#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 7.35 0.16 1.61 0.01 -1.26 -4.92 113.70 116.65 2dhk s SER 2 Ca 0.00 1.62 0.00 0.00 1.31 0.00 0.00 55.95 58.88 2dhk s SER 2 Cb 0.00 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.69 2dhk s SER 2 CO 0.00 -0.14 0.00 -0.24 0.41 0.00 0.00 173.24 173.27 2dhk n SER 3 N 3.36 0.47 -0.33 2.44 2.88 -1.26 -5.16 113.62 116.02 2dhk n SER 3 Ca 0.03 0.25 0.00 0.00 -1.33 0.00 0.00 58.87 57.82 2dhk n SER 3 Cb 0.50 -0.01 0.00 0.00 -0.75 0.00 0.00 64.21 63.96 2dhk n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dhk n GLY 4 N 2.59 3.67 4.04 0.46 0.00 -1.26 -4.96 105.19 109.73 2dhk n GLY 4 Ca 0.00 -1.15 -0.27 0.00 0.00 0.00 0.00 46.02 44.60 2dhk n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dhk n SER 5 N -0.64 -0.53 -4.65 1.61 7.64 -1.26 -4.86 113.62 110.93 2dhk n SER 5 Ca 0.00 -1.04 -0.43 0.00 1.01 0.00 0.00 58.87 58.41 2dhk n SER 5 Cb 0.00 -2.82 -0.02 0.00 -1.01 0.00 0.00 64.21 60.36 2dhk n SER 5 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2dhk s SER 6 N -4.23 6.85 0.00 6.43 0.15 -1.26 -4.84 113.70 116.80 2dhk s SER 6 Ca 0.10 1.40 0.00 0.00 0.70 0.00 0.00 55.95 58.15 2dhk s SER 6 Cb -0.05 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.72 2dhk s SER 6 CO 0.91 -0.89 0.00 0.61 1.20 0.00 0.00 173.24 175.06 2dhk n GLY 7 N 3.90 3.01 2.82 9.45 0.00 -1.26 -5.11 105.19 118.00 2dhk n GLY 7 Ca 0.14 -0.17 -0.29 0.00 0.00 0.00 0.00 46.02 45.69 2dhk n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dhk s LYS 8 N -0.82 1.77 0.80 1.61 3.01 -1.26 -5.11 119.74 119.74 2dhk s LYS 8 Ca 0.00 -2.53 -0.16 0.00 -1.01 0.00 0.00 55.97 52.26 2dhk s LYS 8 Cb 0.00 -2.88 -0.14 0.00 -1.01 0.00 0.00 37.83 33.80 2dhk s LYS 8 CO 0.00 -1.18 -0.56 1.17 0.51 0.00 0.00 175.35 175.28 2dhk n LYS 9 N 3.00 0.00 -3.91 1.68 4.81 -1.26 -4.95 118.16 117.53 2dhk n LYS 9 Ca 0.11 0.00 -0.30 0.00 -0.87 0.00 0.00 58.31 57.25 2dhk n LYS 9 Cb 0.35 -0.95 -0.15 0.00 0.02 0.00 0.00 35.03 34.30 2dhk n LYS 9 CO 0.00 0.00 0.00 -1.17 1.17 0.00 0.00 177.40 177.40 2dhk s LEU 10 N 6.69 3.31 0.11 3.14 2.96 -1.26 -5.10 118.68 128.52 2dhk s LEU 10 Ca 0.43 -1.69 -0.04 0.00 -0.22 0.00 0.00 54.13 52.60 2dhk s LEU 10 Cb -0.26 -1.26 -0.03 0.00 0.50 0.00 0.00 46.19 45.14 2dhk s LEU 10 CO 0.74 -0.34 0.11 0.00 -1.32 0.00 0.00 176.35 175.53 2dhk n GLY 12 N -0.06 2.83 3.74 0.00 0.00 -0.39 -5.01 105.19 106.30 2dhk n GLY 12 Ca -0.10 -0.49 -0.41 0.00 0.00 0.00 0.00 46.02 45.03 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 3.88 0.27 1.61 1.51 -1.26 -2.39 117.35 118.97 2dhk s TYR 13 Ca 0.00 1.84 0.02 0.00 -1.01 0.00 0.00 57.07 57.92 2dhk s TYR 13 Cb 0.00 -3.03 -0.05 0.00 -0.11 0.00 0.00 41.96 38.77 2dhk s TYR 13 CO 0.00 0.28 0.12 -0.51 -1.11 0.00 0.00 175.55 174.33 2dhk s LEU 14 N -0.56 1.60 -0.23 -1.29 1.43 -0.87 -4.83 118.68 113.94 2dhk s LEU 14 Ca 0.44 -1.44 0.02 0.00 -1.03 0.00 0.00 54.13 52.12 2dhk s LEU 14 Cb -0.25 0.11 0.04 0.00 0.03 0.00 0.00 46.19 46.12 2dhk s LEU 14 CO 0.31 -0.79 -0.14 -0.44 0.23 0.00 0.00 176.35 175.52 2dhk s SER 15 N -3.32 3.91 -0.18 2.29 0.01 -1.24 -2.08 113.70 113.10 2dhk s SER 15 Ca 0.37 -1.06 -0.25 0.00 1.31 0.00 0.00 55.95 56.32 2dhk s SER 15 Cb 0.07 -1.53 -0.01 0.00 0.21 0.00 0.00 66.02 64.75 2dhk s SER 15 CO 0.15 -0.11 0.82 -0.75 0.41 0.00 0.00 173.24 173.76 2dhk s LYS 16 N 1.19 4.28 -0.45 12.44 2.20 -1.09 -3.26 119.74 135.05 2dhk s LYS 16 Ca -0.03 0.99 -0.26 0.00 -0.36 0.00 0.00 