#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dhk s SER 2 N 0.00 -0.16 -0.23 1.61 0.01 -1.26 -5.15 113.70 108.51 2dhk s SER 2 Ca 0.00 0.35 -0.17 0.00 1.31 0.00 0.00 55.95 57.44 2dhk s SER 2 Cb 0.00 0.30 0.07 0.00 0.21 0.00 0.00 66.02 66.59 2dhk s SER 2 CO 0.00 -0.10 0.59 -0.94 0.41 0.00 0.00 173.24 173.20 2dhk s SER 3 N 0.61 -0.71 0.00 2.44 1.04 -1.26 -5.10 113.70 110.73 2dhk s SER 3 Ca -0.04 1.25 0.00 0.00 0.48 0.00 0.00 55.95 57.64 2dhk s SER 3 Cb -0.06 1.19 0.00 0.00 0.10 0.00 0.00 66.02 67.25 2dhk s SER 3 CO -0.03 -0.22 0.00 0.61 0.98 0.00 0.00 173.24 174.58 2dhk n GLY 4 N 3.59 -1.33 3.38 7.32 0.00 -1.26 -5.10 105.19 111.79 2dhk n GLY 4 Ca -0.18 0.62 -0.46 0.00 0.00 0.00 0.00 46.02 46.01 2dhk n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dhk s SER 5 N 0.00 6.74 -0.19 1.61 0.01 -1.26 -4.89 113.70 115.72 2dhk s SER 5 Ca 0.00 -2.46 -0.00 0.00 1.31 0.00 0.00 55.95 54.79 2dhk s SER 5 Cb 0.00 -2.29 0.13 0.00 0.21 0.00 0.00 66.02 64.07 2dhk s SER 5 CO 0.00 -0.77 1.98 -1.54 0.41 0.00 0.00 173.24 173.32 2dhk n SER 6 N 5.04 5.89 -1.41 2.44 3.41 -1.26 -4.90 113.62 122.84 2dhk n SER 6 Ca 0.19 -2.78 0.00 0.00 -0.26 0.00 0.00 58.87 56.02 2dhk n SER 6 Cb 0.47 -1.06 0.00 0.00 -0.26 0.00 0.00 64.21 63.36 2dhk n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dhk n GLY 7 N 0.78 -4.67 3.64 5.00 0.00 -1.26 -5.09 105.19 103.59 2dhk n GLY 7 Ca 0.18 -0.46 -0.03 0.00 0.00 0.00 0.00 46.02 45.70 2dhk n GLY 7 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2dhk s LYS 8 N -1.69 0.62 0.16 1.61 2.20 -1.26 -5.16 119.74 116.22 2dhk s LYS 8 Ca 0.00 1.31 -0.17 0.00 -0.36 0.00 0.00 55.97 56.75 2dhk s LYS 8 Cb 0.00 0.54 -0.07 0.00 -1.51 0.00 0.00 37.83 36.79 2dhk s LYS 8 CO 0.00 -0.17 0.62 -1.59 -0.36 0.00 0.00 175.35 173.85 2dhk s LYS 9 N 2.33 4.12 -0.31 4.03 -2.85 -1.26 -5.06 119.74 120.73 2dhk s LYS 9 Ca -0.08 0.67 0.03 0.00 -1.00 0.00 0.00 55.97 55.60 2dhk s LYS 9 Cb -0.09 -2.96 0.09 0.00 -2.06 0.00 0.00 37.83 32.81 2dhk s LYS 9 CO -0.19 0.47 0.01 -1.17 0.10 0.00 0.00 175.35 174.57 2dhk s LEU 10 N -1.84 4.15 0.09 2.77 2.96 -1.26 -5.08 118.68 120.47 2dhk s LEU 10 Ca 0.38 -1.89 -0.04 0.00 -0.22 0.00 0.00 54.13 52.36 2dhk s LEU 10 Cb -0.16 -1.53 -0.02 0.00 0.50 0.00 0.00 46.19 44.97 2dhk s LEU 10 CO 0.20 -0.33 0.10 0.00 -1.32 0.00 0.00 176.35 175.00 2dhk n GLY 12 N -0.03 1.99 3.73 0.00 0.00 -0.04 -4.98 105.19 105.86 2dhk n GLY 12 Ca -0.12 -0.77 -0.40 0.00 0.00 0.00 0.00 46.02 44.73 2dhk n GLY 12 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2dhk s TYR 13 N -2.00 3.64 0.29 1.61 2.02 -1.26 -1.16 117.35 120.49 2dhk s TYR 13 Ca 0.00 1.32 0.03 0.00 -0.37 0.00 0.00 57.07 58.05 2dhk s TYR 13 Cb 0.00 -2.79 -0.06 0.00 -0.40 0.00 0.00 41.96 38.72 2dhk s TYR 13 CO 0.00 0.18 0.07 -0.51 -1.57 0.00 0.00 175.55 173.72 2dhk s LEU 14 N 0.40 1.93 -0.27 -1.29 1.43 -0.46 -4.78 118.68 115.63 2dhk s LEU 14 Ca 0.37 -1.37 0.02 0.00 -1.03 0.00 0.00 54.13 52.12 2dhk s LEU 14 Cb -0.19 -0.19 0.06 0.00 0.03 0.00 0.00 46.19 45.90 2dhk s LEU 14 CO 0.20 -0.66 -0.09 -0.55 0.23 0.00 0.00 176.35 175.48 2dhk s SER 15 N -3.40 4.52 -0.68 2.29 0.15 -1.23 -2.15 113.70 113.21 2dhk s SER 15 Ca 0.37 -1.38 -0.22 0.00 0.70 0.00 0.00 55.95 55.42 2dhk s SER 15 Cb 0.08 -1.58 0.08 0.00 -1.71 0.00 0.00 66.02 62.89 2dhk s SER 15 CO 0.14 -0.20 0.95 -0.75 1.20 0.00 0.00 173.24 174.58 2dhk s LYS 16 N 1.13 3.15 0.24 5.44 2.20 -1.22 -2.74 119.74 127.93 2dhk s LYS 16 Ca -0.08 -0.99 -0.29 0.00 -0.36 0.00 0.00 55.97 54.25 2dhk s LYS 16 Cb -0.20 -4.30 -0.15 0.00 -1.51 0.00 0.00 37.83 31.67 2dhk s LYS 16 CO -0.04 -1.78 0.85 0.34 -0.36 0.00 0.00 175.35 174.36 2dhk n PHE 17 N 7.42 0.64 -1.13 4.03 7.35 -0.26 -4.04 117.46 131.47 2dhk n PHE 17 Ca -0.02 0.80 0.04 0.00 -0.76 0.00 0.00 57.45 57.51 2dhk n PHE 17 Cb 0.45 -2.15 -0.01 0.00 0.35 0.00 0.00 39.48 38.13 2dhk n PHE 17 