#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1okd h GLY 3 N 0.00 0.00 0.35 0.23 0.00 -1.76 -2.38 103.07 99.51 1okd h GLY 3 Ca 0.00 0.00 0.19 0.00 0.00 0.00 0.00 47.33 47.52 1okd h GLY 3 CO 0.00 0.00 0.64 1.41 0.00 0.00 0.00 176.54 178.59 1okd h LEU 4 N 0.00 0.00 -2.15 3.11 3.38 -1.83 0.44 115.31 118.26 1okd h LEU 4 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1okd h LEU 4 Cb 0.07 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 1okd h LEU 4 CO 0.00 0.00 -0.05 -0.78 0.09 0.00 0.00 178.44 177.71 1okd h ASP 5 N 0.00 0.00 0.97 -0.43 1.82 -1.77 -0.90 116.42 116.11 1okd h ASP 5 Ca 0.31 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.95 1okd h ASP 5 Cb 1.59 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.60 1okd h ASP 5 CO -0.00 0.05 0.00 0.07 -1.61 0.00 0.00 179.24 177.74 1okd h LYS 6 N 0.00 0.00 -0.33 0.28 5.09 -0.34 -3.14 116.57 118.12 1okd h LYS 6 Ca -0.00 0.00 0.04 0.00 0.09 0.00 0.00 60.65 60.78 1okd h LYS 6 Cb 0.10 0.00 -0.04 0.00 0.10 0.00 0.00 32.23 32.39 1okd h LYS 6 CO 0.01 0.00 0.10 1.88 -2.09 0.00 0.00 179.45 179.34 1okd h TYR 7 N 0.00 0.17 -1.66 0.07 -1.99 -1.29 -3.44 116.97 108.83 1okd h TYR 7 Ca 0.00 0.02 0.09 0.00 2.00 0.00 0.00 58.73 60.84 1okd h TYR 7 Cb 0.49 -0.03 -0.25 0.00 2.00 0.00 0.00 36.73 38.94 1okd h TYR 7 CO 0.00 0.06 0.28 -1.17 -0.00 0.00 0.00 178.16 177.33 1okd s LEU 8 N -10.33 -0.64 0.00 3.88 2.96 -1.18 -4.89 118.68 108.47 1okd s LEU 8 Ca -0.13 1.01 0.07 0.00 -0.22 0.00 0.00 54.13 54.86 1okd s LEU 8 Cb 0.12 1.93 0.40 0.00 0.50 0.00 0.00 46.19 49.13 1okd s LEU 8 CO 0.71 -0.16 1.10 -2.65 -1.32 0.00 0.00 176.35 174.02 1okd n PRO 9 N 3.90 0.82 -1.38 0.98 -0.02 -1.26 -3.58 135.00 134.46 1okd n PRO 9 Ca -0.19 0.00 -0.25 0.00 -2.02 0.00 0.00 63.50 61.04 1okd n PRO 9 Cb 0.58 -1.13 0.10 0.00 -0.02 0.00 0.00 33.50 33.04 1okd n PRO 9 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1okd n GLY 10 N 0.40 5.61 3.44 -1.23 0.00 -1.26 -4.98 105.19 107.17 1okd n GLY 10 Ca 0.05 -2.00 -0.29 0.00 0.00 0.00 0.00 46.02 43.78 1okd n GLY 10 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1okd s ILE 11 N -4.23 2.57 0.12 -0.61 -1.09 -1.23 -4.58 121.20 112.14 1okd s ILE 11 Ca 0.56 -1.63 0.00 0.00 -2.23 0.00 0.00 60.65 57.36 1okd s ILE 11 Cb 0.46 -2.16 0.00 0.00 -1.58 0.00 0.00 42.46 39.18 1okd s ILE 11 CO 0.02 0.09 0.00 -1.84 -1.23 0.00 0.00 174.94 171.98 1okd n GLU 12 N 0.84 0.00 -3.64 2.79 0.28 -1.26 -5.15 120.64 114.50 1okd n GLU 12 Ca -0.17 0.00 -0.10 0.00 -0.16 0.00 0.00 57.16 56.73 1okd n GLU 12 Cb 0.53 0.00 -0.04 0.00 1.43 0.00 0.00 31.44 33.36 1okd n GLU 12 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 1okd s LYS 13 N -2.00 1.14 -0.18 3.44 1.02 -1.26 -4.05 119.74 117.85 1okd s LYS 13 Ca 0.00 -0.73 -0.09 0.00 0.02 0.00 0.00 55.97 55.17 1okd s LYS 13 Cb 0.00 0.49 -0.05 0.00 -0.52 0.00 0.00 37.83 37.75 1okd s LYS 13 CO 0.00 -0.46 0.11 -0.51 -0.92 0.00 0.00 175.35 173.58 1okd s LEU 14 N -2.82 4.14 0.66 3.17 1.43 -1.13 -4.53 118.68 119.60 1okd s LEU 14 Ca 0.04 0.24 0.25 0.00 -1.03 0.00 0.00 54.13 53.63 1okd s LEU 14 Cb 0.01 -2.05 1.33 0.00 0.03 0.00 0.00 46.19 45.51 1okd s LEU 14 CO -0.10 0.22 1.75 0.03 0.23 0.00 0.00 176.35 178.48 1okd h ARG 15 N 6.37 0.00 -5.25 1.70 3.08 0.14 -1.08 114.38 119.34 1okd h ARG 15 Ca -0.43 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 59.36 1okd h ARG 15 Cb 1.17 0.00 -0.16 0.00 0.08 0.00 0.00 29.97 31.06 1okd h ARG 15 CO 0.72 0.00 -0.38 0.54 -1.07 0.00 0.00 179.97 179.78 1okd n ARG 16 N -2.92 -1.60 0.00 0.04 5.12 -1.20 -2.62 116.66 113.48 1okd n ARG 16 Ca -0.00 0.06 0.00 0.00 -1.93 0.00 0.00 57.85 55.98 1okd n ARG 16 Cb 0.54 -3.57 0.00 0.00 -1.16 0.00 0.00 32.46 28.27 1okd n ARG 16 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1okd n GLY 17 N -0.68 0.92 0.29 -0.13 0.00 -1.19 -3.68 105.19 100.72 1okd n GLY 17 Ca 0.05 -0.62 0.07 0.00 0.00 0.00 0.00 46.02 45.51 1okd n GLY 17 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1okd h ASP 18 N 1.45 -0.41 -3.87 1.61 3.04 -1.93 -3.41 116.42 112.90 1okd h ASP 18 Ca 0.00 0.22 -0.52 0.00 -3.24 0.00 0.00 57.03 53.48 1okd h ASP 18 Cb 0.00 0.39 -0.20 0.00 -1.04 0.00 0.00 39.33 38.48 1okd h ASP 18 CO 0.00 -0.22 -0.80 -0.83 -2.04 0.00 0.00 179.24 175.36 1okd s GLY 19 N -3.84 1.29 0.13 7.15 0.00 -1.24 -5.14 107.32 105.67 1okd s GLY 19 Ca -0.13 -1.36 -0.03 0.00 0.00 0.00 0.00 44.72 43.20 1okd s GLY 19 CO 0.76 -1.39 0.34 -1.83 0.00 0.00 0.00 173.10 170.97 1okd s GLU 20 N -2.41 3.55 0.32 2.90 1.03 -1.08 -3.22 118.70 119.79 1okd s GLU 20 Ca 0.11 -0.24 0.10 0.00 0.03 0.00 0.00 54.97 54.97 1okd s GLU 20 Cb -0.07 -2.90 -0.05 0.00 -0.80 0.00 0.00 34.13 30.31 1okd s GLU 20 CO 0.05 0.49 -0.06 0.14 -1.33 0.00 0.00 175.26 174.55 1okd s VAL 21 N -1.67 2.62 0.41 1.83 -7.23 -0.41 -4.91 120.40 111.04 1okd s VAL 21 Ca 0.39 -2.11 -0.23 0.00 -1.81 0.00 0.00 61.98 58.21 1okd s VAL 21 Cb -0.12 -2.66 -0.09 0.00 0.56 0.00 0.00 36.38 34.07 1okd s VAL 21 CO 0.26 -0.27 1.04 -1.61 -0.31 0.00 0.00 175.10 174.22 1okd s GLU 22 N -3.64 4.13 0.56 4.82 8.01 -1.26 -2.82 118.70 128.50 1okd s GLU 22 Ca 0.33 1.48 0.24 0.00 0.01 0.00 0.00 54.97 57.02 1okd s GLU 22 Cb -0.01 -2.48 1.53 0.00 -4.31 0.00 0.00 34.13 28.86 1okd s GLU 22 CO 0.18 -0.16 2.15 0.28 0.01 0.00 0.00 175.26 177.71 1okd h VAL 23 N 2.11 0.71 -0.62 2.63 2.07 -1.96 -1.93 116.25 119.25 1okd h VAL 23 Ca -0.48 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.22 1okd h VAL 23 Cb 1.21 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 31.89 1okd h VAL 23 CO 0.62 0.00 0.56 0.11 0.02 0.00 0.00 177.57 178.88 1okd h LYS 24 N 0.00 0.00 0.00 1.57 6.56 -1.92 0.19 116.57 122.97 1okd h LYS 24 Ca 0.05 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.64 1okd h LYS 24 Cb 0.25 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.91 1okd h LYS 24 CO -0.00 0.00 0.00 1.03 -2.06 0.00 0.00 179.45 178.42 1okd h SER 25 N 0.00 0.00 -1.25 0.86 0.87 -1.74 -2.18 113.55 110.11 1okd h SER 25 Ca 0.29 0.00 -0.67 0.00 -1.23 0.00 0.00 61.79 60.18 1okd h SER 25 Cb 1.41 0.00 -0.27 0.00 -0.44 0.00 0.00 62.40 63.11 1okd h SER 25 CO -0.00 0.00 0.88 0.18 -0.53 0.00 0.00 176.83 177.35 1okd n LEU 26 N -2.65 7.52 -4.24 2.23 4.77 0.66 -4.83 117.00 120.46 1okd n LEU 26 Ca -0.02 -4.36 -0.42 0.00 -0.03 0.00 0.00 56.01 51.17 1okd n LEU 26 Cb 0.06 -1.02 -0.04 0.00 -2.33 0.00 0.00 43.42 40.08 1okd n LEU 26 CO 0.15 1.55 0.35 0.00 -1.33 0.00 0.00 177.39 178.11 1okd s ALA 27 N -3.65 4.04 0.00 -1.18 0.00 -0.82 -4.48 121.76 115.66 1okd s ALA 27 Ca 0.58 -3.44 0.00 0.00 0.00 0.00 0.00 51.96 49.11 1okd s ALA 27 Cb 0.46 -3.20 0.00 0.00 0.00 0.00 0.00 23.12 20.38 1okd s ALA 27 CO -0.14 -2.21 0.00 0.41 0.00 0.00 0.00 175.76 173.83 1okd n GLY 28 N 3.48 0.58 3.49 0.00 0.00 -1.26 -4.96 105.19 106.51 1okd n GLY 28 Ca 0.14 -0.20 -0.15 0.00 0.00 0.00 0.00 46.02 45.81 1okd n GLY 28 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1okd s LYS 29 N -0.08 1.10 -0.27 1.61 -2.85 -1.26 -4.90 119.74 113.09 1okd s LYS 29 Ca 0.00 -0.01 -0.23 0.00 -1.00 0.00 0.00 55.97 54.73 1okd s LYS 29 Cb 0.00 0.52 -0.01 0.00 -2.06 0.00 0.00 37.83 36.28 1okd s LYS 29 CO 0.00 -0.40 0.76 -1.17 0.10 0.00 0.00 175.35 174.63 1okd s LEU 30 N -1.76 4.08 -0.34 2.77 2.96 -1.26 -1.68 118.68 123.44 1okd s LEU 30 Ca -0.06 0.78 -0.13 0.00 -0.22 0.00 0.00 54.13 54.51 1okd s LEU 30 Cb -0.00 -3.05 -0.02 0.00 0.50 0.00 0.00 46.19 43.62 1okd s LEU 30 CO 0.01 -0.52 0.24 -0.69 -1.32 0.00 0.00 176.35 174.07 1okd s VAL 31 N 2.80 5.24 0.28 1.68 1.01 0.55 -1.85 120.40 130.11 1okd s VAL 31 Ca 0.31 -0.24 -0.17 0.00 0.00 0.00 0.00 61.98 61.89 1okd s VAL 31 Cb -0.15 -3.70 -0.09 0.00 0.00 0.00 0.00 36.38 32.45 1okd s VAL 31 CO 0.10 -0.01 0.73 -0.36 0.00 0.00 0.00 175.10 175.55 1okd s PHE 32 N 1.72 3.48 -0.27 5.22 0.08 0.74 -1.80 117.98 127.16 1okd s PHE 32 Ca 0.06 1.28 0.01 0.00 0.12 0.00 0.00 56.93 58.40 1okd s PHE 32 Cb -0.17 -2.56 0.07 0.00 -0.57 0.00 0.00 43.02 39.79 1okd s PHE 32 CO 0.10 0.20 -0.00 -0.06 -0.10 0.00 0.00 175.22 175.35 1okd s PHE 33 N -1.79 2.49 -0.45 0.36 0.40 15.66 0.18 117.98 134.82 1okd s PHE 33 Ca 0.49 -1.97 -0.19 0.00 -0.60 0.00 0.00 56.93 54.67 1okd s PHE 33 Cb -0.13 -1.84 0.03 0.00 0.51 0.00 0.00 43.02 41.59 1okd s PHE 33 CO 0.19 -0.82 0.57 -0.47 0.70 0.00 0.00 175.22 175.39 1okd s TYR 34 N 1.35 3.09 -0.23 0.36 5.04 5.34 -0.84 117.35 131.46 1okd s TYR 34 Ca 0.00 -0.29 -0.14 0.00 -2.44 0.00 0.00 57.07 54.20 1okd s TYR 34 Cb -0.19 -3.25 -0.04 0.00 0.35 0.00 0.00 41.96 38.83 1okd s TYR 34 CO -0.10 -0.86 0.32 -0.06 -1.34 0.00 0.00 175.55 173.51 1okd s PHE 35 N 2.55 3.31 0.06 4.97 0.08 -0.80 -1.68 117.98 126.48 1okd s PHE 35 Ca 0.17 0.43 -0.27 0.00 0.12 0.00 0.00 56.93 57.38 1okd s PHE 35 Cb -0.16 -2.46 0.09 0.00 -0.57 0.00 0.00 43.02 39.92 1okd s PHE 35 CO 0.15 -0.06 1.18 -1.12 -0.10 0.00 0.00 175.22 175.27 1okd s SER 36 N 1.25 -0.03 0.13 1.36 0.01 -0.66 -1.19 113.70 114.57 1okd s SER 36 Ca 0.14 -0.34 0.03 0.00 1.31 0.00 0.00 55.95 57.09 1okd s SER 36 Cb -0.15 0.29 -0.04 0.00 0.21 0.00 0.00 66.02 66.33 1okd s SER 36 CO 0.08 -0.57 -0.08 0.00 0.41 0.00 0.00 173.24 173.08 1okd s ALA 37 N -2.33 1.30 -2.04 1.44 0.00 -1.26 0.13 121.76 119.00 1okd s ALA 37 Ca 0.21 -1.45 0.12 0.00 0.00 0.00 0.00 51.96 50.84 1okd s ALA 37 Cb 0.00 0.12 0.37 0.00 0.00 0.00 0.00 23.12 23.61 1okd s ALA 37 CO 0.00 -0.16 1.30 -1.13 0.00 0.00 0.00 175.76 175.78 1okd n SER 38 N -0.15 1.85 -0.05 0.00 3.41 -1.26 -3.76 113.62 113.65 1okd n SER 38 Ca -0.11 -1.96 -0.05 0.00 -0.26 0.00 0.00 58.87 56.50 1okd n SER 38 Cb 0.61 -0.22 -0.08 0.00 -0.26 0.00 0.00 64.21 64.26 1okd n SER 38 CO 0.00 0.00 0.00 -2.67 -0.16 0.00 0.00 175.04 172.21 1okd n TRP 39 N 0.50 0.00 -2.02 7.33 4.27 -1.26 -4.95 117.44 121.31 1okd n TRP 39 Ca 0.12 0.00 -0.43 0.00 -3.89 0.00 0.00 57.50 53.31 