115.11 108.83 1rsf h GLN 65 Ca -0.32 0.00 -0.50 0.00 0.06 0.00 0.00 58.65 57.88 1rsf h GLN 65 Cb 1.22 0.00 0.08 0.00 0.30 0.00 0.00 27.48 29.09 1rsf h GLN 65 CO 0.50 0.00 0.41 0.15 -0.67 0.00 0.00 178.83 179.22 1rsf s LYS 66 N -3.70 3.16 -0.23 1.46 1.02 -1.26 -5.03 119.74 115.15 1rsf s LYS 66 Ca 0.01 1.54 -0.12 0.00 0.02 0.00 0.00 55.97 57.42 1rsf s LYS 66 Cb 0.09 -1.99 0.08 0.00 -0.52 0.00 0.00 37.83 35.50 1rsf s LYS 66 CO 0.53 -0.99 0.55 0.14 -0.92 0.00 0.00 175.35 174.66 1rsf s VAL 67 N -1.96 -0.18 -1.45 3.17 -7.23 -1.26 -3.29 120.40 108.19 1rsf s VAL 67 Ca 0.71 0.05 -0.11 0.00 -1.81 0.00 0.00 61.98 60.82 1rsf s VAL 67 Cb -0.23 -0.82 0.05 0.00 0.56 0.00 0.00 36.38 35.95 1rsf s VAL 67 CO 0.32 0.02 1.02 0.47 -0.31 0.00 0.00 175.10 176.62 1rsf n ASP 68 N 4.53 -4.87 -4.76 4.85 8.00 -0.84 -4.88 116.55 118.58 1rsf n ASP 68 Ca -0.19 -0.71 -0.39 0.00 0.71 0.00 0.00 54.79 54.21 1rsf n ASP 68 Cb 0.56 -4.27 -0.05 0.00 -0.02 0.00 0.00 41.12 37.33 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 -6.44 4.38 0.10 -1.24 -1.52 -0.33 -4.60 119.66 110.00 1rsf s GLN 69 Ca 0.57 0.85 -0.31 0.00 -1.95 0.00 0.00 55.36 54.52 1rsf s GLN 69 Cb -0.27 -3.35 -0.07 0.00 -0.22 0.00 0.00 33.01 29.10 1rsf s GLN 69 CO 0.80 0.34 1.34 0.08 -0.25 0.00 0.00 175.29 177.60 1rsf s VAL 70 N -0.16 3.51 0.00 1.09 1.01 -1.26 -1.66 120.40 122.93 1rsf s VAL 70 Ca 0.34 1.08 0.00 0.00 0.00 0.00 0.00 61.98 63.40 1rsf s VAL 70 Cb -0.19 -3.69 0.00 0.00 0.00 0.00 0.00 36.38 32.50 1rsf s VAL 70 CO 0.19 0.08 0.00 2.30 0.00 0.00 0.00 175.10 177.68 1rsf n ILE 71 N 3.95 0.00 -3.70 2.22 -6.64 -1.06 -4.64 119.36 109.48 1rsf n ILE 71 Ca 0.11 0.00 -0.18 0.00 -1.77 0.00 0.00 62.75 60.90 1rsf n ILE 71 Cb 0.43 -0.43 -0.17 0.00 -1.44 0.00 0.00 39.64 38.03 1rsf n ILE 71 CO 0.00 0.00 0.00 -0.51 -1.77 0.00 0.00 176.55 174.27 1rsf s ILE 72 N -1.64 -0.09 0.04 7.28 -1.16 -1.25 -4.21 121.20 120.16 1rsf s ILE 72 Ca 0.00 0.36 -0.01 0.00 -0.51 0.00 0.00 60.65 60.49 1rsf s ILE 72 Cb 0.00 -0.13 -0.03 0.00 0.61 0.00 0.00 42.46 42.91 1rsf s ILE 72 CO 0.00 0.15 -0.02 -0.22 -2.81 0.00 0.00 174.94 172.04 1rsf s LEU 73 N 1.80 2.33 -0.26 8.50 0.20 0.21 -0.39 118.68 131.07 1rsf s LEU 73 Ca 0.00 -0.76 -0.01 0.00 0.69 0.00 0.00 54.13 54.05 1rsf s LEU 73 Cb -0.12 0.20 0.08 0.00 -0.43 0.00 0.00 46.19 45.92 1rsf s LEU 73 CO -0.03 -0.47 0.06 -0.47 -0.29 0.00 0.00 176.35 175.15 1rsf s TYR 74 N -2.84 1.51 0.05 5.38 5.04 -0.17 0.31 117.35 126.63 1rsf s TYR 74 Ca -0.03 -1.42 -0.04 0.00 -2.44 0.00 0.00 57.07 53.14 1rsf s TYR 74 Cb 0.00 -1.45 -0.02 