55.97 56.31 2dhk s LYS 16 Cb -0.17 -3.58 0.03 0.00 -1.51 0.00 0.00 37.83 32.60 2dhk s LYS 16 CO -0.08 -0.34 0.95 0.12 -0.36 0.00 0.00 175.35 175.64 2dhk s PHE 17 N 2.21 2.93 0.00 4.03 5.36 -0.72 -2.59 117.98 129.19 2dhk s PHE 17 Ca 0.37 0.47 0.00 0.00 -0.96 0.00 0.00 56.93 56.81 2dhk s PHE 17 Cb -0.16 -4.00 0.00 0.00 -0.34 0.00 0.00 43.02 38.52 2dhk s PHE 17 CO 0.12 -1.09 0.00 0.41 -1.46 0.00 0.00 175.22 173.19 2dhk n GLY 18 N 4.86 -0.60 0.00 13.12 0.00 -0.93 -4.72 105.19 116.91 2dhk n GLY 18 Ca 0.07 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.45 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 -0.01 0.19 0.38 -0.02 0.00 -1.26 -4.93 105.19 99.54 2dhk n GLY 19 Ca 0.00 -0.10 -0.03 0.00 0.00 0.00 0.00 46.02 45.89 2dhk n GLY 19 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2dhk n LYS 20 N -1.06 -0.26 0.00 1.61 4.76 -1.26 -4.91 118.16 117.04 2dhk n LYS 20 Ca 0.00 1.50 0.00 0.00 -2.87 0.00 0.00 58.31 56.94 2dhk n LYS 20 Cb 0.00 -2.22 0.00 0.00 -1.84 0.00 0.00 35.03 30.97 2dhk n LYS 20 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2dhk n GLY 21 N -1.43 -0.17 0.26 0.72 0.00 -1.26 -4.97 105.19 98.36 2dhk n GLY 21 Ca 0.09 0.51 0.15 0.00 0.00 0.00 0.00 46.02 46.76 2dhk n GLY 21 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dhk h PRO 22 N 0.00 0.00 -6.19 1.61 0.13 -2.03 -3.44 132.00 122.08 2dhk h PRO 22 Ca 0.00 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.55 2dhk h PRO 22 Cb 0.00 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 31.06 2dhk h PRO 22 CO 0.00 0.07 -0.57 0.96 -0.23 0.00 0.00 178.00 178.24 2dhk s ILE 23 N -3.73 4.51 -0.17 -3.56 -0.00 -1.26 -5.11 121.20 111.88 2dhk s ILE 23 Ca 0.00 -1.05 -0.12 0.00 -0.00 0.00 0.00 60.65 59.48 2dhk s ILE 23 Cb 0.10 -3.29 -0.05 0.00 -0.00 0.00 0.00 42.46 39.22 2dhk s ILE 23 CO 0.57 -0.09 0.23 -0.60 -0.00 0.00 0.00 174.94 175.04 2dhk s ARG 24 N -3.06 4.21 -0.06 0.37 3.52 -1.26 -4.41 118.95 118.26 2dhk s ARG 24 Ca 0.31 -0.03 -0.29 0.00 -0.13 0.00 0.00 55.73 55.58 2dhk s ARG 24 Cb -0.10 -3.42 0.10 0.00 -1.56 0.00 0.00 34.95 29.97 2dhk s ARG 24 CO 0.23 0.28 0.87 0.20 -0.81 0.00 0.00 175.30 176.07 2dhk s GLY 25 N 0.39 -0.42 -0.02 8.12 0.00 -1.26 -4.83 107.32 109.30 2dhk s GLY 25 Ca 0.13 1.44 -0.30 0.00 0.00 0.00 0.00 44.72 45.99 2dhk s GLY 25 CO 0.02 0.71 1.20 -0.98 0.00 0.00 0.00 173.10 174.05 2dhk s TRP 26 N -2.01 3.26 -0.01 1.90 0.52 -1.26 -2.19 118.94 119.14 2dhk s TRP 26 Ca -0.01 1.24 0.08 0.00 0.02 0.00 0.00 56.10 57.43 2dhk s TRP 26 Cb -0.01 -3.42 -0.02 0.00 -1.15 0.00 0.00 33.47 28.88 2dhk s TRP 26 CO -0.02 -1.29 -0.25 -1.59 0.02 0.00 0.00 176.95 173.82 2dhk s LYS 27 N 1.89 2.08 -0.26 4.98 0.00 -1.07 -4.94 119.74 122.43 2dhk s LYS 27 Ca 0.57 -0.95 -0.29 0.00 0.00 0.00 0.00 55.97 55.30 2dhk s LYS 27 Cb -0.26 -2.05 0.00 0.00 0.00 0.00 0.00 37.83 35.52 2dhk s LYS 27 CO 0.24 0.56 1.19 -1.12 0.00 0.00 0.00 175.35 176.22 2dhk s SER 28 N -0.73 6.88 0.05 0.03 0.01 -1.26 -2.68 113.70 116.00 2dhk s SER 28 Ca 0.10 1.31 -0.01 0.00 1.31 0.00 0.00 55.95 58.67 2dhk s SER 28 Cb -0.10 -2.54 -0.04 0.00 0.21 0.00 0.00 66.02 63.55 2dhk s SER 28 CO -0.00 -0.88 -0.03 -0.60 0.41 0.00 0.00 173.24 172.13 2dhk s ARG 29 N 3.72 0.61 -0.26 12.44 6.06 -0.88 -5.02 118.95 135.61 2dhk s ARG 29 Ca 0.51 -1.19 -0.15 0.00 -2.50 0.00 0.00 55.73 52.40 2dhk s ARG 29 Cb -0.16 0.18 -0.04 0.00 0.06 0.00 0.00 34.95 34.99 2dhk s ARG 29 CO 0.16 -0.10 0.38 -0.46 -2.50 0.00 0.00 175.30 