1okd n TRP 39 Cb 0.30 -0.50 -0.03 0.00 -1.36 0.00 0.00 31.31 29.72 1okd n TRP 39 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1okd h PRO 41 N 11.11 0.44 -0.50 0.00 0.11 -1.92 -1.95 132.00 139.29 1okd h PRO 41 Ca -0.36 -0.03 0.05 0.00 0.11 0.00 0.00 66.00 65.78 1okd h PRO 41 Cb 1.17 -0.10 -0.05 0.00 0.11 0.00 0.00 31.00 32.13 1okd h PRO 41 CO 0.99 0.29 0.22 -1.35 -0.21 0.00 0.00 178.00 177.94 1okd h PRO 42 N 0.45 0.43 -0.08 1.05 0.11 -1.97 -0.64 132.00 131.35 1okd h PRO 42 Ca 0.44 -0.03 0.02 0.00 0.11 0.00 0.00 66.00 66.55 1okd h PRO 42 Cb 0.69 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 31.70 1okd h PRO 42 CO -0.42 0.28 0.20 0.00 -0.21 0.00 0.00 178.00 177.85 1okd h ARG 44 N 0.00 0.47 0.00 0.00 1.12 -1.04 -3.33 114.38 111.60 1okd h ARG 44 Ca 0.04 -0.03 0.00 0.00 -1.11 0.00 0.00 59.98 58.88 1okd h ARG 44 Cb 0.45 -0.11 0.00 0.00 -0.01 0.00 0.00 29.97 30.30 1okd h ARG 44 CO -0.00 0.31 0.00 0.41 -3.11 0.00 0.00 179.97 177.58 1okd n GLY 45 N -1.23 -1.36 3.61 2.80 0.00 -0.66 -4.63 105.19 103.71 1okd n GLY 45 Ca 0.03 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.61 1okd n GLY 45 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1okd n PHE 46 N -0.77 2.10 0.07 1.61 7.35 -1.24 -4.31 117.46 122.27 1okd n PHE 46 Ca 0.00 -0.16 0.00 0.00 -0.76 0.00 0.00 57.45 56.53 1okd n PHE 46 Cb 0.00 -2.73 0.00 0.00 0.35 0.00 0.00 39.48 37.10 1okd n PHE 46 CO 0.00 0.00 0.00 2.41 -0.76 0.00 0.00 176.76 178.41 1okd n THR 47 N 7.00 0.00 1.10 -2.13 -1.04 -1.26 -4.78 114.28 113.18 1okd n THR 47 Ca 0.28 0.00 0.03 0.00 -2.04 0.00 0.00 64.05 62.32 1okd n THR 47 Cb 0.41 0.00 0.18 0.00 -1.82 0.00 0.00 70.33 69.10 1okd n THR 47 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1okd n PRO 48 N -3.01 0.55 0.08 -2.82 -0.04 -1.26 -2.99 135.00 125.51 1okd n PRO 48 Ca 0.00 0.00 -0.17 0.00 -0.04 0.00 0.00 63.50 63.29 1okd n PRO 48 Cb 0.00 -1.17 -0.09 0.00 -0.04 0.00 0.00 33.50 32.20 1okd n PRO 48 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 1okd h GLN 49 N 0.00 0.50 -0.08 0.54 7.50 -1.92 -3.13 115.11 118.51 1okd h GLN 49 Ca 0.00 -0.61 -0.00 0.00 0.50 0.00 0.00 58.65 58.54 1okd h GLN 49 Cb 0.00 0.19 -0.00 0.00 0.05 0.00 0.00 27.48 27.72 1okd h GLN 49 CO 0.00 1.24 0.04 1.25 -1.50 0.00 0.00 178.83 179.86 1okd h LEU 50 N 0.25 0.11 -0.55 1.46 7.12 -1.92 0.28 115.31 122.06 1okd h LEU 50 Ca -0.13 -0.09 0.04 0.00 0.13 0.00 0.00 57.88 57.83 1okd h LEU 50 Cb 1.75 -0.03 -0.04 0.00 -0.53 0.00 0.00 40.66 41.81 1okd h LEU 50 CO 0.20 0.17 0.30 0.40 -0.13 0.00 0.00 178.44 179.38 1okd h ILE 51 N 0.04 0.99 0.06 4.05 2.04 -1.76 0.98 117.51 123.92 1okd h ILE 51 Ca 0.03 -0.20 -0.00 0.00 1.00 0.00 0.00 64.86 65.69 1okd h ILE 51 Cb 0.09 0.36 0.00 0.00 -0.74 0.00 0.00 36.82 36.53 1okd h ILE 51 CO -0.00 0.11 -0.03 -0.08 0.00 0.00 0.00 178.15 178.14 1okd h GLU 52 N 0.58 -0.08 0.00 2.37 4.57 -1.47 1.03 114.58 121.58 1okd h GLU 52 Ca 0.23 0.01 -0.05 0.00 -1.18 0.00 0.00 59.36 58.37 1okd h GLU 52 Cb 0.10 0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 28.70 1okd h GLU 52 CO -0.14 0.35 -0.26 0.35 -1.18 0.00 0.00 179.01 178.13 1okd h PHE 53 N -0.52 0.00 0.00 0.92 3.04 -0.80 -1.52 116.94 118.07 1okd h PHE 53 Ca -0.01 0.00 -0.05 0.00 3.98 0.00 0.00 57.97 61.89 1okd h PHE 53 Cb 0.46 0.00 -0.01 0.00 2.56 0.00 0.00 35.95 38.96 1okd h PHE 53 CO 0.07 0.26 -0.47 -0.92 -2.02 0.00 0.00 178.31 175.23 1okd h TYR 54 N 0.00 0.00 -0.19 0.41 5.03 0.11 -3.00 116.97 119.32 1okd h TYR 54 Ca -0.00 0.00 0.06 0.00 2.58 0.00 0.00 58.73 61.36 1okd h TYR 54 Cb 0.48 0.00 -0.01 0.00 1.55 0.00 0.00 36.73 38.76 1okd h TYR 54 CO 0.00 0.49 0.19 0.22 -1.32 0.00 0.00 178.16 177.74 1okd h ASP 55 N -1.00 0.00 0.36 -2.11 1.82 0.11 2.06 116.42 117.65 1okd h ASP 55 Ca -0.08 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.56 1okd h ASP 55 Cb 0.63 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.64 1okd h ASP 55 CO -0.05 0.00 -0.87 0.29 -1.61 0.00 0.00 179.24 177.00 1okd n LYS 56 N -3.98 0.14 0.00 0.28 4.76 -0.57 -4.43 118.16 114.36 1okd n LYS 56 Ca 0.02 -0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.46 1okd n LYS 56 Cb 0.32 -1.55 0.00 0.00 -1.84 0.00 0.00 35.03 31.96 1okd n LYS 56 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1okd n PHE 57 N -1.73 0.00 -0.35 2.13 7.35 -0.42 -4.84 117.46 119.61 1okd n PHE 57 Ca 0.03 -0.03 -0.00 0.00 -0.76 0.00 0.00 57.45 56.69 1okd n PHE 57 Cb 0.38 -0.00 0.15 0.00 0.35 0.00 0.00 39.48 40.36 1okd n PHE 57 CO 0.00 0.00 0.00 1.12 -0.76 0.00 0.00 176.76 177.12 1okd h HIS 58 N 0.00 1.20 0.00 -5.13 2.07 0.31 0.45 115.15 114.04 1okd h HIS 58 Ca 0.00 0.03 -0.10 0.00 -2.85 0.00 0.00 60.37 57.45 1okd h HIS 58 Cb 0.52 -0.40 -0.01 0.00 2.57 0.00 0.00 27.41 30.08 1okd h HIS 58 CO 0.00 0.72 -0.45 0.93 -3.07 0.00 0.00 177.93 176.06 1okd h GLU 59 N 1.26 0.00 0.02 5.12 5.08 -1.88 0.93 114.58 125.12 1okd h GLU 59 Ca 0.37 