0.00 0.35 0.00 0.00 41.96 40.84 1rsf s TYR 74 CO -0.06 -0.78 0.05 0.45 -1.34 0.00 0.00 175.55 173.87 1rsf s SER 75 N 1.69 0.29 -1.22 4.32 0.15 -0.87 -2.28 113.70 115.78 1rsf s SER 75 Ca 0.05 -0.72 0.00 0.00 0.70 0.00 0.00 55.95 55.98 1rsf s SER 75 Cb -0.17 0.22 0.00 0.00 -1.71 0.00 0.00 66.02 64.36 1rsf s SER 75 CO -0.18 -0.55 0.00 0.61 1.20 0.00 0.00 173.24 174.31 1rsf n GLY 76 N 0.48 -0.40 3.16 9.45 0.00 -1.26 0.71 105.19 117.34 1rsf n GLY 76 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.85 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 -1.78 -1.02 -4.42 1.61 -0.08 -1.26 -4.95 116.55 104.64 1rsf n ASP 77 Ca -0.17 0.00 -0.44 0.00 -1.51 0.00 0.00 54.79 52.68 1rsf n ASP 77 Cb 0.62 -1.18 -0.09 0.00 2.34 0.00 0.00 41.12 42.81 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 -0.50 2.97 -0.26 -0.67 1.02 0.22 -5.03 119.74 117.49 1rsf s LYS 78 Ca 0.00 -1.20 -0.27 0.00 0.02 0.00 0.00 55.97 54.51 1rsf s LYS 78 Cb 0.00 -4.06 0.01 0.00 -0.52 0.00 0.00 37.83 33.26 1rsf s LYS 78 CO 0.00 -0.90 0.97 -1.50 -0.92 0.00 0.00 175.35 173.00 1rsf s ILE 79 N 1.66 4.69 -0.23 2.17 -1.16 -1.26 -2.04 121.20 125.02 1rsf s ILE 79 Ca 0.04 1.75 -0.10 0.00 -0.51 0.00 0.00 60.65 61.83 1rsf s ILE 79 Cb -0.22 -4.27 -0.05 0.00 0.61 0.00 0.00 42.46 38.53 1rsf s ILE 79 CO 0.08 -0.23 0.15 -0.31 -2.81 0.00 0.00 174.94 171.82 1rsf s TYR 80 N 3.19 3.32 0.15 3.50 2.02 0.90 -4.73 117.35 125.71 1rsf s TYR 80 Ca 0.41 0.23 0.00 0.00 -0.37 0.00 0.00 57.07 57.33 1rsf s TYR 80 Cb -0.14 -2.25 0.00 0.00 -0.40 0.00 0.00 41.96 39.17 1rsf s TYR 80 CO 0.09 0.09 0.00 -0.40 -1.57 0.00 0.00 175.55 173.76 1rsf n ASP 81 N 4.18 -1.34 0.05 2.29 5.75 -1.26 0.65 116.55 126.88 1rsf n ASP 81 Ca -0.15 0.36 -0.09 0.00 -0.01 0.00 0.00 54.79 54.90 1rsf n ASP 81 Cb 0.52 1.49 -0.13 0.00 -1.03 0.00 0.00 41.12 41.98 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 0.06 0.52 -1.12 1.82 -1.85 -1.97 116.42 113.89 1rsf h ASP 82 Ca 0.00 -0.07 -0.14 0.00 -0.39 0.00 0.00 57.03 56.43 1rsf h ASP 82 Cb 0.00 -0.02 -0.02 0.00 0.68 0.00 0.00 39.33 39.97 1rsf h ASP 82 CO 0.00 1.06 -0.63 1.88 -1.61 0.00 0.00 179.24 179.94 1rsf h TYR 83 N 0.01 0.14 -3.64 0.28 -1.99 -1.90 -3.41 116.97 106.46 1rsf h TYR 83 Ca -0.07 -0.05 -0.58 0.00 2.00 0.00 0.00 58.73 60.02 1rsf h TYR 83 Cb 1.84 -0.02 -0.09 0.00 2.00 0.00 0.00 36.73 40.46 1rsf h TYR 83 CO 0.01 0.71 0.74 0.71 -0.00 0.00 0.00 178.16 180.32 1rsf s TYR 84 N -3.64 2.91 0.40 4.88 2.02 -1.17 -4.93 117.35 117.83 1rsf s TYR 84 Ca -0.02 0.62 0.07 0.00 -0.37 0.00 0.00 57.07 57.36 1rsf s