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2dhk n GLY 18 N 1.58 -0.53 0.00 7.13 0.00 -0.19 -4.77 105.19 108.42 2dhk n GLY 18 Ca 0.13 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.76 2dhk n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dhk n GLY 19 N -1.01 -0.63 2.87 -0.02 0.00 -1.11 -4.87 105.19 100.42 2dhk n GLY 19 Ca 0.00 -1.71 -0.20 0.00 0.00 0.00 0.00 46.02 44.11 2dhk n GLY 19 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2dhk n LYS 20 N -0.70 -4.30 0.00 1.61 4.81 -1.26 -4.71 118.16 113.62 2dhk n LYS 20 Ca 0.00 0.85 0.00 0.00 -0.87 0.00 0.00 58.31 58.29 2dhk n LYS 20 Cb 0.00 -5.55 0.00 0.00 0.02 0.00 0.00 35.03 29.50 2dhk n LYS 20 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2dhk n GLY 21 N -1.43 0.95 0.00 3.14 0.00 -1.26 -4.83 105.19 101.76 2dhk n GLY 21 Ca -0.11 -2.02 0.07 0.00 0.00 0.00 0.00 46.02 43.95 2dhk n GLY 21 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dhk n PRO 22 N -1.33 0.05 -2.76 1.61 -0.04 -1.26 -4.74 135.00 126.53 2dhk n PRO 22 Ca 0.00 0.23 -0.40 0.00 -0.04 0.00 0.00 63.50 63.29 2dhk n PRO 22 Cb 0.00 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 31.91 2dhk n PRO 22 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 2dhk s ILE 23 N -2.90 4.30 -1.73 0.52 -0.00 -1.26 -4.95 121.20 115.18 2dhk s ILE 23 Ca 0.09 2.05 0.18 0.00 -0.00 0.00 0.00 60.65 62.97 2dhk s ILE 23 Cb 0.09 -4.31 0.43 0.00 -0.00 0.00 0.00 42.46 38.67 2dhk s ILE 23 CO 0.25 0.41 1.35 -2.11 -0.00 0.00 0.00 174.94 174.84 2dhk n ARG 24 N 2.13 2.52 -1.97 0.37 1.85 -1.26 -2.75 116.66 117.55 2dhk n ARG 24 Ca -0.00 -2.24 -0.29 0.00 -1.00 0.00 0.00 57.85 54.32 2dhk n ARG 24 Cb 0.48 -1.43 0.07 0.00 -1.05 0.00 0.00 32.46 30.53 2dhk n ARG 24 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 2dhk s GLY 25 N -1.13 1.62 0.74 2.89 0.00 -1.26 -1.89 107.32 108.30 2dhk s GLY 25 Ca 0.35 -0.61 -0.11 0.00 0.00 0.00 0.00 44.72 44.35 2dhk s GLY 25 CO 0.26 -0.18 1.08 -0.98 0.00 0.00 0.00 173.10 173.27 2dhk s TRP 26 N -3.43 2.79 0.01 1.90 0.52 -1.26 -1.02 118.94 118.44 2dhk s TRP 26 Ca 0.60 1.50 -0.10 0.00 0.02 0.00 0.00 56.10 58.12 2dhk s TRP 26 Cb -0.11 -2.98 0.01 0.00 -1.15 0.00 0.00 33.47 29.24 2dhk s TRP 26 CO 0.49 -1.58 0.21 -1.59 0.02 0.00 0.00 176.95 174.50 2dhk s LYS 27 N -4.96 0.60 -0.36 4.98 0.00 -1.26 -4.88 119.74 113.87 2dhk s LYS 27 Ca 0.60 -0.40 -0.26 0.00 0.00 0.00 0.00 55.97 55.91 2dhk s LYS 27 Cb -0.16 0.25 0.01 0.00 0.00 0.00 0.00 37.83 37.94 2dhk s LYS 27 CO 0.56 -0.16 0.92 -1.54 0.00 0.00 0.00 175.35 175.12 2dhk s SER 28 N -1.57 6.68 0.05 0.03 1.04 -1.26 -3.44 113.70 115.23 2dhk s SER 28 Ca -0.12 0.60 0.03 0.00 0.48 0.00 0.00 55.95 56.94 2dhk s SER 28 Cb -0.05 -2.46 -0.03 0.00 0.10 0.00 0.00 66.02 63.58 2dhk s SER 28 CO 0.01 -0.83 -0.09 -0.13 0.98 0.00 0.00 173.24 173.17 2dhk s ARG 29 N 3.43 0.59 -0.17 4.02 1.81 -0.92 -4.95 118.95 122.76 2dhk s ARG 29 Ca 0.38 -0.81 -0.12 0.00 -1.72 0.00 0.00 55.73 53.46 2dhk s ARG 29 Cb -0.12 -0.40 -0.05 0.00 -0.45 0.00 0.00 34.95 33.93 2dhk s ARG 29 CO 0.18 0.08 0.23 -0.46 -0.68 0.00 0.00 175.30 174.64 2dhk s TRP 30 N -1.39 3.45 0.12 -0.53 -0.11 0.13 -1.36 118.94 119.26 2dhk s TRP 30 Ca -0.08 0.50 0.10 0.00 1.22 0.00 0.00 56.10 57.84 2dhk s TRP 30 Cb -0.10 -2.26 -0.04 0.00 -1.50 0.00 0.00 33.47 29.58 2dhk s TRP 30 CO 0.01 0.28 -0.25 -0.06 -4.62 0.00 0.00 176.95 172.32 2dhk s PHE 31 N 0.34 2.37 -0.28 5.86 0.40 -0.31 0.34 117.98 126.71 2dhk s PHE 31 Ca 0.13 -0.35 -0.17 0.00 -0.60 0.00 0.00 56.93 55.95 2dhk s PHE 31 Cb -0.12 -1.28 0.09 0.00 0.51 0.00 0.00 43.02 42.21 2dhk s PHE 31 CO 0.02 0.35 0.72 -0.59 0.70 0.00 0.00 175.22 176.42 2dhk s PHE 32 N -1.08 -0.99 -0.08 0.36 -0.12 0.17 -0.86 117.98 115.39 2dhk s PHE 32 Ca 0.15 2.02 -0.28 0.00 -0.05 0.00 0.00 56.93 58.77 2dhk s PHE 32 Cb -0.10 0.57 -0.02 0.00 -0.63 0.00 0.00 43.02 42.84 2dhk s PHE 32 CO 0.07 -0.49 0.93 -0.47 -0.05 0.00 0.00 175.22 175.21 2dhk s TYR 33 N 1.47 3.55 -0.72 3.49 6.14 0.45 -0.84 117.35 130.89 2dhk s TYR 33 Ca -0.09 1.52 -0.17 0.00 0.64 0.00 0.00 57.07 58.97 2dhk s TYR 33 Cb -0.05 -3.09 0.15 0.00 0.42 0.00 0.00 41.96 39.39 2dhk s TYR 33 CO -0.17 -0.13 0.78 0.34 0.64 0.00 0.00 175.55 177.01 2dhk s ASP 34 N 1.04 6.45 0.00 4.32 -1.08 0.14 -4.61 116.67 122.94 2dhk s ASP 34 Ca 0.46 -1.98 0.08 0.00 -0.52 0.00 0.00 52.55 50.60 2dhk s ASP 34 Cb -0.19 -2.28 0.42 0.00 -1.46 0.00 0.00 42.92 39.41 2dhk s ASP 34 CO 0.20 -0.91 1.13 -1.84 0.52 0.00 0.00 175.17 174.27 2dhk n GLU 35 N 5.53 0.12 -0.03 4.34 0.00 -1.26 -0.66 120.64 128.68 2dhk n GLU 35 Ca 0.04 0.21 -0.15 0.00 0.00 0.00 0.00 57.16 57.25 2dhk n GLU 35 Cb 0.45 -1.50 -0.09 0.00 0.00 0.00 0.00 31.44 30.29 2dhk n GLU 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2dhk h ARG 36 N 0.00 0.36 -0.15 3.44 2.47 -1.93 -3.33 114.38 115.23 2dhk h ARG 36 Ca 0.00 -0.29 0.00 0.00 -1.26 0.00 0.00 59.98 58.43 2dhk h ARG 36 Cb 0.08 0.06 0.00 0.00 -1.65 0.00 0.00 29.97 28.46 2dhk h ARG 36 CO 0.00 0.94 0.00 1.63 0.56 0.00 0.00 179.97 183.10 2dhk n LYS 37 N -4.40 1.84 -3.43 0.04 5.02 -1.01 -5.00 118.16 111.23 2dhk n LYS 37 Ca -0.08 -1.53 -0.17 0.00 -2.02 0.00 0.00 58.31 54.50 2dhk n LYS 37 Cb 0.52 -1.17 0.09 0.00 -0.02 0.00 0.00 35.03 34.44 2dhk n LYS 37 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2dhk s GLN 39 N -5.30 1.54 -0.30 0.00 -1.52 -0.92 -4.56 119.66 108.61 2dhk s GLN 39 Ca 0.04 -1.87 0.01 0.00 -1.95 0.00 0.00 55.36 51.60 2dhk s GLN 39 Cb -0.01 0.29 0.07 0.00 -0.22 0.00 0.00 33.01 33.14 2dhk s GLN 39 CO 0.73 -0.54 -0.02 -1.17 -0.25 0.00 0.00 175.29 174.04 2dhk s LEU 40 N -3.29 3.98 0.01 2.90 2.96 -0.54 0.28 118.68 124.98 2dhk s LEU 40 Ca 0.40 -1.54 -0.01 0.00 -0.22 0.00 0.00 54.13 52.76 2dhk s LEU 40 Cb 0.04 -1.64 -0.04 0.00 0.50 0.00 0.00 46.19 45.05 2dhk s LEU 40 CO 0.21 -0.28 0.14 -0.31 -1.32 0.00 0.00 176.35 174.80 2dhk s TYR 41 N 1.12 3.42 -0.08 5.38 1.51 -0.02 0.47 117.35 129.16 2dhk s TYR 41 Ca -0.03 0.26 -0.05 0.00 -1.01 0.00 0.00 57.07 56.24 2dhk s TYR 41 Cb -0.20 -1.77 0.03 0.00 -0.11 0.00 0.00 41.96 39.92 2dhk s TYR 41 CO -0.04 0.59 0.19 1.52 -1.11 0.00 0.00 175.55 176.70 2dhk s TYR 42 N -1.33 -0.23 0.20 2.71 -0.85 -0.73 0.46 117.35 117.59 2dhk s TYR 42 Ca 0.28 0.57 0.03 0.00 -0.52 0.00 0.00 57.07 57.43 2dhk s TYR 42 Cb -0.12 0.03 -0.01 0.00 0.38 0.00 0.00 41.96 42.23 2dhk s TYR 42 CO 0.19 -0.15 0.12 0.45 -1.52 0.00 0.00 175.55 174.64 2dhk n SER 43 N 3.62 0.25 -0.03 -0.18 2.88 0.15 -2.23 113.62 118.08 2dhk n SER 43 Ca -0.19 -2.17 -0.10 0.00 -1.33 0.00 0.00 58.87 55.08 2dhk n SER 43 Cb 0.55 0.75 -0.03 0.00 -0.75 0.00 0.00 64.21 64.73 2dhk n SER 43 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 2dhk h ARG 44 N 0.00 0.15 -4.96 -1.46 2.47 -1.92 0.36 114.38 109.02 2dhk h ARG 44 Ca -0.14 -0.01 -0.50 0.00 -1.26 0.00 0.00 59.98 58.06 2dhk h ARG 44 Cb 0.65 -0.03 -0.13 0.00 -1.65 0.00 0.00 29.97 28.80 2dhk h ARG 44 CO 0.22 0.10 -0.52 0.95 0.56 0.00 0.00 179.97 181.28 2dhk s THR 45 N -6.18 0.36 -0.56 2.04 -4.23 -1.26 -3.69 115.64 102.11 2dhk s THR 45 Ca -0.13 -2.00 0.24 0.00 -1.18 0.00 0.00 61.69 58.62 2dhk s THR 45 Cb 0.09 -2.42 0.26 0.00 1.34 0.00 0.00 72.50 71.76 2dhk s THR 45 CO 0.68 0.00 1.60 0.00 -0.54 0.00 0.00 174.62 176.36 2dhk h ALA 46 N 1.98 0.91 -0.41 3.99 0.00 -1.93 -3.18 119.26 120.62 2dhk h ALA 46 Ca -0.32 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.59 2dhk h ALA 46 Cb 1.