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.55 1okd h GLU 59 Cb -0.06 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.17 1okd h GLU 59 CO -0.10 0.45 -0.96 0.66 -1.00 0.00 0.00 179.01 178.07 1okd h SER 60 N 0.00 0.06 1.00 1.42 4.64 -1.69 -3.38 113.55 115.60 1okd h SER 60 Ca -0.00 -0.70 -0.18 0.00 -0.47 0.00 0.00 61.79 60.43 1okd h SER 60 Cb 0.81 -0.02 -0.03 0.00 -0.31 0.00 0.00 62.40 62.85 1okd h SER 60 CO 0.06 1.39 -1.06 0.50 -0.87 0.00 0.00 176.83 176.84 1okd h LYS 61 N -0.88 0.00 -6.01 4.77 1.63 -0.21 -3.49 116.57 112.39 1okd h LYS 61 Ca -0.25 0.00 -0.22 0.00 -0.85 0.00 0.00 60.65 59.33 1okd h LYS 61 Cb 1.31 0.00 0.01 0.00 -0.60 0.00 0.00 32.23 32.94 1okd h LYS 61 CO -0.11 0.60 -0.87 -1.71 -3.45 0.00 0.00 179.45 173.91 1okd n ASN 62 N -3.15 -6.56 -4.24 4.20 2.85 0.32 -4.94 115.26 103.74 1okd n ASN 62 Ca -0.04 0.09 -0.17 0.00 -0.11 0.00 0.00 54.58 54.35 1okd n ASN 62 Cb 0.87 -3.32 -0.10 0.00 1.24 0.00 0.00 39.78 38.48 1okd n ASN 62 CO 0.00 0.00 0.00 0.72 -2.11 0.00 0.00 177.26 175.87 1okd s PHE 63 N -2.07 1.52 -0.07 1.20 -0.12 -1.26 -4.48 117.98 112.70 1okd s PHE 63 Ca 0.30 -1.24 0.02 0.00 -0.05 0.00 0.00 56.93 55.96 1okd s PHE 63 Cb -0.05 -0.86 0.02 0.00 -0.63 0.00 0.00 43.02 41.49 1okd s PHE 63 CO 0.83 -0.40 -0.10 -2.00 -0.05 0.00 0.00 175.22 173.50 1okd s GLU 64 N -4.00 1.49 -0.33 1.99 2.56 -0.77 -5.00 118.70 114.64 1okd s GLU 64 Ca 0.37 -0.33 -0.10 0.00 0.00 0.00 0.00 54.97 54.91 1okd s GLU 64 Cb 0.07 -1.30 0.00 0.00 2.00 0.00 0.00 34.13 34.90 1okd s GLU 64 CO 0.14 -0.03 0.18 0.08 -0.56 0.00 0.00 175.26 175.07 1okd s VAL 65 N 0.83 4.67 -0.07 3.70 1.01 -1.26 -0.18 120.40 129.09 1okd s VAL 65 Ca -0.12 -0.51 -0.19 0.00 0.00 0.00 0.00 61.98 61.16 1okd s VAL 65 Cb -0.15 -3.44 -0.05 0.00 0.00 0.00 0.00 36.38 32.74 1okd s VAL 65 CO 0.02 -0.02 0.52 0.68 0.00 0.00 0.00 175.10 176.30 1okd s VAL 66 N 1.61 5.09 0.10 2.92 -7.23 0.13 -3.03 120.40 119.99 1okd s VAL 66 Ca 0.04 1.06 -0.30 0.00 -1.81 0.00 0.00 61.98 60.97 1okd s VAL 66 Cb -0.18 -3.86 -0.07 0.00 0.56 0.00 0.00 36.38 32.84 1okd s VAL 66 CO 0.07 0.37 1.23 0.12 -0.31 0.00 0.00 175.10 176.57 1okd s PHE 67 N 0.26 3.41 -0.16 2.82 2.19 0.49 -3.08 117.98 123.91 1okd s PHE 67 Ca 0.28 1.28 -0.02 0.00 0.33 0.00 0.00 56.93 58.80 1okd s PHE 67 Cb -0.16 -3.46 0.05 0.00 -1.31 0.00 0.00 43.02 38.13 1okd s PHE 67 CO 0.13 -1.42 0.01 0.00 1.83 0.00 0.00 175.22 175.77 1okd s THR 69 N 1.86 2.19 -0.36 0.00 -1.32 -1.26 -1.65 115.64 115.10 1okd s THR 69 Ca 0.01 -0.22 0.13 0.00 -1.21 0.00 0.00 61.69 60.40 1okd s THR 69 Cb -0.15 -2.96 0.42 0.00 -1.51 0.00 0.00 72.50 68.29 1okd s THR 69 CO -0.07 0.00 1.31 0.79 -2.21 0.00 0.00 174.62 174.44 1okd n TRP 70 N -3.08 -1.38 -4.42 9.09 7.02 0.35 -4.33 117.44 120.69 1okd n TRP 70 Ca 0.09 -2.04 -0.21 0.00 -1.02 0.00 0.00 57.50 54.32 1okd n TRP 70 Cb 0.60 1.07 -0.10 0.00 -2.42 0.00 0.00 31.31 30.46 1okd n TRP 70 CO 0.00 0.00 0.00 0.34 -2.02 0.00 0.00 177.69 176.01 1okd s ASP 71 N -1.77 2.98 -0.10 -0.99 2.15 -1.26 -4.45 116.67 113.23 1okd s ASP 71 Ca 0.20 -1.11 0.19 0.00 0.43 0.00 0.00 52.55 52.26 1okd s ASP 71 Cb 0.42 -0.21 0.70 0.00 -0.30 0.00 0.00 42.92 43.53 1okd s ASP 71 CO -0.07 -0.20 1.61 -0.62 -0.17 0.00 0.00 175.17 175.72 1okd n GLU 72 N -0.55 3.58 -4.77 4.34 4.71 -1.26 -4.90 120.64 121.78 1okd n GLU 72 Ca -0.06 -2.85 -0.26 0.00 -0.01 0.00 0.00 57.16 53.99 1okd n GLU 72 Cb 0.62 -1.84 -0.16 0.00 -1.01 0.00 0.00 31.44 29.05 1okd n GLU 72 CO 0.00 0.00 0.00 -2.00 0.09 0.00 0.00 177.13 175.22 1okd s GLU 73 N -1.73 1.74 0.36 3.49 2.12 -1.26 -5.02 118.70 118.40 1okd s GLU 73 Ca 0.50 -0.56 0.18 0.00 0.36 0.00 0.00 54.97 55.45 1okd s GLU 73 Cb 0.32 -1.50 0.60 0.00 0.26 0.00 0.00 34.13 33.81 1okd s GLU 73 CO 0.25 0.20 1.70 0.93 -0.54 0.00 0.00 175.26 177.80 1okd h GLU 74 N 6.38 0.00 0.00 4.30 5.08 -2.01 -2.98 114.58 125.35 1okd h GLU 74 Ca -0.32 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 57.93 1okd h GLU 74 Cb 1.18 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.41 1okd h GLU 74 CO 0.48 0.40 -0.53 -0.44 -1.00 0.00 0.00 179.01 177.92 1okd h ASP 75 N 0.00 0.00 0.12 1.42 3.32 -2.00 -3.05 116.42 116.24 1okd h ASP 75 Ca -0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 1okd h ASP 75 Cb 0.96 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.51 1okd h ASP 75 CO 0.05 0.53 -0.06 1.23 -1.72 0.00 0.00 179.24 179.27 1okd h GLY 76 N 2.68 -0.17 0.52 2.75 0.00 -1.95 -2.85 103.07 104.05 1okd h GLY 76 Ca -0.01 0.06 0.11 0.00 0.00 0.00 0.00 47.33 47.50 1okd h GLY 76 CO 0.07 -0.06 0.62 0.27 0.00 0.00 0.00 176.54 177.44 1okd h PHE 77 N -0.97 1.14 0.36 5.60 -0.00 -1.66 0.16 116.94 121.57 1okd h PHE 77 Ca -0.02 0.03 -0.02 0.00 -0.00 0.00 0.00 57.97 57.97 1okd h PHE 77 Cb 0.44 -0.36 0.00 0.00 -0.00 0.00 0.00 35.95 36.03 1okd h PHE 77 CO 0.08 0.48 -0.17 0.00 -0.00 0.00 0.00 178.31 178.70 1okd h ALA 78 N 1.52 -0.48 0.00 12.09 