TYR 84 Cb 0.12 -4.10 0.82 0.00 -0.40 0.00 0.00 41.96 38.40 1rsf s TYR 84 CO 0.78 -1.11 2.03 -1.35 -1.57 0.00 0.00 175.55 174.33 1rsf h PRO 85 N 9.00 0.55 -1.01 -1.71 0.11 -1.80 0.72 132.00 137.85 1rsf h PRO 85 Ca -0.23 -0.04 0.29 0.00 0.11 0.00 0.00 66.00 66.13 1rsf h PRO 85 Cb 1.07 -0.12 -0.04 0.00 0.11 0.00 0.00 31.00 32.02 1rsf h PRO 85 CO 1.06 0.39 0.74 -0.44 -0.21 0.00 0.00 178.00 179.54 1rsf h ASP 86 N 0.56 0.00 -0.00 -2.05 3.32 -1.83 -2.97 116.42 113.45 1rsf h ASP 86 Ca 0.15 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 57.05 1rsf h ASP 86 Cb -0.01 0.00 -0.21 0.00 0.22 0.00 0.00 39.33 39.33 1rsf h ASP 86 CO -0.03 0.00 -0.52 0.18 -1.72 0.00 0.00 179.24 177.15 1rsf n LEU 87 N -4.20 -0.38 -4.68 1.55 4.77 -1.10 -4.98 117.00 107.97 1rsf n LEU 87 Ca 0.21 -2.03 -0.45 0.00 -0.03 0.00 0.00 56.01 53.71 1rsf n LEU 87 Cb 1.08 0.01 -0.03 0.00 -2.33 0.00 0.00 43.42 42.15 1rsf n LEU 87 CO 0.39 1.20 1.09 2.29 -1.33 0.00 0.00 177.39 181.04 1rsf n LYS 88 N 0.11 2.15 -0.61 3.23 2.85 0.25 -2.26 118.16 123.89 1rsf n LYS 88 Ca -0.17 0.77 0.00 0.00 -1.05 0.00 0.00 58.31 57.86 1rsf n LYS 88 Cb 0.84 -2.47 0.00 0.00 -0.65 0.00 0.00 35.03 32.75 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 2.53 0.68 2.00 2.58 0.00 -1.25 -4.86 105.19 106.87 1rsf n GLY 89 Ca 0.13 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -2.61 0.00 -2.53 1.61 1.85 -0.96 -4.59 116.66 109.44 1rsf n ARG 90 Ca 0.00 0.00 -0.41 0.00 -1.00 0.00 0.00 57.85 56.44 1rsf n ARG 90 Cb 0.00 0.00 -0.01 0.00 -1.05 0.00 0.00 32.46 31.40 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 -2.00 4.05 -0.22 8.89 0.11 -1.20 -0.31 120.40 129.72 1rsf s VAL 91 Ca 0.00 -1.73 -0.10 0.00 -2.93 0.00 0.00 61.98 57.23 1rsf s VAL 91 Cb 0.00 -5.13 -0.05 0.00 -1.53 0.00 0.00 36.38 29.68 1rsf s VAL 91 CO 0.00 -1.93 0.13 -1.00 -3.33 0.00 0.00 175.10 168.97 1rsf s HIS 92 N 4.90 3.30 -0.01 1.54 3.76 0.43 -4.63 115.29 124.57 1rsf s HIS 92 Ca 0.55 0.16 -0.30 0.00 -0.15 0.00 0.00 55.06 55.31 1rsf s HIS 92 Cb 0.03 -2.22 -0.05 0.00 1.11 0.00 0.00 32.58 31.45 1rsf s HIS 92 CO 0.07 0.08 1.41 -0.06 -0.85 0.00 0.00 174.74 175.38 1rsf s PHE 93 N 0.89 2.80 0.00 1.40 0.08 -1.25 0.14 117.98 122.04 1rsf s PHE 93 Ca 0.07 0.79 0.00 0.00 0.12 0.00 0.00 56.93 57.91 1rsf s PHE 93 Cb -0.13 -3.67 0.00 0.00 -0.57 0.00 0.00 43.02 38.65 1rsf s PHE 93 CO 0.03 -2.48 1.30 0.25 -0.10 0.00 0.00 175.22 174.22 1rsf n THR 94 N 4.75 1.30 -3.70 0.64 -2.24 -0.44 -4.65 114.28 109.94 1rsf n THR 94 Ca 0.13 -0.25 -0.11 0.00 -2.27 0.00 0.00 64.05 61.55 1rsf n THR 