172.78 2dhk s TRP 30 N -3.76 3.26 -0.07 5.12 -0.11 0.16 -2.04 118.94 121.49 2dhk s TRP 30 Ca 0.06 0.43 0.02 0.00 1.22 0.00 0.00 56.10 57.83 2dhk s TRP 30 Cb 0.07 -2.57 -0.03 0.00 -1.50 0.00 0.00 33.47 29.45 2dhk s TRP 30 CO -0.09 -0.21 -0.11 -0.06 -4.62 0.00 0.00 176.95 171.86 2dhk s PHE 31 N 2.00 2.81 -0.14 5.86 0.40 -1.01 -0.21 117.98 127.69 2dhk s PHE 31 Ca 0.15 -0.19 -0.14 0.00 -0.60 0.00 0.00 56.93 56.15 2dhk s PHE 31 Cb -0.16 -1.71 0.04 0.00 0.51 0.00 0.00 43.02 41.70 2dhk s PHE 31 CO 0.10 0.15 0.39 -0.59 0.70 0.00 0.00 175.22 175.97 2dhk s PHE 32 N -0.52 -0.42 0.48 0.36 -0.12 0.13 -1.26 117.98 116.63 2dhk s PHE 32 Ca 0.07 1.01 -0.11 0.00 -0.05 0.00 0.00 56.93 57.85 2dhk s PHE 32 Cb -0.12 0.15 -0.06 0.00 -0.63 0.00 0.00 43.02 42.36 2dhk s PHE 32 CO 0.02 -0.22 0.87 -0.47 -0.05 0.00 0.00 175.22 175.36 2dhk s TYR 33 N 0.10 3.50 -0.26 3.49 5.04 -0.62 -0.08 117.35 128.51 2dhk s TYR 33 Ca -0.01 1.16 0.01 0.00 -2.44 0.00 0.00 57.07 55.78 2dhk s TYR 33 Cb -0.03 -2.55 0.07 0.00 0.35 0.00 0.00 41.96 39.80 2dhk s TYR 33 CO 0.01 -0.28 0.00 0.34 -1.34 0.00 0.00 175.55 174.28 2dhk s ASP 34 N -3.42 3.96 0.00 4.32 2.15 0.18 -4.79 116.67 119.07 2dhk s ASP 34 Ca 0.53 -1.40 0.25 0.00 0.43 0.00 0.00 52.55 52.36 2dhk s ASP 34 Cb -0.10 -1.14 1.19 0.00 -0.30 0.00 0.00 42.92 42.57 2dhk s ASP 34 CO 0.36 -0.30 1.83 -1.84 -0.17 0.00 0.00 175.17 175.06 2dhk n GLU 35 N 4.67 0.20 -0.03 4.34 0.28 -1.26 -0.96 120.64 127.89 2dhk n GLU 35 Ca -0.07 0.06 -0.15 0.00 -0.16 0.00 0.00 57.16 56.84 2dhk n GLU 35 Cb 0.44 -1.50 -0.09 0.00 1.43 0.00 0.00 31.44 31.71 2dhk n GLU 35 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2dhk h ARG 36 N 0.00 0.34 -0.09 3.44 2.47 -1.93 -3.33 114.38 115.28 2dhk h ARG 36 Ca 0.00 -0.27 0.00 0.00 -1.26 0.00 0.00 59.98 58.45 2dhk h ARG 36 Cb 0.33 0.05 0.00 0.00 -1.65 0.00 0.00 29.97 28.70 2dhk h ARG 36 CO 0.00 0.91 0.00 1.63 0.56 0.00 0.00 179.97 183.07 2dhk n LYS 37 N -4.43 2.43 -3.89 0.04 5.02 -1.22 -4.99 118.16 111.12 2dhk n LYS 37 Ca -0.08 -2.10 -0.26 0.00 -2.02 0.00 0.00 58.31 53.85 2dhk n LYS 37 Cb 0.50 -1.31 0.00 0.00 -0.02 0.00 0.00 35.03 34.20 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 -6.41 0.39 -0.34 0.00 -0.21 -0.55 -4.35 119.66 108.19 2dhk s GLN 39 Ca 0.19 -0.78 -0.16 0.00 0.02 0.00 0.00 55.36 54.63 2dhk s GLN 39 Cb -0.10 0.14 -0.01 0.00 1.00 0.00 0.00 33.01 34.04 2dhk s GLN 39 CO 0.86 -0.07 0.41 -1.17 -2.12 0.00 0.00 175.29 173.20 2dhk s LEU 40 N -1.86 4.40 0.11 2.90 2.96 -1.08 0.47 118.68 126.58 2dhk s LEU 40 Ca -0.10 -0.15 0.05 0.00 -0.22 0.00 0.00 54.13 53.72 2dhk s LEU 40 Cb -0.05 -2.43 -0.04 0.00 0.50 0.00 0.00 46.19 44.17 2dhk s LEU 40 CO -0.03 -0.38 0.04 -0.31 -1.32 0.00 0.00 176.35 174.34 2dhk s TYR 41 N 2.15 3.04 -0.04 5.38 1.51 0.89 -0.04 117.35 130.23 2dhk s TYR 41 Ca 0.14 -0.02 -0.09 0.00 -1.01 0.00 0.00 57.07 56.09 2dhk s TYR 41 Cb -0.16 -1.53 0.01 0.00 -0.11 0.00 0.00 41.96 40.17 2dhk s TYR 41 CO 0.12 0.50 0.21 1.52 -1.11 0.00 0.00 175.55 176.79 2dhk s TYR 42 N -1.46 -0.13 0.17 2.71 -0.85 -0.07 0.19 117.35 117.91 2dhk s TYR 42 Ca 0.28 0.26 0.03 0.00 -0.52 0.00 0.00 57.07 57.11 2dhk s TYR 42 Cb -0.11 0.04 -0.01 0.00 0.38 0.00 0.00 41.96 42.26 2dhk s TYR 42 CO 0.20 -0.24 0.18 -1.13 -1.52 0.00 0.00 175.55 173.04 2dhk n SER 43 N 2.05 -0.46 -0.02 -0.18 3.41 0.71 -1.32 113.62 117.80 2dhk n SER 43 Ca -0.18 -2.09 -0.10 0.00 -0.26 0.00 0.00 58.87 56.24 2dhk n SER 43 Cb 0.57 0.99 -0.04 0.00 -0.26 0.00 0.00 64.21 65.47 2dhk n SER 43 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 2dhk h ARG 44 N 0.00 0.10 0.00 4.33 3.08 -1.90 0.49 114.38 120.48 2dhk h ARG 44 Ca -0.13 -0.01 -0.34 0.00 0.07 0.00 0.00 59.98 59.58 2dhk h ARG 44 Cb 0.62 -0.02 -0.09 0.00 0.08 0.00 0.00 29.97 30.56 2dhk h ARG 44 CO 0.18 0.06 -0.29 0.25 -1.07 0.00 0.00 179.97 179.10 2dhk n THR 45 N -5.07 0.00 0.51 2.04 -2.24 -1.26 -3.65 114.28 104.61 2dhk n THR 45 Ca -0.04 -1.81 0.13 0.00 -2.27 0.00 0.00 64.05 60.06 2dhk n THR 45 Cb 0.07 0.96 0.32 0.00 -2.10 0.00 0.00 70.33 69.59 2dhk n THR 45 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2dhk h ALA 46 N 1.89 0.97 0.00 6.98 0.00 -1.94 -3.19 119.26 123.97 2dhk h ALA 46 Ca -0.20 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.58 2dhk h ALA 46 Cb 0.98 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 2dhk h ALA 46 CO 0.29 0.00 -0.59 1.96 0.00 0.00 0.00 179.25 180.91 2dhk h GLN 47 N 0.00 0.00 -4.30 0.00 7.50 -2.00 -3.38 115.11 112.93 2dhk h GLN 47 Ca 0.00 0.00 -0.68 0.00 0.50 0.00 0.00 58.65 58.47 2dhk h GLN 47 Cb 0.81 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 28.32 2dhk h GLN 47 CO 0.00 0.59 2.78 -0.25 -1.50 0.00 0.00 178.83 180.45 2dhk n ASP 48 N -3.30 3.53 -0.32 1.46 9.92 -1.21 -4.76 116.55 121.87 2dhk n ASP 48 Ca 0.01 -2.80 0.29 0.00 -0.53 0.00 0.00 54.79 51.77 2dhk n ASP 48 Cb 0.75 -1.51 0.52 0.00 -0.64 0.00 0.00 41.12 40.24 2dhk n ASP 48 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2dhk n ALA 49 N 6.88 0.98 -2.44 2.24 0.00 -1.26 -3.93 120.51 122.99 2dhk n ALA 49 Ca 0.51 0.78 -0.43 0.00 0.00 0.00 0.00 53.44 54.30 2dhk n ALA 49 Cb 0.40 -0.85 -0.02 0.00 0.00 0.00 0.00 19.45 18.98 2dhk n ALA 49 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2dhk s ASN 50 N -4.47 6.52 0.19 0.00 0.01 -1.26 -4.99 114.94 110.94 2dhk s ASN 50 Ca -0.07 0.87 -0.30 0.00 -0.71 0.00 0.00 52.86 52.65 2dhk s ASN 50 Cb 0.27 -2.54 -0.09 0.00 0.41 0.00 0.00 41.25 39.30 2dhk s ASN 50 CO 0.66 -1.27 1.31 -2.16 -1.51 0.00 0.00 177.10 174.13 2dhk s PRO 51 N 4.56 4.39 -0.02 -0.60 0.04 -1.25 -4.86 135.00 137.25 2dhk s PRO 51 Ca 0.56 2.04 -0.25 0.00 0.04 0.00 0.00 61.00 63.40 2dhk s PRO 51 Cb -0.13 -3.20 -0.18 0.00 0.04 0.00 0.00 34.50 31.02 2dhk s PRO 51 CO 0.29 -0.26 1.19 -0.07 0.04 0.00 0.00 177.00 178.19 2dhk h LEU 52 N 5.49 -0.11 -7.62 -3.56 3.38 -1.55 -3.47 115.31 107.86 2dhk h LEU 52 Ca -0.44 -0.38 -0.09 0.00 0.09 0.00 0.00 57.88 57.05 2dhk h LEU 52 Cb 1.21 0.03 -0.16 0.00 0.09 0.00 0.00 40.66 41.83 2dhk h LEU 52 CO 0.78 0.35 -0.28 -0.62 0.09 0.00 0.00 178.44 178.75 2dhk s ASP 53 N -5.50 -0.06 0.20 -0.43 -1.08 -0.98 -5.02 116.67 103.80 2dhk s ASP 53 Ca -0.15 -0.32 0.04 0.00 -0.52 0.00 0.00 52.55 51.60 2dhk s ASP 53 Cb 0.02 0.35 -0.05 0.00 -1.46 0.00 0.00 42.92 41.78 2dhk s ASP 53 CO 0.61 -0.65 -0.04 -0.55 0.52 0.00 0.00 175.17 175.06 2dhk s SER 54 N -2.28 1.80 -0.09 -0.34 0.15 -1.26 -0.89 113.70 110.78 2dhk s SER 54 Ca -0.02 -1.15 0.02 0.00 0.70 0.00 0.00 55.95 55.49 2dhk s SER 54 Cb 0.00 0.01 0.02 0.00 -1.71 0.00 0.00 66.02 64.34 2dhk s SER 54 CO -0.06 -0.45 -0.13 -0.63 1.20 0.00 0.00 173.24 173.17 2dhk s ILE 55 N -3.40 1.27 -0.49 6.45 1.09 0.94 -4.97 121.20 122.09 2dhk s ILE 55 Ca 0.24 -0.52 -0.27 0.00 -1.10 0.00 0.00 60.65 59.01 2dhk s ILE 55 Cb 0.05 -1.18 -0.03 0.00 -1.06 0.00 0.00 42.46 40.24 2dhk s ILE 55 CO 0.06 0.39 1.90 -0.62 -0.10 0.00 0.00 174.94 176.57 2dhk s ASP 56 N 0.96 