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2dhk h ALA 46 CO 0.50 0.00 0.00 1.04 0.00 0.00 0.00 179.25 180.79 2dhk n GLN 47 N -2.62 2.90 -2.48 0.00 1.13 -1.26 -4.88 117.38 110.17 2dhk n GLN 47 Ca 0.04 -1.88 -0.43 0.00 -1.94 0.00 0.00 57.00 52.79 2dhk n GLN 47 Cb 0.48 -1.73 -0.02 0.00 0.11 0.00 0.00 30.24 29.08 2dhk n GLN 47 CO 0.00 0.00 0.00 0.16 -1.44 0.00 0.00 177.06 175.78 2dhk s ASP 48 N -0.71 6.60 0.52 1.08 1.47 -1.20 -4.88 116.67 119.54 2dhk s ASP 48 Ca 0.33 0.88 0.20 0.00 1.18 0.00 0.00 52.55 55.15 2dhk s ASP 48 Cb 0.22 -2.54 1.38 0.00 -0.34 0.00 0.00 42.92 41.64 2dhk s ASP 48 CO 0.15 -1.20 2.14 0.00 0.68 0.00 0.00 175.17 176.93 2dhk h ALA 49 N 9.53 1.73 -3.20 2.11 0.00 -1.93 -3.39 119.26 124.11 2dhk h ALA 49 Ca -0.25 -0.05 -0.53 0.00 0.00 0.00 0.00 54.91 54.08 2dhk h ALA 49 Cb 1.08 -0.01 -0.36 0.00 0.00 0.00 0.00 17.79 18.50 2dhk h ALA 49 CO 1.07 0.07 -0.81 -0.80 0.00 0.00 0.00 179.25 178.78 2dhk s ASN 50 N -6.72 2.18 0.37 0.00 -0.87 -1.26 -5.13 114.94 103.51 2dhk s ASN 50 Ca -0.05 -0.32 -0.27 0.00 -1.57 0.00 0.00 52.86 50.66 2dhk s ASN 50 Cb 0.16 -0.87 -0.09 0.00 -0.02 0.00 0.00 41.25 40.43 2dhk s ASN 50 CO 0.63 -0.10 1.20 -2.16 -2.57 0.00 0.00 177.10 174.11 2dhk s PRO 51 N 1.57 4.18 0.04 -0.60 0.04 -1.26 -4.93 135.00 134.03 2dhk s PRO 51 Ca 0.03 1.94 -0.28 0.00 0.04 0.00 0.00 61.00 62.73 2dhk s PRO 51 Cb -0.13 -2.83 -0.17 0.00 0.04 0.00 0.00 34.50 31.41 2dhk s PRO 51 CO -0.07 -0.24 1.39 -0.07 0.04 0.00 0.00 177.00 178.05 2dhk h LEU 52 N 2.94 -0.51 -8.35 -3.56 3.38 -1.82 -3.48 115.31 103.92 2dhk h LEU 52 Ca -0.49 -0.07 -0.12 0.00 0.09 0.00 0.00 57.88 57.29 2dhk h LEU 52 Cb 1.23 0.13 -0.10 0.00 0.09 0.00 0.00 40.66 42.01 2dhk h LEU 52 CO 0.64 -0.22 -0.24 -0.62 0.09 0.00 0.00 178.44 178.08 2dhk s ASP 53 N -4.79 0.05 0.16 -0.43 2.15 -1.15 -5.03 116.67 107.62 2dhk s ASP 53 Ca -0.15 -1.09 0.03 0.00 0.43 0.00 0.00 52.55 51.78 2dhk s ASP 53 Cb 0.03 0.54 -0.05 0.00 -0.30 0.00 0.00 42.92 43.15 2dhk s ASP 53 CO 0.57 -1.08 -0.06 -0.94 -0.17 0.00 0.00 175.17 173.48 2dhk s SER 54 N -3.07 1.61 -0.07 -0.34 1.04 -1.26 -1.77 113.70 109.83 2dhk s SER 54 Ca 0.27 -1.07 -0.01 0.00 0.48 0.00 0.00 55.95 55.62 2dhk s SER 54 Cb 0.01 0.03 0.03 0.00 0.10 0.00 0.00 66.02 66.19 2dhk s SER 54 CO 0.11 -0.42 -0.02 -0.63 0.98 0.00 0.00 173.24 173.26 2dhk s ILE 55 N -3.44 0.52 -0.65 -1.02 1.09 0.18 -4.93 121.20 112.94 2dhk s ILE 55 Ca 0.19 0.01 -0.27 0.00 -1.10 0.00 0.00 60.65 59.48 2dhk s ILE 55 Cb 0.04 -0.63 0.01 0.00 -1.06 0.00 0.00 42.46 40.81 2dhk s ILE 55 CO 0.02 0.28 1.54 -0.62 -0.10 0.00 0.00 174.94 176.05 2dhk s ASP 56 N 1.76 5.80 0.46 3.58 2.15 -1.26 -1.46 116.67 127.70 2dhk s ASP 56 Ca 0.03 0.02 0.29 0.00 0.43 0.00 0.00 52.55 53.32 2dhk s ASP 56 Cb -0.13 -2.54 1.01 0.00 -0.30 0.00 0.00 42.92 40.96 2dhk s ASP 56 CO -0.05 -2.03 1.84 -0.07 -0.17 0.00 0.00 175.17 174.69 2dhk h LEU 57 N 14.39 0.00 -1.36 -1.34 3.38 -1.92 -3.18 115.31 125.29 2dhk h LEU 57 Ca -0.27 0.00 0.27 0.00 0.09 0.00 0.00 57.88 57.97 2dhk h LEU 57 Cb 1.10 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.76 2dhk h LEU 57 CO 1.23 0.00 0.68 -1.28 0.09 0.00 0.00 178.44 179.16 2dhk h SER 58 N 0.00 0.44 -0.08 -0.43 0.87 -1.88 -1.08 113.55 111.40 2dhk h SER 58 Ca 0.00 0.09 -0.11 0.00 -1.23 0.00 0.00 61.79 60.53 2dhk h SER 58 Cb 0.63 0.02 -0.18 0.00 -0.44 0.00 0.00 62.40 62.43 2dhk h SER 58 CO 0.00 0.07 -0.73 -1.20 -0.53 0.00 0.00 176.83 174.44 2dhk n SER 59 N -4.63 1.72 -4.64 6.23 7.64 -1.20 -5.00 113.62 113.73 2dhk n SER 59 Ca 0.26 -3.17 -0.34 0.00 1.01 0.00 0.00 58.87 56.63 2dhk n SER 59 Cb 0.90 -0.44 -0.10 0.00 -1.01 0.00 0.00 64.21 63.57 2dhk n SER 59 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dhk s ALA 60 N -2.21 3.17 -0.23 -0.43 0.00 -0.41 -4.37 121.76 117.27 2dhk s ALA 60 Ca 0.37 -0.88 0.00 0.00 0.00 0.00 0.00 51.96 51.46 2dhk s ALA 60 Cb 0.38 -1.35 0.03 0.00 0.00 0.00 0.00 23.12 22.18 2dhk s ALA 60 CO -0.09 0.60 -0.11 0.54 0.00 0.00 0.00 175.76 176.69 2dhk s VAL 61 N -0.91 2.51 -0.11 0.00 0.11 -0.23 -4.93 120.40 116.83 2dhk s VAL 61 Ca 0.14 -1.12 -0.23 0.00 -2.93 0.00 0.00 61.98 57.85 2dhk s VAL 61 Cb -0.11 -2.25 -0.03 0.00 -1.53 0.00 0.00 36.38 32.45 2dhk s VAL 61 CO 0.04 0.25 0.69 -0.36 -3.33 0.00 0.00 175.10 172.40 2dhk s PHE 62 N 1.27 3.51 0.24 1.54 0.08 -1.26 -0.82 117.98 122.54 2dhk s PHE 62 Ca -0.00 1.17 0.04 0.00 0.12 0.00 0.00 56.93 58.25 2dhk s PHE 62 Cb -0.16 -2.82 -0.05 0.00 -0.57 0.00 0.00 43.02 39.41 2dhk s PHE 62 CO -0.07 -0.01 -0.00 0.34 -0.10 0.00 0.00 175.22 175.38 2dhk s ASP 63 N 0.92 1.88 -0.12 1.36 2.15 0.39 -4.95 116.67 118.30 2dhk s ASP 63 Ca 0.35 -1.22 -0.03 0.00 0.43 0.00 0.00 52.55 52.08 2dhk s ASP 63 Cb -0.17 0.00 -0.03 0.00 -0.30 0.00 0.00 42.92 42.42 2dhk s ASP 63 CO 0.15 -0.51 -0.01 0.00 -0.17 0.00 0.00 175.17 174.63 2dhk n LYS 65 N 2.77 -2.81 0.01 0.00 4.76 -0.40 -4.92 118.16 117.56 2dhk n LYS 65 Ca -0.18 -1.42 -0.14 0.00 -2.87 0.00 0.00 58.31 53.70 2dhk n LYS 65 Cb 0.53 -1.34 -0.02 0.00 -1.84 0.00 0.00 35.03 32.36 2dhk n LYS 65 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2dhk h ALA 66 N -2.63 0.46 -0.60 7.82 0.00 -2.00 -3.18 119.26 119.13 2dhk h ALA 66 Ca -0.34 -0.60 -0.41 0.00 0.00 0.00 0.00 54.91 53.57 2dhk h ALA 66 Cb 1.03 -0.04 -0.18 0.00 0.00 0.00 0.00 17.79 18.60 2dhk h ALA 66 CO 0.22 0.72 0.53 -0.25 0.00 0.00 0.00 179.25 180.46 2dhk n ASP 67 N -3.90 6.64 0.22 0.00 9.92 -1.26 -4.55 116.55 123.62 2dhk n ASP 67 Ca -0.06 -3.23 0.13 0.00 -0.53 0.00 0.00 54.79 51.10 2dhk n ASP 67 Cb 0.72 -1.03 0.70 0.00 -0.64 0.00 0.00 41.12 40.87 2dhk n ASP 67 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2dhk h ALA 68 N 1.59 1.07 -1.47 2.24 0.00 -1.80 -2.70 119.26 118.20 2dhk h ALA 68 Ca 0.37 0.00 0.44 0.00 0.00 0.00 0.00 54.91 55.72 2dhk h ALA 68 Cb 0.94 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.64 2dhk h ALA 68 CO 0.95 -0.07 1.01 1.05 0.00 0.00 0.00 179.25 182.19 2dhk h GLU 69 N 0.00 0.07 0.00 0.00 4.11 -1.90 1.02 114.58 117.87 2dhk h GLU 69 Ca 0.00 -0.00 -0.28 0.00 0.07 0.00 0.00 59.36 59.14 2dhk h GLU 69 Cb 0.18 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.36 2dhk h GLU 69 CO 0.00 0.04 -1.76 -1.91 0.07 0.00 0.00 179.01 175.46 2dhk n GLU 70 N -4.35 0.64 0.00 1.06 2.13 -1.02 -4.46 120.64 114.64 2dhk n GLU 70 Ca 0.36 0.25 0.00 0.00 0.66 0.00 0.00 57.16 58.43 2dhk n GLU 70 Cb 1.52 -1.76 0.00 0.00 0.27 0.00 0.00 31.44 31.47 2dhk n GLU 70 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2dhk n GLY 71 N 1.55 0.66 3.43 8.31 0.00 0.35 -3.07 105.19 116.42 2dhk n GLY 71 Ca -0.18 -0.48 -0.33 0.00 0.00 0.00 0.00 46.02 45.03 2dhk n GLY 71 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dhk s ILE 72 N -0.51 3.12 0.40 -0.61 1.09 -1.26 -0.27 121.20 123.16 2dhk s ILE 72 Ca 0.00 -0.66 0.05 0.00 -1.10 0.00 0.00 60.65 58.93 2dhk s ILE 72 Cb 0.00 -2.28 -0.02 0.00 -1.06 0.00 0.00 42.46 39.10 2dhk s ILE 72 CO 0.00 0.55 0.17 2.22 -0.10 0.00 0.00 174.94 177.78 2dhk n PHE 73 N 3.00 -0.04 -3.73 3.97 -1.74 -0.11 -1.28 117.46 117.53 2dhk n PHE 73 Ca -0.18 -2.67 -0.12 0.00 -0.56 0.00 0.00 57.45 53.92 2dhk n PHE 73 Cb 0.53 0.05 -0.12 0.00 1.52 0.00 0.00 39.48 41.46 2dhk n PHE 73 CO 0.00 0.00 0.00 -1.21 -0.56 0.00 0.00 176.76 174.99 2dhk s GLU 74 N -3.52 0.32 -0.52 3.97 2.02 0.17 -2.43 118.70 118.70 2dhk s GLU 74 Ca 0.24 0.56 -0.15 0.00 0.02 0.00 0.00 54.97 55.65 2dhk s GLU 74 Cb 0.01 0.03 0.13 0.00 0.10 0.00 0.00 34.13 34.40 2dhk s GLU 74 CO 0.17 -0.11 0.46 0.42 0.02 0.00 0.00 175.26 176.22 2dhk s ILE 75 N 0.84 5.01 -0.27 -1.63 1.01 0.12 -0.47 121.20 125.81 2dhk s ILE 75 Ca -0.05 -1.54 -0.27 0.00 0.00 0.00 0.00 60.65 58.79 2dhk s ILE 75 Cb -0.06 -4.22 0.01 0.00 0.01 0.00 0.00 42.46 38.20 2dhk s ILE 75 CO -0.06 -0.84 0.97 -0.54 0.00 0.00 0.00 174.94 174.47 2dhk s LYS 76 N 1.55 4.13 0.12 2.79 3.01 0.00 -1.61 119.74 129.75 2dhk s LYS 76 Ca 0.04 1.06 0.06 0.00 -1.01 0.00 0.00 55.97 56.11 2dhk s LYS 76 Cb -0.29 -3.69 -0.04 0.00 -1.01 0.00 0.00 37.83 32.81 2dhk s LYS 76 CO 0.02 -0.70 -0.13 0.95 0.51 0.00 0.00 175.35 176.00 2dhk s THR 77 N 3.23 1.28 -2.00 2.17 -4.23 -1.26 -1.07 