94 Cb 0.44 -1.21 -0.12 0.00 -2.10 0.00 0.00 70.33 67.34 1rsf n THR 94 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1rsf s SER 95 N 1.61 -0.24 0.00 3.42 0.01 -1.26 -5.01 113.70 112.23 1rsf s SER 95 Ca 0.00 0.72 0.16 0.00 1.31 0.00 0.00 55.95 58.13 1rsf s SER 95 Cb 0.00 0.69 0.48 0.00 0.21 0.00 0.00 66.02 67.40 1rsf s SER 95 CO 0.00 -0.20 1.38 0.59 0.41 0.00 0.00 173.24 175.42 1rsf n ASN 96 N 4.57 2.22 -3.04 2.44 3.02 -1.26 -4.24 115.26 118.96 1rsf n ASN 96 Ca -0.19 -1.93 -0.18 0.00 -0.03 0.00 0.00 54.58 52.25 1rsf n ASN 96 Cb 0.53 -0.24 -0.02 0.00 -0.61 0.00 0.00 39.78 39.44 1rsf n ASN 96 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1rsf n ASP 97 N 0.70 -0.69 -0.17 6.41 8.00 -1.26 -4.98 116.55 124.56 1rsf n ASP 97 Ca 0.15 -2.97 0.06 0.00 0.71 0.00 0.00 54.79 52.73 1rsf n ASP 97 Cb 0.37 0.18 0.35 0.00 -0.02 0.00 0.00 41.12 42.00 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 3.76 0.67 0.00 0.64 4.07 -1.74 -1.49 115.31 121.22 1rsf h LEU 98 Ca 0.01 -0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.97 1rsf h LEU 98 Cb 0.95 -0.14 0.00 0.00 1.08 0.00 0.00 40.66 42.54 1rsf h LEU 98 CO 0.41 0.44 0.00 0.29 -1.08 0.00 0.00 178.44 178.50 1rsf n LYS 99 N -4.47 0.15 0.00 1.13 5.02 -1.26 -1.00 118.16 117.72 1rsf n LYS 99 Ca 0.10 0.00 0.14 0.00 -2.02 0.00 0.00 58.31 56.53 1rsf n LYS 99 Cb 0.20 -1.39 0.50 0.00 -0.02 0.00 0.00 35.03 34.31 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 -0.89 1.56 0.00 4.39 7.64 -0.56 -4.91 113.62 120.85 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 0.01 0.01 0.00 0.00 -1.01 0.00 0.00 64.21 63.22 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 1.19 1.23 3.48 0.23 0.00 -0.17 -4.97 105.19 106.18 1rsf n GLY 101 Ca 0.18 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 -1.84 6.16 -0.10 1.61 1.01 -1.17 0.46 116.67 122.79 1rsf s ASP 102 Ca 0.00 -0.69 0.14 0.00 0.71 0.00 0.00 52.55 52.71 1rsf s ASP 102 Cb 0.00 -2.19 0.47 0.00 1.01 0.00 0.00 42.92 42.20 1rsf s ASP 102 CO 0.00 -0.49 1.39 0.00 0.21 0.00 0.00 175.17 176.27 1rsf n ALA 103 N 5.40 2.70 -1.78 5.23 0.00 0.31 -4.17 120.51 128.21 1rsf n ALA 103 Ca -0.09 -1.76 -0.41 0.00 0.00 0.00 0.00 53.44 51.18 1rsf n ALA 103 Cb 0.48 -0.65 -0.00 0.00 0.00 0.00 0.00 19.45 19.28 1rsf n ALA 103 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1rsf s SER 104 N -1.42 6.31 -0.05 0.00 0.01 -0.58 -4.57 113.70 113.39 1rsf s SER 104 Ca 0.36 3.08 0.01 0.00 1.31 0.00 0.00 55.95 60.71 1rsf s SER 104 Cb 0.25 -2.67 0.02 0.00 0.21 0.00 0.00 66.02 63.83 1rsf s SER 104 CO 