5.41 0.15 3.58 -1.08 -1.26 -2.62 116.67 121.81 2dhk s ASP 56 Ca -0.08 0.79 0.13 0.00 -0.52 0.00 0.00 52.55 52.86 2dhk s ASP 56 Cb -0.15 -2.52 -0.10 0.00 -1.46 0.00 0.00 42.92 38.69 2dhk s ASP 56 CO -0.00 -2.18 1.17 -0.07 0.52 0.00 0.00 175.17 174.61 2dhk h LEU 57 N 15.74 0.00 -1.60 -1.34 3.38 -1.93 -3.29 115.31 126.27 2dhk h LEU 57 Ca -0.29 0.00 0.49 0.00 0.09 0.00 0.00 57.88 58.18 2dhk h LEU 57 Cb 1.18 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 41.81 2dhk h LEU 57 CO 1.14 0.73 1.04 0.77 0.09 0.00 0.00 178.44 182.21 2dhk h SER 58 N 0.00 0.14 -0.55 -0.43 4.64 -1.88 0.26 113.55 115.74 2dhk h SER 58 Ca -0.07 0.10 -0.35 0.00 -0.47 0.00 0.00 61.79 61.00 2dhk h SER 58 Cb 1.62 0.10 -0.41 0.00 -0.31 0.00 0.00 62.40 63.40 2dhk h SER 58 CO 0.08 -0.16 -1.02 -1.20 -0.87 0.00 0.00 176.83 173.67 2dhk n SER 59 N -4.47 2.74 -4.47 4.97 7.64 -1.25 -5.01 113.62 113.77 2dhk n SER 59 Ca 0.41 -2.63 -0.33 0.00 1.01 0.00 0.00 58.87 57.33 2dhk n SER 59 Cb 1.67 -0.43 -0.13 0.00 -1.01 0.00 0.00 64.21 64.31 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 -3.73 2.70 -0.25 -0.43 0.00 0.91 -4.38 121.76 116.57 2dhk s ALA 60 Ca 0.35 -0.95 -0.04 0.00 0.00 0.00 0.00 51.96 51.32 2dhk s ALA 60 Cb 0.35 -1.04 0.00 0.00 0.00 0.00 0.00 23.12 22.44 2dhk s ALA 60 CO -0.01 0.51 -0.01 0.54 0.00 0.00 0.00 175.76 176.79 2dhk s VAL 61 N -0.58 3.45 -0.02 0.00 0.11 -0.23 -4.94 120.40 118.19 2dhk s VAL 61 Ca 0.08 -0.64 -0.23 0.00 -2.93 0.00 0.00 61.98 58.26 2dhk s VAL 61 Cb -0.11 -2.66 -0.05 0.00 -1.53 0.00 0.00 36.38 32.03 2dhk s VAL 61 CO 0.01 0.29 0.69 -0.36 -3.33 0.00 0.00 175.10 172.41 2dhk s PHE 62 N 1.46 3.65 0.32 1.54 0.08 -1.26 -0.55 117.98 123.22 2dhk s PHE 62 Ca 0.04 1.30 0.03 0.00 0.12 0.00 0.00 56.93 58.42 2dhk s PHE 62 Cb -0.15 -2.76 -0.04 0.00 -0.57 0.00 0.00 43.02 39.49 2dhk s PHE 62 CO -0.02 0.20 0.12 0.34 -0.10 0.00 0.00 175.22 175.77 2dhk s ASP 63 N 0.32 1.86 -0.07 1.36 2.15 0.12 -4.96 116.67 117.45 2dhk s ASP 63 Ca 0.36 -1.51 0.03 0.00 0.43 0.00 0.00 52.55 51.87 2dhk s ASP 63 Cb -0.19 0.28 0.00 0.00 -0.30 0.00 0.00 42.92 42.71 2dhk s ASP 63 CO 0.19 -0.81 -0.18 0.00 -0.17 0.00 0.00 175.17 174.20 2dhk s LYS 65 N 0.38 -0.74 0.22 0.00 1.02 -1.07 -4.95 119.74 114.59 2dhk s LYS 65 Ca -0.13 0.08 0.01 0.00 0.02 0.00 0.00 55.97 55.95 2dhk s LYS 65 Cb -0.16 -1.64 0.19 0.00 -0.52 0.00 0.00 37.83 35.70 2dhk s LYS 65 CO 0.05 -3.42 1.53 0.00 -0.92 0.00 0.00 175.35 172.59 2dhk h ALA 66 N -2.38 0.78 -0.29 5.17 0.00 -2.01 -3.11 119.26 117.43 2dhk h ALA 66 Ca -0.48 -0.53 -0.18 0.00 0.00 0.00 0.00 54.91 53.72 2dhk h ALA 66 Cb 1.30 -0.08 -0.08 0.00 0.00 0.00 0.00 17.79 18.93 2dhk h ALA 66 CO 0.41 0.71 0.24 -0.25 0.00 0.00 0.00 179.25 180.36 2dhk n ASP 67 N -3.91 5.37 0.21 0.00 9.92 -1.26 -4.41 116.55 122.47 2dhk n ASP 67 Ca -0.03 -2.72 0.15 0.00 -0.53 0.00 0.00 54.79 51.66 2dhk n ASP 67 Cb 0.61 -0.97 0.75 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 1.39 1.00 -1.06 2.24 0.00 -1.81 -2.90 119.26 118.12 2dhk h ALA 68 Ca 0.18 0.00 0.31 0.00 0.00 0.00 0.00 54.91 55.39 2dhk h ALA 68 Cb 1.08 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.83 2dhk h ALA 68 CO 0.43 0.00 1.02 1.05 0.00 0.00 0.00 179.25 181.75 2dhk h GLU 69 N 0.00 0.00 0.01 0.00 4.11 -1.90 0.71 114.58 117.51 2dhk h GLU 69 Ca 0.00 0.00 -0.36 0.00 0.07 0.00 0.00 59.36 59.07 2dhk h GLU 69 Cb 0.10 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.29 2dhk h GLU 69 CO 0.00 0.00 -2.28 -1.91 0.07 0.00 0.00 179.01 174.89 2dhk n GLU 70 N -3.59 0.68 0.00 1.06 2.13 -1.09 -4.51 120.64 115.32 2dhk n GLU 70 Ca 0.23 0.09 0.00 0.00 0.66 0.00 0.00 57.16 58.14 2dhk n GLU 70 Cb 1.36 -1.57 0.00 0.00 0.27 0.00 0.00 31.44 31.49 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 1.85 0.53 3.39 8.31 0.00 0.25 -2.73 105.19 116.79 2dhk n GLY 71 Ca -0.33 -0.72 -0.32 0.00 0.00 0.00 0.00 46.02 44.65 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 -0.40 2.57 0.38 -0.61 1.09 -1.26 -0.03 121.20 122.93 2dhk s ILE 72 Ca 0.00 -0.91 0.06 0.00 -1.10 0.00 0.00 60.65 58.70 2dhk s ILE 72 Cb 0.00 -1.96 -0.02 0.00 -1.06 0.00 0.00 42.46 39.42 2dhk s ILE 72 CO 0.00 0.59 0.23 0.72 -0.10 0.00 0.00 174.94 176.37 2dhk s PHE 73 N -0.66 1.79 -0.14 3.97 -0.71 -0.74 -2.60 117.98 118.89 2dhk s PHE 73 Ca 0.11 -1.54 -0.10 0.00 -1.04 0.00 0.00 56.93 54.36 2dhk s PHE 73 Cb -0.10 -0.92 0.05 0.00 -1.21 0.00 0.00 43.02 40.84 2dhk s PHE 73 CO -0.00 -0.65 0.36 -1.21 -1.34 0.00 0.00 175.22 172.37 2dhk s GLU 74 N -3.50 0.36 -0.46 1.99 2.02 0.32 -3.16 118.70 116.27 2dhk s GLU 74 Ca 0.32 0.62 -0.11 0.00 0.02 0.00 0.00 54.97 55.82 2dhk s GLU 74 Cb 0.02 0.05 0.10 0.00 0.10 0.00 0.00 34.13 34.39 2dhk s GLU 74 CO 0.23 -0.11 0.34 0.42 0.02 0.00 0.00 175.26 176.15 2dhk s ILE 75 N 0.87 4.46 -0.25 -1.63 1.01 -0.14 0.15 121.20 125.68 2dhk s ILE 75 Ca -0.06 -1.51 -0.28 0.00 0.00 0.00 0.00 60.65 58.81 2dhk s ILE 75 Cb -0.06 -3.81 0.01 0.00 0.01 0.00 0.00 42.46 38.60 2dhk s ILE 75 CO -0.06 -0.66 0.97 -0.54 0.00 0.00 0.00 174.94 174.65 2dhk s LYS 76 N 1.45 4.21 0.09 2.79 3.01 0.29 -1.59 119.74 129.99 2dhk s LYS 76 Ca 0.04 1.18 0.06 0.00 -1.01 0.00 0.00 55.97 56.24 2dhk s LYS 76 Cb -0.25 -3.66 -0.03 0.00 -1.01 0.00 0.00 37.83 32.88 2dhk s LYS 76 CO 0.02 -0.63 -0.15 0.95 0.51 0.00 0.00 175.35 176.05 2dhk s THR 77 N 3.14 1.23 -2.00 2.17 -4.23 -1.26 -1.07 115.64 113.61 2dhk s THR 77 Ca 0.41 -1.46 0.11 0.00 -1.18 0.00 0.00 61.69 59.57 2dhk s THR 77 Cb -0.15 -1.26 0.30 0.00 1.34 0.00 0.00 72.50 72.74 2dhk s THR 77 CO 0.08 -0.28 1.07 -0.81 -0.54 0.00 0.00 174.62 174.14 2dhk n PRO 78 N 1.02 0.49 -0.05 3.99 -0.04 -1.26 -3.20 135.00 135.95 2dhk n PRO 78 Ca -0.19 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.17 2dhk n PRO 78 Cb 0.55 -1.34 -0.03 0.00 -0.04 0.00 0.00 33.50 32.63 2dhk n PRO 78 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2dhk n SER 79 N -0.84 0.74 -3.62 3.54 7.64 -1.26 -5.08 113.62 114.74 2dhk n SER 79 Ca 0.08 0.11 -0.03 0.00 1.01 0.00 0.00 58.87 60.04 2dhk n SER 79 Cb 0.04 -0.27 -0.06 0.00 -1.01 0.00 0.00 64.21 62.90 2dhk n SER 79 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dhk s ARG 80 N -2.17 0.48 0.02 1.43 1.70 -1.19 -5.14 118.95 114.07 2dhk s ARG 80 Ca -0.13 0.87 -0.30 0.00 -0.47 0.00 0.00 55.73 55.70 2dhk s ARG 80 Cb 0.05 0.16 -0.05 0.00 -0.57 0.00 0.00 34.95 34.54 2dhk s ARG 80 CO 0.17 -0.11 1.22 0.08 -1.08 0.00 0.00 175.30 175.58 2dhk s VAL 81 N 1.60 4.07 0.14 4.99 1.01 -1.26 -4.12 120.40 126.83 2dhk s VAL 81 Ca -0.09 1.46 0.06 0.00 0.00 0.00 0.00 61.98 63.42 2dhk s VAL 81 Cb -0.05 -3.94 -0.04 0.00 0.00 0.00 0.00 36.38 32.36 2dhk s VAL 81 CO -0.17 0.06 -0.01 -0.63 0.00 0.00 0.00 175.10 174.36 2dhk s ILE 82 N 1.58 3.80 -0.28 2.22 -1.09 -0.62 -4.99 121.20 121.83 2dhk s ILE 82 Ca 0.58 -1.27 -0.01 0.00 -2.23 0.00 0.00 60.65 57.73 2dhk s ILE 82 Cb -0.28 -2.87 0.08 0.00 -1.58 0.00 0.00 42.46 37.81 2dhk s ILE 82 CO 0.27 -0.02 0.06 -0.89 -1.23 0.00 0.00 174.94 173.12 2dhk s THR 83 N -1.55 1.00 0.07 2.92 2.01 -1.26 -0.96 115.64 117.87 2dhk s THR 83 Ca 0.26 -1.26 0.10 0.00 0.31 0.00 0.00 61.69 61.10 2dhk s THR 83 Cb -0.10 -1.62 -0.03 0.00 0.01 0.00 0.00 72.50 70.75 2dhk s THR 83 CO 0.18 -0.48 -0.26 -0.76 -0.69 0.00 0.00 174.62 172.61 2dhk s LEU 84 N 1.58 2.22 0.13 4.42 1.43 -1.19 -1.76 118.68 125.52 2dhk s LEU 84 Ca 0.05 -0.64 0.09 0.00 -1.03 0.00 0.00 54.13 52.61 2dhk s LEU 84 Cb -0.18 -1.23 -0.04 0.00 0.03 0.00 0.00 46.19 44.77 2dhk s LEU 84 CO -0.17 0.22 -0.22 -1.59 0.23 0.00 0.00 176.35 174.81 2dhk s LYS 85 N -1.49 1.28 0.45 1.70 -2.85 -1.20 -1.79 119.74 115.83 2dhk s LYS 85 Ca 0.12 -1.31 0.08 0.00 -1.00 0.00 0.00 55.97 53.85 2dhk s LYS 85 Cb -0.10 -1.58 -0.00 0.00 -2.06 0.00 0.00 37.83 34.09 2dhk s LYS 85 CO 0.03 0.36 0.44 0.00 0.10 0.00 0.00 175.35 176.28 2dhk s ALA 86 N -1.38 4.22 0.00 0.59 0.00 0.95 -3.62 121.76 122.52 2dhk s ALA 86 Ca 0.12 -1.81 0.00 0.00 0.00 0.00 0.00 51.96 50.28 2dhk s ALA 86 Cb -0.09 -1.09 0.00 0.00 0.00 0.00 0.00 23.12 21.94 2dhk s ALA 86 CO 0.06 -0.31 0.90 0.00 0.00 0.00 0.00 175.76 176.41 2dhk n ALA 87 N -1.67 -0.23 -4.13 0.00 0.00 -1.26 -4.66 120.51 108.55 2dhk n ALA 87 Ca 0.04 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.25 2dhk n ALA 87 Cb 0.62 0.19 -0.02 0.00 0.00 0.00 0.00 19.45 20.24 2dhk n ALA 87 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2dhk n THR 88 N -2.09 0.00 -0.31 0.00 -2.24 -1.26 -4.76 114.28 103.63 2dhk n THR 88 Ca 0.00 -1.73 -0.04 0.00 -2.27 0.00 0.00 64.05 60.00 2dhk n THR 88 Cb 0.00 0.08 0.09 0.00 -2.10 0.00 0.00 70.33 68.40 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 1.21 0.00 -0.78 1.63 -1.74 -2.13 116.57 114.76 2dhk h LYS 89 Ca -0.29 -0.18 -0.08 0.00 -0.85 0.00 0.00 60.65 59.26 2dhk h LYS 89 Cb 0.97 -0.22 -0.01 0.00 -0.60 0.00 0.00 32.23 32.37 2dhk h LYS 89 CO 0.47 0.93 -0.36 1.96 -3.45 0.00 0.00 179.45 178.99 2dhk h GLN 90 N 1.20 0.00 0.53 1.90 7.50 -1.93 -3.19 115.11 121.12 2dhk h GLN 90 Ca 0.29 0.00 -0.03 0.00 0.50 0.00 0.00 58.65 59.41 2dhk h GLN 90 Cb 0.12 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.65 2dhk h GLN 90 CO -0.04 0.36 -0.28 0.00 -1.50 0.00 0.00 178.83 177.38 2dhk h ALA 91 N 1.64 -1.18 -0.68 3.87 0.00 -1.77 -2.82 119.26 118.33 2dhk h ALA 91 Ca -0.00 -0.16 0.13 0.00 0.00 0.00 0.00 54.91 54.88 2dhk h ALA 91 Cb 0.97 0.33 -0.09 0.00 0.00 0.00 0.00 17.79 19.00 2dhk h ALA 91 CO 0.05 -1.13 0.20 0.00 0.00 0.00 0.00 179.25 178.37 2dhk h MET 92 N -0.74 0.32 -1.05 0.00 -0.00 -1.64 0.12 114.93 111.95 2dhk h MET 92 Ca -0.07 -0.02 0.30 0.00 -0.00 0.00 0.00 59.70 59.91 2dhk h MET 92 Cb 0.57 -0.07 -0.13 0.00 -0.00 0.00 0.00 31.60 31.98 2dhk h MET 92 CO 0.11 0.21 0.64 -0.07 -0.00 0.00 0.00 176.91 177.80 2dhk h LEU 93 N 0.33 0.51 -0.65 -0.10 3.38 -1.52 0.61 115.31 117.88 2dhk h LEU 93 Ca 0.36 0.14 -0.12 0.00 0.09 0.00 0.00 57.88 58.35 2dhk h LEU 93 Cb 0.55 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 2dhk h LEU 93 CO -0.41 -0.02 -0.27 0.22 0.09 0.00 0.00 178.44 178.05 2dhk h TYR 94 N 0.38 0.89 0.33 1.13 3.20 -0.71 -1.84 116.97 120.35 2dhk h TYR 94 Ca 0.68 -0.22 -0.02 0.00 3.14 0.00 0.00 58.73 62.32 2dhk h TYR 94 Cb 1.62 -0.21 0.00 0.00 1.54 0.00 0.00 36.73 39.69 2dhk h TYR 94 CO -0.01 0.95 -0.16 -1.49 -1.64 0.00 0.00 178.16 175.82 2dhk h TRP 95 N 0.67 -0.41 -0.95 -3.82 4.06 0.26 -0.96 115.95 114.79 2dhk h TRP 95 Ca 0.08 -0.01 0.14 0.00 2.06 0.00 0.00 