0.00 -1.64 0.47 119.26 131.21 1okd h ALA 78 Ca 0.48 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.25 1okd h ALA 78 Cb 0.42 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1okd h ALA 78 CO -0.25 -0.72 0.00 0.41 0.00 0.00 0.00 179.25 178.69 1okd n GLY 79 N -1.03 -1.04 0.11 0.00 0.00 -0.98 -1.02 105.19 101.23 1okd n GLY 79 Ca -0.10 0.14 0.03 0.00 0.00 0.00 0.00 46.02 46.09 1okd n GLY 79 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1okd h TYR 80 N 0.00 0.00 0.00 1.61 3.20 0.81 -3.32 116.97 119.27 1okd h TYR 80 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1okd h TYR 80 Cb 0.17 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.44 1okd h TYR 80 CO 0.00 0.42 0.00 1.97 -1.64 0.00 0.00 178.16 178.91 1okd n PHE 81 N -2.88 0.59 -0.35 -3.82 1.16 0.15 -3.73 117.46 108.58 1okd n PHE 81 Ca -0.06 0.18 0.14 0.00 -1.87 0.00 0.00 57.45 55.84 1okd n PHE 81 Cb 0.75 -0.79 0.34 0.00 -1.61 0.00 0.00 39.48 38.18 1okd n PHE 81 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1okd h ALA 82 N 2.66 1.71 -2.48 1.98 0.00 -1.64 -3.39 119.26 118.09 1okd h ALA 82 Ca 0.00 0.09 -0.48 0.00 0.00 0.00 0.00 54.91 54.52 1okd h ALA 82 Cb 0.62 -0.06 0.02 0.00 0.00 0.00 0.00 17.79 18.38 1okd h ALA 82 CO 0.00 -0.11 0.41 0.15 0.00 0.00 0.00 179.25 179.70 1okd s LYS 83 N -5.83 4.09 0.00 0.00 -0.14 -1.24 -4.49 119.74 112.12 1okd s LYS 83 Ca -0.11 1.49 0.00 0.00 -1.36 0.00 0.00 55.97 55.99 1okd s LYS 83 Cb 0.26 -2.46 0.00 0.00 -1.68 0.00 0.00 37.83 33.94 1okd s LYS 83 CO 0.80 -0.20 0.00 0.00 -0.76 0.00 0.00 175.35 175.19 1okd n MET 84 N -0.24 -0.07 0.00 1.68 0.00 -1.26 -4.82 117.12 112.41 1okd n MET 84 Ca 0.06 0.16 0.14 0.00 0.00 0.00 0.00 57.70 58.05 1okd n MET 84 Cb 0.50 -0.18 0.54 0.00 0.00 0.00 0.00 33.22 34.08 1okd n MET 84 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 175.97 175.62 1okd n PRO 85 N 0.72 0.20 0.00 3.17 -0.04 -1.26 -4.71 135.00 133.07 1okd n PRO 85 Ca 0.00 -0.06 0.00 0.00 -0.04 0.00 0.00 63.50 63.40 1okd n PRO 85 Cb 0.09 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.05 1okd n PRO 85 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1okd n TRP 86 N -1.35 0.00 -3.83 0.54 2.14 -1.26 -3.18 117.44 110.50 1okd n TRP 86 Ca 0.09 0.00 -0.13 0.00 2.07 0.00 0.00 57.50 59.53 1okd n TRP 86 Cb 0.31 0.00 -0.14 0.00 -0.81 0.00 0.00 31.31 30.67 1okd n TRP 86 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 1okd s LEU 87 N -1.09 1.63 0.05 5.67 1.43 -1.17 -4.44 118.68 120.75 1okd s LEU 87 Ca 0.00 0.05 -0.08 0.00 -1.03 0.00 0.00 54.13 53.06 1okd s LEU 87 Cb 0.00 0.04 -0.00 0.00 0.03 0.00 0.00 46.19 46.25 1okd s LEU 87 CO 0.00 -0.05 0.17 0.00 0.23 0.00 0.00 176.35 176.70 1okd s ALA 88 N 0.37 -0.27 -0.27 4.21 0.00 -1.26 0.18 121.76 124.73 1okd s ALA 88 Ca -0.03 -0.40 -0.16 0.00 0.00 0.00 0.00 51.96 51.37 1okd s ALA 88 Cb -0.04 0.30 -0.03 0.00 0.00 0.00 0.00 23.12 23.35 1okd s ALA 88 CO -0.01 -0.37 0.42 0.08 0.00 0.00 0.00 175.76 175.87 1okd s VAL 89 N -2.78 5.14 0.69 0.00 1.01 -1.20 0.17 120.40 123.43 1okd s VAL 89 Ca -0.03 0.67 -0.16 0.00 0.00 0.00 0.00 61.98 62.46 1okd s VAL 89 Cb -0.00 -3.74 0.02 0.00 0.00 0.00 0.00 36.38 32.66 1okd s VAL 89 CO -0.05 0.13 1.23 -2.16 0.00 0.00 0.00 175.10 174.25 1okd s PRO 90 N 2.15 2.34 0.56 2.72 0.04 -1.26 -4.83 135.00 136.71 1okd s PRO 90 Ca 0.17 1.86 0.34 0.00 0.04 0.00 0.00 61.00 63.41 1okd s PRO 90 Cb -0.16 -1.85 1.47 0.00 0.04 0.00 0.00 34.50 34.01 1okd s PRO 90 CO 0.10 -1.71 1.77 0.35 0.04 0.00 0.00 177.00 177.55 1okd h PHE 91 N 0.07 0.00 -0.95 0.56 3.57 -1.99 0.11 116.94 118.31 1okd h PHE 91 Ca -0.49 0.00 0.19 0.00 3.53 0.00 0.00 57.97 61.20 1okd h PHE 91 Cb 1.31 0.00 -0.08 0.00 2.79 0.00 0.00 35.95 39.97 1okd h PHE 91 CO 0.45 0.00 0.61 0.00 -2.23 0.00 0.00 178.31 177.14 1okd h ALA 92 N 1.31 1.97 -0.39 2.41 0.00 -1.98 0.15 119.26 122.73 1okd h ALA 92 Ca 0.48 0.04 -0.12 0.00 0.00 0.00 0.00 54.91 55.32 1okd h ALA 92 Cb 2.12 -0.06 -0.07 0.00 0.00 0.00 0.00 17.79 19.78 1okd h ALA 92 CO -0.01 -0.28 0.04 1.04 0.00 0.00 0.00 179.25 180.04 1okd n GLN 93 N -4.61 2.60 -0.02 0.00 6.02 0.38 -4.63 117.38 117.14 1okd n GLN 93 Ca 0.21 -3.00 0.04 0.00 -0.01 0.00 0.00 57.00 54.24 1okd n GLN 93 Cb 0.63 -1.90 0.42 0.00 1.02 0.00 0.00 30.24 30.41 1okd n GLN 93 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1okd h SER 94 N 1.58 0.48 -0.58 1.08 4.64 -0.92 -0.78 113.55 119.06 1okd h SER 94 Ca 0.14 -0.01 0.17 0.00 -0.47 0.00 0.00 61.79 61.62 1okd h SER 94 Cb 1.70 -0.12 -0.02 0.00 -0.31 0.00 0.00 62.40 63.65 1okd h SER 94 CO 0.39 0.35 0.43 -0.08 -0.87 0.00 0.00 176.83 177.05 1okd h GLU 95 N 0.57 0.00 -0.48 4.77 4.81 -1.82 0.10 114.58 122.54 1okd h GLU 95 Ca 0.16 0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 59.28 1okd h GLU 95 Cb -0.03 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.33 1okd h GLU 95 CO -0.04 0.00 -0.17 0.00 -0.73 0.00 0.00 179.01 178.07 1okd