115.64 113.76 2dhk s THR 77 Ca 0.41 -1.75 0.09 0.00 -1.18 0.00 0.00 61.69 59.26 2dhk s THR 77 Cb -0.14 -1.55 0.27 0.00 1.34 0.00 0.00 72.50 72.41 2dhk s THR 77 CO 0.10 -0.47 1.00 -0.81 -0.54 0.00 0.00 174.62 173.91 2dhk n PRO 78 N 0.44 0.48 -0.03 3.99 -0.04 -1.26 -3.33 135.00 135.26 2dhk n PRO 78 Ca -0.15 0.00 -0.07 0.00 -0.04 0.00 0.00 63.50 63.24 2dhk n PRO 78 Cb 0.57 -1.30 -0.02 0.00 -0.04 0.00 0.00 33.50 32.71 2dhk n PRO 78 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2dhk n SER 79 N -0.80 0.91 -3.62 3.54 2.88 -1.26 -5.08 113.62 110.18 2dhk n SER 79 Ca 0.07 0.14 -0.04 0.00 -1.33 0.00 0.00 58.87 57.71 2dhk n SER 79 Cb 0.03 -0.34 -0.06 0.00 -0.75 0.00 0.00 64.21 63.09 2dhk n SER 79 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dhk s ARG 80 N -2.21 0.54 0.35 -1.46 1.70 -1.21 -5.16 118.95 111.50 2dhk s ARG 80 Ca -0.11 1.00 -0.26 0.00 -0.47 0.00 0.00 55.73 55.89 2dhk s ARG 80 Cb 0.03 0.21 -0.09 0.00 -0.57 0.00 0.00 34.95 34.54 2dhk s ARG 80 CO 0.15 -0.13 1.09 0.08 -1.08 0.00 0.00 175.30 175.41 2dhk s VAL 81 N 1.72 3.53 0.10 4.99 1.01 -1.26 -4.18 120.40 126.32 2dhk s VAL 81 Ca -0.09 1.34 0.06 0.00 0.00 0.00 0.00 61.98 63.29 2dhk s VAL 81 Cb -0.05 -3.77 -0.03 0.00 0.00 0.00 0.00 36.38 32.52 2dhk s VAL 81 CO -0.18 0.16 -0.16 -0.63 0.00 0.00 0.00 175.10 174.30 2dhk s ILE 82 N -1.42 1.37 -0.35 2.22 -1.09 -0.63 -4.98 121.20 116.31 2dhk s ILE 82 Ca 0.52 -1.55 0.02 0.00 -2.23 0.00 0.00 60.65 57.41 2dhk s ILE 82 Cb -0.27 -1.40 0.11 0.00 -1.58 0.00 0.00 42.46 39.32 2dhk s ILE 82 CO 0.35 -0.27 0.11 -0.89 -1.23 0.00 0.00 174.94 173.01 2dhk s THR 83 N -1.62 1.60 0.20 2.92 2.01 -1.26 0.11 115.64 119.60 2dhk s THR 83 Ca 0.05 -2.06 0.07 0.00 0.31 0.00 0.00 61.69 60.07 2dhk s THR 83 Cb -0.08 -2.18 -0.04 0.00 0.01 0.00 0.00 72.50 70.22 2dhk s THR 83 CO 0.03 -0.69 0.08 -0.76 -0.69 0.00 0.00 174.62 172.59 2dhk s LEU 84 N 1.04 3.53 0.14 4.42 1.43 -1.02 -1.10 118.68 127.11 2dhk s LEU 84 Ca 0.12 -0.34 0.07 0.00 -1.03 0.00 0.00 54.13 52.95 2dhk s LEU 84 Cb -0.20 -2.12 -0.04 0.00 0.03 0.00 0.00 46.19 43.86 2dhk s LEU 84 CO -0.13 0.04 -0.15 -1.59 0.23 0.00 0.00 176.35 174.75 2dhk s LYS 85 N -3.30 1.10 0.40 1.70 -2.85 -1.11 -0.93 119.74 114.75 2dhk s LYS 85 Ca 0.30 -1.30 0.08 0.00 -1.00 0.00 0.00 55.97 54.05 2dhk s LYS 85 Cb -0.09 -1.02 -0.04 0.00 -2.06 0.00 0.00 37.83 34.62 2dhk s LYS 85 CO 0.21 0.20 0.22 0.00 0.10 0.00 0.00 175.35 176.08 2dhk s ALA 86 N -2.16 3.68 0.17 0.59 0.00 0.63 -3.51 121.76 121.17 2dhk s ALA 86 Ca 0.11 -1.99 -0.21 0.00 0.00 0.00 0.00 51.96 49.87 2dhk s ALA 86 Cb -0.05 -0.61 0.08 0.00 0.00 0.00 0.00 23.12 22.54 2dhk s ALA 86 CO 0.04 -0.14 1.62 0.00 0.00 0.00 0.00 175.76 177.28 2dhk h ALA 87 N 1.35 -0.03 -4.70 0.00 0.00 -1.86 -3.44 119.26 110.58 2dhk h ALA 87 Ca -0.43 0.12 -0.43 0.00 0.00 0.00 0.00 54.91 54.17 2dhk h ALA 87 Cb 1.26 0.58 -0.11 0.00 0.00 0.00 0.00 17.79 19.51 2dhk h ALA 87 CO 0.65 -0.64 -0.40 0.25 0.00 0.00 0.00 179.25 179.11 2dhk n THR 88 N -5.40 0.00 -0.27 0.00 -2.24 -1.26 -4.90 114.28 100.21 2dhk n THR 88 Ca 0.02 -2.28 0.00 0.00 -2.27 0.00 0.00 64.05 59.52 2dhk n THR 88 Cb 0.31 1.18 0.21 0.00 -2.10 0.00 0.00 70.33 69.93 2dhk n THR 88 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 2dhk h LYS 89 N 0.00 1.08 0.00 -0.78 1.63 -1.76 -0.62 116.57 116.12 2dhk h LYS 89 Ca -0.24 -0.07 0.00 0.00 -0.85 0.00 0.00 60.65 59.50 2dhk h LYS 89 Cb 1.18 -0.24 0.00 0.00 -0.60 0.00 0.00 32.23 32.56 2dhk h LYS 89 CO 0.34 0.72 0.00 1.96 -3.45 0.00 0.00 179.45 179.02 2dhk h GLN 90 N 1.11 0.00 0.31 1.90 4.20 -1.94 -3.26 115.11 117.44 2dhk h GLN 90 Ca 0.32 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 59.02 2dhk h GLN 90 Cb -0.07 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.71 2dhk h GLN 90 CO -0.08 0.00 -0.15 0.00 -0.67 0.00 0.00 178.83 177.93 2dhk h ALA 91 N 2.12 -0.63 -0.81 3.87 0.00 -1.49 -3.25 119.26 119.07 2dhk h ALA 91 Ca 0.00 -0.09 0.20 0.00 0.00 0.00 0.00 54.91 55.02 2dhk h ALA 91 Cb 0.72 0.16 -0.13 0.00 0.00 0.00 0.00 17.79 18.53 2dhk h ALA 91 CO 0.00 -0.60 0.13 0.00 0.00 0.00 0.00 179.25 178.79 2dhk h MET 92 N -0.70 0.17 -1.11 0.00 -0.00 -1.62 0.38 114.93 112.05 2dhk h MET 92 Ca -0.04 -0.01 0.32 0.00 -0.00 0.00 0.00 59.70 59.97 2dhk h MET 92 Cb 0.32 -0.04 -0.11 0.00 -0.00 0.00 0.00 31.60 31.77 2dhk h MET 92 CO 0.07 0.11 0.71 -0.07 -0.00 0.00 0.00 176.91 177.73 2dhk h LEU 93 N 0.17 0.41 -0.45 -0.10 3.38 -1.63 0.64 115.31 117.73 2dhk h LEU 93 Ca 0.48 0.11 -0.17 0.00 0.09 0.00 0.00 57.88 58.40 2dhk h LEU 93 Cb 0.90 0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.70 2dhk h LEU 93 CO -0.64 -0.02 -0.50 0.22 0.09 0.00 0.00 178.44 177.59 2dhk h TYR 94 N 0.30 0.90 -0.00 1.13 3.20 -0.26 -1.17 116.97 121.06 2dhk h TYR 94 Ca 0.68 -0.30 -0.00 0.00 3.14 0.00 0.00 58.73 62.25 2dhk h TYR 94 Cb 1.83 -0.18 -0.00 0.00 1.54 0.00 0.00 36.73 39.92 2dhk h TYR 94 CO -0.00 1.08 -0.00 -1.49 -1.64 0.00 0.00 178.16 176.10 2dhk h TRP 95 N 0.57 0.01 -0.81 -3.82 4.06 0.31 0.59 115.95 116.85 2dhk h TRP 95 Ca 0.02 -0.00 -0.03 0.00 2.06 0.00 0.00 58.89 60.94 2dhk h TRP 95 Cb 1.07 -0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 29.19 2dhk h TRP 95 CO 0.06 0.46 0.37 -0.07 -3.56 0.00 0.00 178.44 175.70 2dhk h LEU 96 N -0.45 1.07 -0.05 -4.49 3.38 -0.90 0.48 115.31 114.34 2dhk h LEU 96 Ca 0.00 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 2dhk h LEU 96 Cb 0.46 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 2dhk h LEU 96 CO 0.00 0.91 -0.03 -0.61 0.09 0.00 0.00 178.44 178.80 2dhk h GLN 97 N 1.15 0.12 0.57 1.13 5.75 -1.22 -3.03 115.11 119.58 2dhk h GLN 97 Ca 0.28 -0.05 -0.03 0.00 -0.15 0.00 0.00 58.65 58.69 2dhk h GLN 97 Cb 0.14 -0.00 0.01 0.00 1.07 0.00 0.00 27.48 28.69 2dhk h GLN 97 CO -0.03 0.52 -0.28 1.96 -2.65 0.00 0.00 178.83 178.35 2dhk h GLN 98 N -0.29 -0.74 -0.85 1.69 1.08 -0.75 -2.97 115.11 112.27 2dhk h GLN 98 Ca 0.01 0.05 0.34 0.00 -1.45 0.00 0.00 58.65 57.60 2dhk h GLN 98 Cb 0.49 0.17 -0.15 0.00 -0.05 0.00 0.00 27.48 27.93 2dhk h GLN 98 CO 0.01 -0.50 0.40 1.28 -0.95 0.00 0.00 178.83 179.07 2dhk n LEU 99 N -5.03 0.24 0.19 1.46 4.77 0.17 0.73 117.00 119.54 2dhk n LEU 99 Ca -0.10 1.42 -0.14 0.00 -0.03 0.00 0.00 56.01 57.16 2dhk n LEU 99 Cb 0.30 -0.67 -0.08 0.00 -2.33 0.00 0.00 43.42 40.64 2dhk n LEU 99 CO 0.23 -1.57 0.62 1.56 -1.33 0.00 0.00 177.39 176.90 2dhk h GLN 100 N 0.00 -0.46 -0.73 3.23 4.20 -1.50 -3.10 115.11 116.75 2dhk h GLN 100 Ca 0.70 0.03 0.16 0.00 0.06 0.00 0.00 58.65 59.59 2dhk h GLN 100 Cb 1.80 0.11 -0.14 0.00 0.30 0.00 0.00 27.48 29.55 2dhk h GLN 100 CO -0.68 -0.19 -0.14 -1.33 -0.67 0.00 0.00 178.83 175.82 2dhk n MET 101 N -5.21 -0.06 0.19 1.46 2.81 0.22 0.10 117.12 116.63 2dhk n MET 101 Ca -0.10 1.12 -0.15 0.00 -1.81 0.00 0.00 57.70 56.77 2dhk n MET 101 Cb 0.26 -1.70 -0.08 0.00 -0.71 0.00 0.00 33.22 30.99 2dhk n MET 101 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 2dhk h LYS 102 N 0.00 -0.43 0.37 0.03 1.79 -1.46 -0.67 116.57 116.21 2dhk h LYS 102 Ca 0.37 0.03 -0.02 0.00 -2.18 0.00 0.00 60.65 58.85 2dhk h LYS 102 Cb 0.60 0.10 0.00 0.00 -1.58 0.00 0.00 32.23 31.35 2dhk h LYS 102 CO -0.74 -0.28 -0.18 -0.09 -1.08 0.00 0.00 179.45 177.08 2dhk h ARG 103 N -0.44 -0.48 -1.00 3.15 2.43 0.68 -3.09 114.38 115.63 2dhk h ARG 103 Ca -0.04 0.03 0.38 0.00 -0.81 0.00 0.00 59.98 59.55 2dhk h ARG 103 Cb 0.35 0.11 -0.17 0.00 -0.42 0.00 0.00 29.97 29.84 2dhk h ARG 103 CO 0.05 -0.32 0.53 2.35 -1.51 0.00 0.00 179.97 181.07 2dhk h TRP 104 N -0.72 0.83 -0.34 2.20 7.01 0.58 0.62 115.95 126.13 2dhk h TRP 104 Ca -0.05 0.04 0.04 0.00 2.11 0.00 0.00 58.89 61.03 2dhk h TRP 104 Cb 0.38 -0.20 -0.04 0.00 -2.10 0.00 0.00 29.16 27.21 2dhk h TRP 104 CO 0.06 -0.38 0.11 0.93 -2.79 0.00 0.00 178.44 176.36 