0.13 -0.90 -0.07 0.27 0.41 0.00 0.00 173.24 173.09 1rsf s ILE 105 N -1.12 0.69 0.04 1.44 -5.25 -0.18 -1.32 121.20 115.50 1rsf s ILE 105 Ca 0.53 -0.22 0.02 0.00 -0.99 0.00 0.00 60.65 59.99 1rsf s ILE 105 Cb -0.47 -0.68 -0.04 0.00 2.95 0.00 0.00 42.46 44.22 1rsf s ILE 105 CO 0.64 0.25 0.07 0.54 -1.79 0.00 0.00 174.94 174.65 1rsf s ASN 106 N 0.81 5.51 -0.27 4.36 2.20 0.37 -0.54 114.94 127.37 1rsf s ASN 106 Ca -0.12 0.03 -0.11 0.00 -0.94 0.00 0.00 52.86 51.72 1rsf s ASN 106 Cb -0.15 -1.50 -0.05 0.00 -2.00 0.00 0.00 41.25 37.55 1rsf s ASN 106 CO 0.01 0.22 0.21 -0.69 -2.94 0.00 0.00 177.10 173.91 1rsf s VAL 107 N -1.29 5.30 0.27 3.54 1.01 0.12 0.16 120.40 129.52 1rsf s VAL 107 Ca 0.26 0.23 -0.22 0.00 0.00 0.00 0.00 61.98 62.24 1rsf s VAL 107 Cb -0.12 -3.55 -0.09 0.00 0.00 0.00 0.00 36.38 32.62 1rsf s VAL 107 CO 0.18 0.26 0.83 0.42 0.00 0.00 0.00 175.10 176.78 1rsf s THR 108 N 1.66 4.41 -1.16 3.92 -4.23 0.58 -0.89 115.64 119.92 1rsf s THR 108 Ca 0.08 1.52 -0.17 0.00 -1.18 0.00 0.00 61.69 61.94 1rsf s THR 108 Cb -0.16 -3.91 -0.01 0.00 1.34 0.00 0.00 72.50 69.76 1rsf s THR 108 CO 0.10 0.16 0.78 0.59 -0.54 0.00 0.00 174.62 175.70 1rsf n ASN 109 N 0.59 -4.87 -4.48 3.99 3.02 -1.09 -4.64 115.26 107.78 1rsf n ASN 109 Ca -0.00 -0.98 -0.18 0.00 -0.03 0.00 0.00 54.58 53.40 1rsf n ASN 109 Cb 0.51 -3.57 -0.16 0.00 -0.61 0.00 0.00 39.78 35.94 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 -4.12 -0.51 -4.73 3.41 4.77 -0.80 -4.38 117.00 110.65 1rsf n LEU 110 Ca -0.12 -0.95 -0.38 0.00 -0.03 0.00 0.00 56.01 54.54 1rsf n LEU 110 Cb 0.60 -0.89 0.05 0.00 -2.33 0.00 0.00 43.42 40.85 1rsf n LEU 110 CO 0.67 -1.87 0.94 0.00 -1.33 0.00 0.00 177.39 175.80 1rsf n GLN 111 N 6.44 1.49 -0.08 3.23 10.64 -1.26 -1.53 117.38 136.30 1rsf n GLN 111 Ca 0.56 0.56 0.03 0.00 -1.83 0.00 0.00 57.00 56.32 1rsf n GLN 111 Cb 0.26 -2.54 0.36 0.00 -0.86 0.00 0.00 30.24 27.46 1rsf n GLN 111 CO 0.00 0.00 0.00 1.25 -1.83 0.00 0.00 177.06 176.48 1rsf h LEU 112 N 1.14 0.62 0.00 2.61 5.85 -1.94 -0.63 115.31 122.96 1rsf h LEU 112 Ca -0.51 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.20 1rsf h LEU 112 Cb 1.32 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 42.19 1rsf h LEU 112 CO 0.56 0.45 0.00 -1.54 -0.34 0.00 0.00 178.44 177.57 1rsf n SER 113 N -4.45 0.00 0.25 1.25 3.41 -1.26 -2.55 113.62 110.26 1rsf n SER 113 Ca 0.05 0.44 0.16 0.00 -0.26 0.00 0.00 58.87 59.26 1rsf n SER 113 Cb 0.05 -0.47 0.64 0.00 -0.26 0.00 0.00 64.21 64.17 1rsf n SER 113 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1rsf h