h ALA 96 N 1.69 0.79 -0.74 2.92 0.00 -1.50 -3.06 119.26 119.35 1okd h ALA 96 Ca 0.28 -0.37 0.07 0.00 0.00 0.00 0.00 54.91 54.88 1okd h ALA 96 Cb 1.14 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 18.71 1okd h ALA 96 CO -0.00 0.66 0.49 0.28 0.00 0.00 0.00 179.25 180.67 1okd h VAL 97 N 0.82 1.02 -0.15 0.00 2.07 -0.86 1.83 116.25 120.99 1okd h VAL 97 Ca 0.12 -0.27 -0.17 0.00 0.82 0.00 0.00 66.70 67.20 1okd h VAL 97 Cb 0.73 0.17 0.01 0.00 -1.52 0.00 0.00 31.29 30.68 1okd h VAL 97 CO 0.06 0.14 -0.59 0.06 0.02 0.00 0.00 177.57 177.26 1okd h GLN 98 N 0.78 0.66 0.08 1.57 3.07 -1.52 -3.18 115.11 116.56 1okd h GLN 98 Ca 0.32 -0.51 -0.27 0.00 0.09 0.00 0.00 58.65 58.28 1okd h GLN 98 Cb 0.26 0.10 -0.01 0.00 0.08 0.00 0.00 27.48 27.91 1okd h GLN 98 CO -0.11 1.13 -1.28 0.87 0.09 0.00 0.00 178.83 179.53 1okd h LYS 99 N 0.33 0.17 -0.83 0.06 1.79 -1.34 -3.33 116.57 113.42 1okd h LYS 99 Ca -0.03 -0.29 0.11 0.00 -2.18 0.00 0.00 60.65 58.26 1okd h LYS 99 Cb 1.22 0.11 -0.08 0.00 -1.58 0.00 0.00 32.23 31.90 1okd h LYS 99 CO 0.12 1.07 0.46 1.25 -1.08 0.00 0.00 179.45 181.27 1okd h LEU 100 N 0.05 0.62 -1.17 2.94 5.85 0.27 -0.78 115.31 123.09 1okd h LEU 100 Ca -0.14 0.06 0.03 0.00 0.84 0.00 0.00 57.88 58.67 1okd h LEU 100 Cb 1.93 -0.05 -0.05 0.00 0.37 0.00 0.00 40.66 42.86 1okd h LEU 100 CO 0.16 0.33 0.57 0.77 -0.34 0.00 0.00 178.44 179.94 1okd h SER 101 N 0.73 0.94 -0.19 1.25 4.64 -1.66 -1.14 113.55 118.13 1okd h SER 101 Ca 0.41 -0.01 0.05 0.00 -0.47 0.00 0.00 61.79 61.78 1okd h SER 101 Cb 0.45 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 62.31 1okd h SER 101 CO -0.28 0.65 0.14 0.50 -0.87 0.00 0.00 176.83 176.98 1okd h LYS 102 N 1.10 0.00 -0.10 4.77 1.63 -1.28 -0.78 116.57 121.91 1okd h LYS 102 Ca 0.34 0.00 -0.20 0.00 -0.85 0.00 0.00 60.65 59.93 1okd h LYS 102 Cb -0.01 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.63 1okd h LYS 102 CO -0.10 0.00 -0.77 1.25 -3.45 0.00 0.00 179.45 176.38 1okd h HIS 103 N 0.00 0.75 -0.41 1.91 2.76 -1.14 -3.06 115.15 115.96 1okd h HIS 103 Ca 0.09 -0.34 0.00 0.00 -2.20 0.00 0.00 60.37 57.92 1okd h HIS 103 Cb 0.38 -0.11 0.00 0.00 1.55 0.00 0.00 27.41 29.23 1okd h HIS 103 CO 0.00 1.13 0.00 1.19 -1.30 0.00 0.00 177.93 178.95 1okd n PHE 104 N -3.87 0.75 -2.67 5.26 3.72 -0.41 -4.90 117.46 115.34 1okd n PHE 104 Ca -0.06 -0.33 -0.16 0.00 -0.05 0.00 0.00 57.45 56.85 1okd n PHE 104 Cb 0.74 -0.09 -0.00 0.00 -0.94 0.00 0.00 39.48 39.18 1okd n PHE 104 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 1okd n ASN 105 N 0.67 -4.34 -4.54 4.37 4.05 -0.55 -4.79 115.26 110.13 1okd n ASN 105 Ca 0.15 0.01 -0.33 0.00 0.45 0.00 0.00 54.58 54.86 1okd n ASN 105 Cb 0.48 -3.63 -0.06 0.00 1.23 0.00 0.00 39.78 37.80 1okd n ASN 105 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 177.26 174.73 1okd n VAL 106 N -3.68 -0.06 -0.03 3.44 0.31 -0.54 -4.80 118.33 112.96 1okd n VAL 106 Ca -0.13 -0.65 -0.08 0.00 -0.01 0.00 0.00 64.34 63.47 1okd n VAL 106 Cb 0.61 -2.32 -0.02 0.00 -0.91 0.00 0.00 33.84 31.20 1okd n VAL 106 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 1okd h GLU 107 N 17.52 -0.08 -1.55 5.55 4.57 -1.90 -3.46 114.58 135.23 1okd h GLU 107 Ca -0.18 0.01 0.09 0.00 -1.18 0.00 0.00 59.36 58.10 1okd h GLU 107 Cb 1.24 0.02 -0.23 0.00 -0.16 0.00 0.00 28.75 29.62 1okd h GLU 107 CO 1.18 -0.05 0.56 -1.12 -1.18 0.00 0.00 179.01 178.41 1okd s SER 108 N -5.14 -0.35 0.59 1.04 0.01 -1.26 -5.17 113.70 103.41 1okd s SER 108 Ca -0.14 0.38 -0.10 0.00 1.31 0.00 0.00 55.95 57.40 1okd s SER 108 Cb 0.11 0.29 -0.04 0.00 0.21 0.00 0.00 66.02 66.59 1okd s SER 108 CO 0.68 -0.33 0.99 0.27 0.41 0.00 0.00 173.24 175.26 1okd s ILE 109 N -1.14 4.74 0.50 1.44 -5.25 -1.26 -4.46 121.20 115.77 1okd s ILE 109 Ca -0.01 0.76 -0.17 0.00 -0.99 0.00 0.00 60.65 60.24 1okd s ILE 109 Cb -0.00 -3.87 -0.08 0.00 2.95 0.00 0.00 42.46 41.45 1okd s ILE 109 CO 0.01 -1.09 0.97 -2.16 -1.79 0.00 0.00 174.94 170.88 1okd s PRO 110 N -5.09 3.99 0.29 0.37 0.04 -1.26 -4.95 135.00 128.39 1okd s PRO 110 Ca 0.54 0.97 -0.06 0.00 0.04 0.00 0.00 61.00 62.49 1okd s PRO 110 Cb -0.11 -2.15 -0.01 0.00 0.04 0.00 0.00 34.50 32.27 1okd s PRO 110 CO 0.52 -0.22 0.42 -0.08 0.04 0.00 0.00 177.00 177.68 1okd s THR 111 N -2.54 0.00 -0.11 1.26 -1.32 -0.33 -5.03 115.64 107.58 1okd s THR 111 Ca 0.59 -1.60 -0.08 0.00 -1.21 0.00 0.00 61.69 59.40 1okd s THR 111 Cb -0.10 -2.47 0.03 0.00 -1.51 0.00 0.00 72.50 68.46 1okd s THR 111 CO 0.28 0.00 0.27 -0.22 -2.21 0.00 0.00 174.62 172.74 1okd s LEU 112 N -3.15 0.72 0.13 9.08 2.96 -1.26 -1.90 118.68 125.26 1okd s LEU 112 Ca 0.29 0.55 0.05 0.00 -0.22 0.00 0.00 54.13 54.80 1okd s LEU 112 Cb 0.01 0.87 -0.04 0.00 0.50 0.00 0.00 46.19 47.53 1okd s LEU 112 CO 0.15 -0.12 -0.12 -0.51 -1.32 0.00 0.00 176.35 174.43 1okd s ILE 113 N 0.61 1.20 -0.03 6.68 1.10 -0.02 -1.58 121.20 129.16 1okd s ILE 113 Ca -0.04 -1.86 0.02 0.00 -0.51 0.00 