2dhk h GLU 105 N 0.10 0.24 -0.69 2.65 4.39 -1.10 0.79 114.58 120.96 2dhk h GLU 105 Ca 0.80 -0.01 0.03 0.00 0.34 0.00 0.00 59.36 60.52 2dhk h GLU 105 Cb 2.03 -0.05 -0.04 0.00 -0.10 0.00 0.00 28.75 30.58 2dhk h GLU 105 CO -0.72 0.16 0.43 0.35 -1.16 0.00 0.00 179.01 178.06 2dhk h PHE 106 N 0.24 0.80 0.01 4.33 3.04 0.33 0.14 116.94 125.83 2dhk h PHE 106 Ca 0.16 0.02 -0.00 0.00 3.98 0.00 0.00 57.97 62.13 2dhk h PHE 106 Cb 0.14 -0.26 0.00 0.00 2.56 0.00 0.00 35.95 38.39 2dhk h PHE 106 CO -0.15 0.45 -0.00 0.45 -2.02 0.00 0.00 178.31 177.04 2dhk h HIS 107 N 0.83 -0.01 0.89 0.41 3.86 -0.97 -3.28 115.15 116.88 2dhk h HIS 107 Ca 0.28 -0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.44 2dhk h HIS 107 Cb 0.03 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.51 2dhk h HIS 107 CO -0.05 0.22 -0.43 -0.91 0.86 0.00 0.00 177.93 177.62 2dhk h ASN 108 N -0.24 -1.03 -3.85 2.45 -0.26 -0.60 -3.43 115.58 108.62 2dhk h ASN 108 Ca -0.00 0.04 -0.53 0.00 -0.56 0.00 0.00 56.30 55.25 2dhk h ASN 108 Cb 0.23 0.27 0.08 0.00 -1.06 0.00 0.00 38.32 37.84 2dhk h ASN 108 CO 0.00 -0.73 0.71 -0.55 -1.06 0.00 0.00 177.43 175.80 2dhk s SER 109 N -4.14 6.58 0.08 5.81 0.15 0.47 -4.95 113.70 117.70 2dhk s SER 109 Ca -0.19 2.84 -0.31 0.00 0.70 0.00 0.00 55.95 58.99 2dhk s SER 109 Cb 0.03 -2.65 -0.07 0.00 -1.71 0.00 0.00 66.02 61.61 2dhk s SER 109 CO 0.61 -0.70 1.39 -2.16 1.20 0.00 0.00 173.24 173.58 2dhk s PRO 110 N -1.77 4.31 1.04 5.44 0.04 -1.26 -4.79 135.00 138.00 2dhk s PRO 110 Ca 0.52 2.03 -0.13 0.00 0.04 0.00 0.00 61.00 63.45 2dhk s PRO 110 Cb -0.43 -3.37 0.21 0.00 0.04 0.00 0.00 34.50 30.95 2dhk s PRO 110 CO 0.56 -0.48 1.10 -1.25 0.04 0.00 0.00 177.00 176.97 2dhk s PRO 111 N 1.55 0.12 0.57 0.56 0.04 -1.26 -5.01 135.00 131.57 2dhk s PRO 111 Ca 0.64 0.41 -0.19 0.00 0.04 0.00 0.00 61.00 61.91 2dhk s PRO 111 Cb -0.35 -1.71 -0.05 0.00 0.04 0.00 0.00 34.50 32.44 2dhk s PRO 111 CO 0.29 -2.92 1.13 0.00 0.04 0.00 0.00 177.00 175.55 2dhk s ALA 112 N -2.97 2.64 0.17 8.56 0.00 -1.26 -4.93 121.76 123.97 2dhk s ALA 112 Ca 0.66 0.79 0.29 0.00 0.00 0.00 0.00 51.96 53.70 2dhk s ALA 112 Cb -0.18 -3.36 1.24 0.00 0.00 0.00 0.00 23.12 20.82 2dhk s ALA 112 CO 0.57 -0.89 1.95 -1.00 0.00 0.00 0.00 175.76 176.39 2dhk h PRO 113 N 0.96 0.00 -0.61 0.00 0.13 -2.06 -3.22 132.00 127.20 2dhk h PRO 113 Ca -0.49 0.00 0.12 0.00 -0.87 0.00 0.00 66.00 64.76 2dhk h PRO 113 Cb 1.26 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.27 2dhk h PRO 113 CO 0.56 0.10 -0.18 0.77 -0.23 0.00 0.00 178.00 179.03 2dhk h SER 114 N 0.00 -0.65 -3.92 1.44 0.02 -2.05 -3.48 113.55 104.91 2dhk h SER 114 Ca -0.00 0.19 0.06 0.00 -0.84 0.00 0.00 61.79 61.20 2dhk h SER 114 Cb 0.57 0.41 -0.03 0.00 0.14 0.00 0.00 62.40 63.48 2dhk h SER 114 CO 0.01 -0.22 -0.20 0.61 -1.14 0.00 0.00 176.83 175.89 2dhk n GLY 115 N -1.43 -2.49 3.77 -3.77 0.00 -1.22 -4.64 105.19 95.41 2dhk n GLY 115 Ca 0.07 -1.40 -0.35 0.00 0.00 0.00 0.00 46.02 44.34 2dhk n GLY 115 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dhk s PRO 116 N -2.84 3.35 -1.36 1.61 0.04 -1.26 -3.55 135.00 130.99 2dhk s PRO 116 Ca 0.00 1.61 -0.08 0.00 0.04 0.00 0.00 61.00 62.57 2dhk s PRO 116 Cb 0.00 -2.01 0.02 0.00 0.04 0.00 0.00 34.50 32.56 2dhk s PRO 116 CO 0.00 -0.85 1.08 0.45 0.04 0.00 0.00 177.00 177.72 2dhk n SER 117 N -1.31 -4.89 -4.58 6.66 2.88 -1.26 -4.87 113.62 106.25 2dhk n SER 117 Ca 0.12 -0.62 -0.41 0.00 -1.33 0.00 0.00 58.87 56.62 2dhk n SER 117 Cb 0.51 -4.76 -0.03 0.00 -0.75 0.00 0.00 64.21 59.18 2dhk n SER 117 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2dhk s SER 118 N -3.59 5.62 0.00 -3.46 0.01 -1.23 -5.24 113.70 105.81 2dhk s SER 118 Ca 0.45 1.12 0.00 0.00 1.31 0.00 0.00 55.95 58.83 2dhk s SER 118 Cb -0.21 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.50 2dhk s SER 118 CO 0.76 -1.96 0.00 0.61 0.41 0.00 0.00 173.24 173.06