ASP 114 N 0.00 0.00 -1.53 4.04 3.32 -1.46 -3.45 116.42 117.34 1rsf h ASP 114 Ca 0.00 0.00 -0.68 0.00 0.02 0.00 0.00 57.03 56.37 1rsf h ASP 114 Cb 0.29 0.00 0.08 0.00 0.22 0.00 0.00 39.33 39.92 1rsf h ASP 114 CO 0.00 0.00 0.03 -0.38 -1.72 0.00 0.00 179.24 177.17 1rsf n ILE 115 N -2.93 0.99 0.00 0.35 5.41 -1.06 -4.83 119.36 117.30 1rsf n ILE 115 Ca 0.01 -0.25 0.00 0.00 1.00 0.00 0.00 62.75 63.51 1rsf n ILE 115 Cb 0.30 -0.46 0.00 0.00 -0.71 0.00 0.00 39.64 38.77 1rsf n ILE 115 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1rsf n GLY 116 N 1.86 4.46 3.74 7.39 0.00 -0.82 -3.23 105.19 118.59 1rsf n GLY 116 Ca 0.17 -1.38 -0.42 0.00 0.00 0.00 0.00 46.02 44.39 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 -1.96 0.93 -4.82 2.61 -1.04 -0.11 -2.46 114.28 107.44 1rsf n THR 117 Ca 0.00 -0.23 -0.33 0.00 -2.04 0.00 0.00 64.05 61.45 1rsf n THR 117 Cb 0.00 -1.94 -0.13 0.00 -1.82 0.00 0.00 70.33 66.44 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 0.09 2.76 -0.14 -1.42 1.51 0.73 0.56 117.35 121.44 1rsf s TYR 118 Ca 0.65 -0.22 -0.00 0.00 -1.01 0.00 0.00 57.07 56.48 1rsf s TYR 118 Cb -0.51 -1.69 0.03 0.00 -0.11 0.00 0.00 41.96 39.69 1rsf s TYR 118 CO 0.47 0.13 -0.07 -1.14 -1.11 0.00 0.00 175.55 173.83 1rsf s GLN 119 N -0.52 1.52 -0.27 -0.62 0.74 0.42 0.61 119.66 121.54 1rsf s GLN 119 Ca 0.07 -0.37 -0.09 0.00 0.05 0.00 0.00 55.36 55.02 1rsf s GLN 119 Cb -0.12 -1.77 -0.03 0.00 1.10 0.00 0.00 33.01 32.19 1rsf s GLN 119 CO 0.02 -0.33 0.12 0.00 -0.55 0.00 0.00 175.29 174.55 1rsf s LYS 121 N 1.65 2.01 -0.44 0.00 1.02 -0.06 -0.96 119.74 122.96 1rsf s LYS 121 Ca 0.06 -1.51 -0.21 0.00 0.02 0.00 0.00 55.97 54.33 1rsf s LYS 121 Cb -0.16 -2.99 0.02 0.00 -0.52 0.00 0.00 37.83 34.19 1rsf s LYS 121 CO 0.06 -0.68 0.68 0.08 -0.92 0.00 0.00 175.35 174.57 1rsf s VAL 122 N 1.04 4.78 -0.32 3.17 1.01 0.27 0.81 120.40 131.16 1rsf s VAL 122 Ca -0.03 0.22 -0.15 0.00 0.00 0.00 0.00 61.98 62.02 1rsf s VAL 122 Cb -0.20 -4.23 -0.02 0.00 0.00 0.00 0.00 36.38 31.93 1rsf s VAL 122 CO -0.06 -0.62 0.37 -0.54 0.00 0.00 0.00 175.10 174.25 1rsf s LYS 123 N 2.95 3.69 -0.27 2.72 1.02 0.55 0.13 119.74 130.52 1rsf s LYS 123 Ca 0.25 -0.29 -0.01 0.00 0.02 0.00 0.00 55.97 55.93 1rsf s LYS 123 Cb -0.14 -3.76 0.13 0.00 -0.52 0.00 0.00 37.83 33.54 1rsf s LYS 123 CO 0.20 -0.46 0.29 0.21 -0.92 0.00 0.00 175.35 174.67 1rsf s LYS 124 N 2.04 0.31 0.19 1.68 2.20 -0.92 0.13 119.74 125.38 1rsf s LYS 124 Ca 0.13 -0.04 -0.33 0.00 -0.36 0.00 0.00 55.97 55.37 1rsf s LYS 124 Cb -0.16 -0.72 -0.14 0.00 -1.51 0.00 0.00 