0.00 60.65 58.26 1okd s ILE 113 Cb -0.05 -1.64 0.01 0.00 0.15 0.00 0.00 42.46 40.93 1okd s ILE 113 CO -0.04 -0.59 -0.06 -0.83 -2.11 0.00 0.00 174.94 171.31 1okd s GLY 114 N -2.78 0.44 0.12 1.50 0.00 -1.25 0.12 107.32 105.47 1okd s GLY 114 Ca 0.12 -0.18 0.03 0.00 0.00 0.00 0.00 44.72 44.69 1okd s GLY 114 CO 0.02 0.13 -0.09 -1.34 0.00 0.00 0.00 173.10 171.81 1okd s VAL 115 N 0.45 0.97 -0.37 1.40 -7.23 -0.74 -1.84 120.40 113.04 1okd s VAL 115 Ca -0.06 -1.94 -0.10 0.00 -1.81 0.00 0.00 61.98 58.06 1okd s VAL 115 Cb -0.10 -1.70 0.03 0.00 0.56 0.00 0.00 36.38 35.17 1okd s VAL 115 CO 0.00 -0.75 0.20 1.51 -0.31 0.00 0.00 175.10 175.75 1okd s ASP 116 N -2.99 5.69 0.25 4.85 1.47 -0.82 -0.33 116.67 124.80 1okd s ASP 116 Ca 0.13 -1.02 -0.04 0.00 1.18 0.00 0.00 52.55 52.80 1okd s ASP 116 Cb 0.02 -2.01 0.30 0.00 -0.34 0.00 0.00 42.92 40.90 1okd s ASP 116 CO -0.01 -0.38 1.83 0.00 0.68 0.00 0.00 175.17 177.28 1okd h ALA 117 N 8.41 1.17 0.65 2.11 0.00 -1.59 0.88 119.26 130.89 1okd h ALA 117 Ca -0.25 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.45 1okd h ALA 117 Cb 1.10 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1okd h ALA 117 CO 0.66 0.60 -0.34 0.22 0.00 0.00 0.00 179.25 180.38 1okd h ASP 118 N 1.00 -0.84 -0.13 0.00 3.58 -1.80 -3.22 116.42 115.01 1okd h ASP 118 Ca 0.23 0.04 -0.12 0.00 0.42 0.00 0.00 57.03 57.60 1okd h ASP 118 Cb 0.20 0.23 0.00 0.00 1.72 0.00 0.00 39.33 41.49 1okd h ASP 118 CO -0.02 -0.56 -0.40 -1.28 -2.88 0.00 0.00 179.24 174.09 1okd h SER 119 N -0.92 0.58 -1.68 2.28 0.87 -1.93 -3.36 113.55 109.39 1okd h SER 119 Ca -0.08 -0.60 0.00 0.00 -1.23 0.00 0.00 61.79 59.88 1okd h SER 119 Cb 0.72 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 62.51 1okd h SER 119 CO 0.12 1.08 0.00 0.61 -0.53 0.00 0.00 176.83 178.11 1okd n GLY 120 N 0.57 0.50 3.61 5.77 0.00 0.30 -4.32 105.19 111.62 1okd n GLY 120 Ca -0.07 -0.47 0.04 0.00 0.00 0.00 0.00 46.02 45.51 1okd n GLY 120 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1okd s ASP 121 N -2.24 -0.00 -0.07 1.61 -4.77 -1.18 -4.45 116.67 105.57 1okd s ASP 121 Ca 0.00 -0.01 -0.30 0.00 -3.30 0.00 0.00 52.55 48.94 1okd s ASP 121 Cb 0.00 0.02 -0.02 0.00 -1.09 0.00 0.00 42.92 41.83 1okd s ASP 121 CO 0.00 -0.03 0.99 -0.69 0.70 0.00 0.00 175.17 176.14 1okd s VAL 122 N -2.04 4.82 -0.50 2.11 1.01 -1.26 -1.94 120.40 122.60 1okd s VAL 122 Ca 0.17 2.05 0.10 0.00 0.00 0.00 0.00 61.98 64.29 1okd s VAL 122 Cb 0.07 -4.31 -0.10 0.00 0.00 0.00 0.00 36.38 32.03 1okd s VAL 122 CO -0.06 0.07 0.44 0.52 0.00 0.00 0.00 175.10 176.06 1okd n VAL 123 N 4.30 0.00 -3.94 2.92 0.31 -0.84 -4.94 118.33 116.14 1okd n VAL 123 Ca 0.08 -0.27 -0.08 0.00 -0.01 0.00 0.00 64.34 64.05 1okd n VAL 123 Cb 0.50 1.01 -0.04 0.00 -0.91 0.00 0.00 33.84 34.39 1okd n VAL 123 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1okd s THR 124 N -1.91 0.00 0.21 2.52 -1.32 -0.77 -3.02 115.64 111.37 1okd s THR 124 Ca 0.04 -1.25 0.00 0.00 -1.21 0.00 0.00 61.69 59.27 1okd s THR 124 Cb 0.08 -2.10 0.00 0.00 -1.51 0.00 0.00 72.50 68.96 1okd s THR 124 CO 0.40 -0.01 0.00 0.35 -2.21 0.00 0.00 174.62 173.15 1okd n THR 125 N -0.40 0.00 -1.12 5.08 -2.24 -1.26 -3.89 114.28 110.44 1okd n THR 125 Ca -0.03 0.00 -0.16 0.00 -2.27 0.00 0.00 64.05 61.59 1okd n THR 125 Cb 0.61 -0.40 -0.14 0.00 -2.10 0.00 0.00 70.33 68.29 1okd n THR 125 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 1okd n ARG 126 N -3.13 2.15 0.00 -0.78 0.00 -1.26 -4.25 116.66 109.39 1okd n ARG 126 Ca 0.00 -1.33 0.11 0.00 -0.00 0.00 0.00 57.85 56.63 1okd n ARG 126 Cb 0.00 -2.06 0.59 0.00 -0.00 0.00 0.00 32.46 30.99 1okd n ARG 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1okd n ALA 127 N 2.19 2.21 0.01 2.89 0.00 -0.61 -2.96 120.51 124.22 1okd n ALA 127 Ca 0.45 -0.12 -0.18 0.00 0.00 0.00 0.00 53.44 53.60 1okd n ALA 127 Cb 0.82 -1.35 -0.11 0.00 0.00 0.00 0.00 19.45 18.81 1okd n ALA 127 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 1okd h ARG 128 N 0.00 0.45 0.17 0.00 -0.00 -1.79 -2.60 114.38 110.61 1okd h ARG 128 Ca 0.00 -0.48 -0.34 0.00 -0.00 0.00 0.00 59.98 59.17 1okd h ARG 128 Cb 0.10 0.13 0.01 0.00 -0.00 0.00 0.00 29.97 30.20 1okd h ARG 128 CO 0.00 1.13 -1.66 0.00 -0.00 0.00 0.00 179.97 179.43 1okd h ALA 129 N 0.34 0.18 -0.21 0.08 0.00 -1.93 -3.37 119.26 114.36 1okd h ALA 129 Ca -0.08 -1.12 -0.11 0.00 0.00 0.00 0.00 54.91 53.60 1okd h ALA 129 Cb 1.35 0.38 -0.00 0.00 0.00 0.00 0.00 17.79 19.52 1okd h ALA 129 CO 0.13 1.05 -0.30 1.79 0.00 0.00 0.00 179.25 181.92 1okd h THR 130 N 0.10 1.33 -0.93 0.00 1.35 -1.68 0.33 112.91 113.40 1okd h THR 130 Ca -0.31 -1.51 0.17 0.00 -0.55 0.00 0.00 66.41 64.22 1okd h THR 130 Cb 2.08 1.81 -0.08 0.00 -1.73 0.00 0.00 68.15 70.23 1okd h THR 130 CO 0.18 0.47 0.60 0.25 -0.25 0.00 0.00 175.52 176.76 1okd h LEU 131 N 0.24 0.64 0.01 3.87 6.46 -1.65 0.15 115.31 125.04 1okd h LEU 131 Ca 0.02 0.06 -0.23 0.00 -0.12 0.00 0.00 57.88 57.61 1okd h LEU 131 Cb 0.88 -0.07 -0.03 0.00 -0.73 0.00 0.00 40.66 40.72 1okd h LEU 131 CO 0.07 0.28 -1.25 1.62 -0.62 0.00 0.00 178.44 178.54 1okd h VAL 132 N 0.65 0.94 0.00 1.05 3.04 -1.70 -3.37 116.25 116.86 1okd h VAL 132 Ca 0.49 -2.20 0.00 0.00 -1.01 0.00 0.00 66.70 63.98 1okd h VAL 132 Cb 0.88 2.31 0.00 0.00 -2.01 0.00 0.00 31.29 32.47 1okd h VAL 132 CO -0.25 0.38 0.00 0.29 -1.01 0.00 0.00 177.57 176.98 1okd n LYS 133 N -4.36 0.93 -3.66 4.17 4.76 0.11 -4.51 118.16 115.61 1okd n LYS 133 Ca -0.31 0.00 -0.37 0.00 -2.87 0.00 0.00 58.31 54.76 1okd n LYS 133 Cb 0.70 -1.27 -0.08 0.00 -1.84 0.00 0.00 35.03 32.55 1okd n LYS 133 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1okd s ASP 134 N -0.50 5.58 0.00 4.39 2.15 0.50 -4.91 116.67 123.88 1okd s ASP 134 Ca 0.00 -3.08 0.04 0.00 0.43 0.00 0.00 52.55 49.94 1okd s ASP 134 Cb 0.00 -1.90 0.20 0.00 -0.30 0.00 0.00 42.92 40.91 1okd s ASP 134 CO 0.00 -0.34 1.14 -0.81 -0.17 0.00 0.00 175.17 174.99 1okd n PRO 135 N 3.21 1.14 -0.02 4.34 -0.04 -1.26 -3.54 135.00 138.83 1okd n PRO 135 Ca 0.12 -0.22 -0.02 0.00 -0.04 0.00 0.00 63.50 63.34 1okd n PRO 135 Cb 0.38 -1.09 -0.03 0.00 -0.04 0.00 0.00 33.50 32.73 1okd n PRO 135 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1okd n GLU 136 N -0.35 3.33 -1.49 0.54 -0.58 -1.26 -4.99 120.64 115.83 1okd n GLU 136 Ca 0.04 -0.00 -0.17 0.00 -0.42 0.00 0.00 57.16 56.61 1okd n GLU 136 Cb 0.06 -1.10 -0.07 0.00 -0.57 0.00 0.00 31.44 29.76 1okd n GLU 136 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1okd n GLY 137 N 2.76 1.62 0.14 0.62 0.00 -1.23 -4.81 105.19 104.29 1okd n GLY 137 Ca -0.06 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.74 1okd n GLY 137 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1okd h GLU 138 N 0.00 0.38 -0.50 1.61 5.08 -1.94 -3.32 114.58 115.89 1okd h GLU 138 Ca -0.35 -0.64 0.00 0.00 -1.00 0.00 0.00 59.36 57.37 1okd h GLU 138 Cb 1.15 0.24 0.00 0.00 0.50 0.00 0.00 28.75 30.64 1okd h GLU 138 CO 0.51 1.28 0.00 1.04 -1.00 0.00 0.00 179.01 180.84 1okd n GLN 139 N -3.57 2.19 -0.11 2.33 1.13 -1.26 -4.72 117.38 113.37 1okd n GLN 139 Ca -0.22 -1.85 0.03 0.00 -1.94 0.00 0.00 57.00 53.03 1okd n GLN 139 Cb 1.07 -1.41 0.06 0.00 0.11 0.00 0.00 30.24 30.08 1okd n GLN 139 CO 0.00 0.00 0.00 1.97 -1.44 0.00 0.00 177.06 177.59 1okd n PHE 140 N 1.01 0.14 0.13 1.08 -1.74 -1.25 0.37 117.46 117.20 1okd n PHE 140 Ca 0.17 0.36 0.01 0.00 -0.56 0.00 0.00 57.45 57.43 1okd n PHE 140 Cb 0.44 -0.70 0.04 0.00 1.52 0.00 0.00 39.48 40.78 1okd n PHE 140 CO 0.00 0.00 0.00 -0.35 -0.56 0.00 0.00 176.76 175.85 1okd n PRO 141 N -4.36 0.07 -0.87 3.97 -0.04 -1.26 -4.79 135.00 127.72 1okd n PRO 141 Ca 0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.52 1okd n PRO 141 Cb 0.19 -1.33 0.00 0.00 -0.04 0.00 0.00 33.50 32.32 1okd n PRO 141 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 1okd n TRP 142 N -0.83 0.00 -0.68 0.54 8.01 1.17 -4.14 117.44 121.51 1okd n TRP 142 Ca 0.01 0.00 -0.31 0.00 -1.31 0.00 0.00 57.50 55.89 1okd n TRP 142 Cb 0.00 0.00 0.17 0.00 -2.01 0.00 0.00 31.31 29.47 1okd n TRP 142 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 177.69 177.04 1okd n LYS 143 N -0.19 -0.90 0.00 -0.99 2.85 -1.17 -4.30 118.16 113.46 1okd n LYS 143 Ca 0.00 -0.22 0.00 0.00 -1.05 0.00 0.00 58.31 57.04 1okd n LYS 143 Cb 0.00 -2.06 0.00 0.00 -0.65 0.00 0.00 35.03 32.32 1okd n LYS 143 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 1okd n ASP 144 N -2.95 0.00 0.06 -5.58 2.03 -1.26 -4.97 116.55 103.88 1okd n ASP 144 Ca 0.07 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.38 1okd n ASP 144 Cb 0.54 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.94 1okd n ASP 144 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1okd n ALA 145 N 0.47 1.42 -1.00 -1.67 0.00 -1.26 -4.67 120.51 113.80 1okd n ALA 145 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1okd n ALA 145 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1okd n ALA 145 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1okd n PRO 146 N -2.77 -0.10 -4.29 0.00 -0.04 -1.26 -5.08 135.00 121.47 1okd n PRO 146 Ca 0.00 0.00 -0.25 0.00 -0.04 0.00 0.00 63.50 63.21 1okd n PRO 146 Cb 0.00 0.00 -0.17 0.00 -0.04 0.00 0.00 33.50 33.29 1okd n PRO 146 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1okd s LEU 147 N 0.00 1.44 0.04 1.53 1.02 -1.26 -4.99 118.68 116.46 1okd s LEU 147 Ca 0.00 -0.28 0.00 0.00 0.02 0.00 0.00 54.13 53.87 1okd s LEU 147 Cb 0.00 -0.80 0.00 0.00 0.02 0.00 0.00 46.19 45.41 1okd s LEU 147 CO 0.00 -0.03 0.00 1.21 0.02 0.00 0.00 176.35 177.55 1okd n GLU 148 N 4.27 0.00 0.00 1.70 4.07 -1.26 -5.33 120.64 124.09 1okd n GLU 148 Ca -0.19 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 56.91 1okd n GLU 148 Cb 0.51 -0.12 0.00 0.00 -0.06 0.00 0.00 31.44 31.77 1okd n GLU 148 CO 0.00 0.00 0.00 1.58 -0.06 0.00 0.00 177.13 178.65