37.83 35.29 1rsf s LYS 124 CO 0.11 -0.95 1.38 0.00 -0.36 0.00 0.00 175.35 175.53 1rsf n ALA 125 N 5.32 0.51 -2.04 3.13 0.00 -1.25 0.20 120.51 126.37 1rsf n ALA 125 Ca -0.03 0.44 -0.40 0.00 0.00 0.00 0.00 53.44 53.46 1rsf n ALA 125 Cb 0.47 -2.21 0.04 0.00 0.00 0.00 0.00 19.45 17.74 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 2.31 3.18 -3.46 0.00 -0.04 -1.23 -0.17 135.00 135.59 1rsf n PRO 126 Ca 0.14 -3.72 -0.20 0.00 -0.04 0.00 0.00 63.50 59.69 1rsf n PRO 126 Cb 0.28 -2.30 -0.12 0.00 -0.04 0.00 0.00 33.50 31.32 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 -1.17 0.03 -0.26 0.55 0.00 0.53 -4.99 107.32 102.02 1rsf s GLY 127 Ca 0.50 -0.32 -0.20 0.00 0.00 0.00 0.00 44.72 44.70 1rsf s GLY 127 CO -0.37 2.39 0.61 -1.34 0.00 0.00 0.00 173.10 174.39 1rsf s VAL 128 N 2.30 4.99 -0.11 1.40 -7.23 -1.26 -2.16 120.40 118.33 1rsf s VAL 128 Ca 0.09 1.10 -0.07 0.00 -1.81 0.00 0.00 61.98 61.28 1rsf s VAL 128 Cb -0.15 -3.92 -0.04 0.00 0.56 0.00 0.00 36.38 32.83 1rsf s VAL 128 CO -0.28 0.03 0.15 0.00 -0.31 0.00 0.00 175.10 174.70 1rsf s ALA 129 N 2.48 3.87 -0.10 1.32 0.00 0.35 -4.93 121.76 124.75 1rsf s ALA 129 Ca 0.25 -0.62 -0.06 0.00 0.00 0.00 0.00 51.96 51.53 1rsf s ALA 129 Cb -0.15 -1.99 0.04 0.00 0.00 0.00 0.00 23.12 21.01 1rsf s ALA 129 CO 0.09 0.61 0.24 1.21 0.00 0.00 0.00 175.76 177.91 1rsf s ASN 130 N -1.03 -0.26 0.02 0.00 2.47 -1.25 0.96 114.94 115.84 1rsf s ASN 130 Ca 0.15 0.51 -0.08 0.00 0.42 0.00 0.00 52.86 53.86 1rsf s ASN 130 Cb -0.12 0.44 0.00 0.00 -1.45 0.00 0.00 41.25 40.12 1rsf s ASN 130 CO 0.04 -0.14 0.16 -1.59 -3.72 0.00 0.00 177.10 171.86 1rsf s LYS 131 N 0.86 0.59 -0.09 0.43 0.00 -0.14 -4.88 119.74 116.51 1rsf s LYS 131 Ca -0.06 -0.54 -0.05 0.00 0.00 0.00 0.00 55.97 55.32 1rsf s LYS 131 Cb -0.07 0.24 -0.04 0.00 0.00 0.00 0.00 37.83 37.96 1rsf s LYS 131 CO -0.05 -0.16 0.10 0.15 0.00 0.00 0.00 175.35 175.39 1rsf s LYS 132 N -2.04 3.29 -0.04 1.78 1.02 0.54 -1.30 119.74 122.99 1rsf s LYS 132 Ca -0.09 -0.25 -0.02 0.00 0.02 0.00 0.00 55.97 55.62 1rsf s LYS 132 Cb -0.04 -3.05 0.03 0.00 -0.52 0.00 0.00 37.83 34.25 1rsf s LYS 132 CO -0.01 0.74 0.06 0.42 -0.92 0.00 0.00 175.35 175.63 1rsf s ILE 133 N -1.04 -0.11 -0.35 2.17 1.01 0.20 0.24 121.20 123.32 1rsf s ILE 133 Ca 0.17 0.43 -0.13 0.00 0.00 0.00 0.00 60.65 61.11 1rsf s ILE 133 Cb -0.12 -0.15 -0.01 0.00 0.01 0.00 0.00 42.46 42.19 1rsf s ILE 133 CO 0.06 0.18 0.25 -1.00 0.00 0.00 0.00 174.94 174.43 1rsf s HIS 134 N 2.17 3.23 -0.18 3.97 3.76 0.96 0.26 115.29 129.46 1rsf s HIS 134 Ca 0.05 -0.29 -0.20 0.00 -0.15 0.00 0.00 55.06 54.48 1rsf s HIS 134 Cb -0.12 -2.50 -0.03 0.00 1.11 0.00 0.00 32.58 31.04 1rsf s HIS 134 CO -0.03 -0.41 0.57 -1.17 -0.85 0.00 0.00 174.74 172.85 1rsf s LEU 135 N 1.71 4.17 -0.14 0.89 2.96 -1.03 0.17 118.68 127.41 1rsf s LEU 135 Ca 0.06 0.78 0.02 0.00 -0.22 0.00 0.00 54.13 54.77 1rsf s LEU 135 Cb -0.18 -2.80 0.01 0.00 0.50 0.00 0.00 46.19 43.73 1rsf s LEU 135 CO 0.10 -0.19 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.05 1rsf s VAL 136 N 1.56 1.97 -0.27 1.68 1.01 0.13 -1.94 120.40 124.52 1rsf s VAL 136 Ca 0.27 -0.91 -0.14 0.00 0.00 0.00 0.00 61.98 61.20 1rsf s VAL 136 Cb -0.16 -1.75 -0.04 0.00 0.00 0.00 0.00 36.38 34.43 1rsf s VAL 136 CO 0.10 0.53 0.32 -0.69 0.00 0.00 0.00 175.10 175.37 1rsf s VAL 137 N 0.96 5.21 0.74 2.92 1.01 -1.26 -0.52 120.40 129.46 1rsf s VAL 137 Ca -0.04 0.46 -0.08 0.00 0.00 0.00 0.00 61.98 62.32 1rsf s VAL 137 Cb -0.15 -3.65 0.07 0.00 0.00 0.00 0.00 36.38 32.65 1rsf s VAL 137 CO -0.04 0.18 1.06 -0.76 0.00 0.00 0.00 175.10 175.53 1rsf s LEU 138 N 1.99 2.76 0.23 3.92 1.43 0.34 -4.77 118.68 124.58 1rsf s LEU 138 Ca 0.13 0.47 -0.30 0.00 -1.03 0.00 0.00 54.13 53.40 1rsf s LEU 138 Cb -0.16 -3.06 -0.09 0.00 0.03 0.00 0.00 46.19 42.92 1rsf s LEU 138 CO 0.10 -1.72 1.09 -0.69 0.23 0.00 0.00 176.35 175.37 1rsf s VAL 139 N -3.33 3.67 0.32 -1.59 1.01 -1.26 -0.61 120.40 118.61 1rsf s VAL 139 Ca 0.61 1.58 -0.19 0.00 0.00 0.00 0.00 61.98 63.98 1rsf s VAL 139 Cb -0.10 -4.01 0.04 0.00 0.00 0.00 0.00 36.38 32.31 1rsf s VAL 139 CO 0.46 0.33 0.76 -0.54 0.00 0.00 0.00 175.10 176.11 1rsf s LYS 140 N -0.97 1.96 0.00 2.72 -0.14 -1.26 -4.47 119.74 117.58 1rsf s LYS 140 Ca 0.46 -1.18 0.00 0.00 -1.36 0.00 0.00 55.97 53.90 1rsf s LYS 140 Cb -0.31 0.61 0.00 0.00 -1.68 0.00 0.00 37.83 36.45 1rsf s LYS 140 CO 0.38 -0.91 0.00 -0.35 -0.76 0.00 0.00 175.35 173.71 1rsf n PRO 141 N -0.49 1.93 -0.30 -1.68 -0.04 -1.26 -4.67 135.00 128.48 1rsf n PRO 141 Ca -0.06 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.45 1rsf n PRO 141 Cb 0.59 0.00 0.12 0.00 -0.04 0.00 0.00 33.50 34.17 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 0.00 -0.30 0.00 3.54 7.64 -1.26 -4.71 113.62 118.53 1rsf n SER 142 Ca 0.00 1.42 0.00 0.00 1.01 0.00 0.00 58.87 61.30 1rsf n SER 142 Cb 0.00 -0.43 0.00 0.00 -1.01 0.00 0.00 64.21 62.77 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 -1.52 0.98 0.20 0.23 0.00 -1.26 -4.90 105.19 98.92 1rsf n GLY 143 Ca 0.13 -0.02 0.15 0.00 0.00 0.00 0.00 46.02 46.29 1rsf n GLY 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32