58.89 61.16 2dhk h TRP 95 Cb 0.79 0.14 -0.08 0.00 -1.00 0.00 0.00 29.16 29.01 2dhk h TRP 95 CO 0.04 -0.08 0.60 -0.07 -3.56 0.00 0.00 178.44 175.38 2dhk h LEU 96 N -0.93 0.78 0.50 -4.49 3.38 -0.99 0.50 115.31 114.06 2dhk h LEU 96 Ca -0.05 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 2dhk h LEU 96 Cb 0.52 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.17 2dhk h LEU 96 CO 0.07 0.39 -0.24 -0.61 0.09 0.00 0.00 178.44 178.15 2dhk h GLN 97 N 0.82 -0.65 0.55 1.13 5.75 -1.34 -3.23 115.11 118.15 2dhk h GLN 97 Ca 0.48 0.04 -0.02 0.00 -0.15 0.00 0.00 58.65 59.01 2dhk h GLN 97 Cb 0.64 0.15 -0.01 0.00 1.07 0.00 0.00 27.48 29.33 2dhk h GLN 97 CO -0.25 -0.43 -0.42 1.96 -2.65 0.00 0.00 178.83 177.04 2dhk h GLN 98 N -1.04 -0.91 -0.77 1.69 1.08 -0.92 -2.31 115.11 111.92 2dhk h GLN 98 Ca -0.07 0.06 0.30 0.00 -1.45 0.00 0.00 58.65 57.49 2dhk h GLN 98 Cb 0.52 0.21 -0.11 0.00 -0.05 0.00 0.00 27.48 28.04 2dhk h GLN 98 CO 0.11 -0.61 0.45 1.28 -0.95 0.00 0.00 178.83 179.11 2dhk n LEU 99 N -5.53 0.20 -0.02 1.46 4.77 0.17 0.23 117.00 118.28 2dhk n LEU 99 Ca -0.12 1.04 -0.13 0.00 -0.03 0.00 0.00 56.01 56.77 2dhk n LEU 99 Cb 0.42 -0.51 -0.09 0.00 -2.33 0.00 0.00 43.42 40.92 2dhk n LEU 99 CO 0.31 -1.15 0.66 1.56 -1.33 0.00 0.00 177.39 177.43 2dhk h GLN 100 N 0.00 0.09 -0.81 3.23 4.20 -1.43 -3.24 115.11 117.15 2dhk h GLN 100 Ca 0.58 -0.04 0.14 0.00 0.06 0.00 0.00 58.65 59.38 2dhk h GLN 100 Cb 1.66 -0.00 -0.14 0.00 0.30 0.00 0.00 27.48 29.30 2dhk h GLN 100 CO -0.44 0.50 -0.28 -1.33 -0.67 0.00 0.00 178.83 176.61 2dhk n MET 101 N -4.81 -0.15 0.20 1.46 2.81 0.64 0.16 117.12 117.43 2dhk n MET 101 Ca -0.08 1.25 -0.12 0.00 -1.81 0.00 0.00 57.70 56.95 2dhk n MET 101 Cb 0.25 -1.86 -0.06 0.00 -0.71 0.00 0.00 33.22 30.83 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 -0.64 0.43 0.03 1.79 -1.57 0.67 116.57 117.29 2dhk h LYS 102 Ca 0.32 0.04 -0.02 0.00 -2.18 0.00 0.00 60.65 58.81 2dhk h LYS 102 Cb 0.52 0.15 0.00 0.00 -1.58 0.00 0.00 32.23 31.32 2dhk h LYS 102 CO -0.81 -0.43 -0.21 -0.09 -1.08 0.00 0.00 179.45 176.83 2dhk h ARG 103 N -0.66 -0.56 -0.94 3.15 2.43 -0.96 -3.08 114.38 113.75 2dhk h ARG 103 Ca -0.04 0.04 0.25 0.00 -0.81 0.00 0.00 59.98 59.41 2dhk h ARG 103 Cb 0.57 0.13 -0.18 0.00 -0.42 0.00 0.00 29.97 30.07 2dhk h ARG 103 CO -0.02 -0.37 -0.03 1.87 -1.51 0.00 0.00 179.97 179.90 2dhk n TRP 104 N -3.65 0.55 -0.24 2.20 -0.00 0.42 0.44 117.44 117.15 2dhk n TRP 104 Ca -0.07 1.14 -0.01 0.00 -0.00 0.00 0.00 57.50 58.56 2dhk n TRP 104 Cb 0.23 -1.18 0.06 0.00 -0.00 0.00 0.00 31.31 30.43 2dhk n TRP 104 CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 177.69 178.62 2dhk h GLU 105 N 0.00 -0.04 -0.01 5.87 4.39 -0.77 -0.02 114.58 123.99 2dhk h GLU 105 Ca 0.55 0.00 0.01 0.00 0.34 0.00 0.00 59.36 60.26 2dhk h GLU 105 Cb 1.08 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.73 2dhk h GLU 105 CO -0.90 -0.03 -0.03 0.35 -1.16 0.00 0.00 179.01 177.24 2dhk h PHE 106 N -0.04 -0.08 -0.58 4.33 3.57 0.00 -1.66 116.94 122.48 2dhk h PHE 106 Ca 0.32 0.00 0.17 0.00 3.53 0.00 0.00 57.97 61.99 2dhk h PHE 106 Cb 0.54 0.04 -0.02 0.00 2.79 0.00 0.00 35.95 39.30 2dhk h PHE 106 CO -0.61 -0.05 0.46 0.45 -2.23 0.00 0.00 178.31 176.33 2dhk h HIS 107 N -0.05 0.00 -0.17 0.41 3.86 -0.77 -0.60 115.15 117.82 2dhk h HIS 107 Ca 0.02 0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.18 2dhk h HIS 107 Cb 0.08 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.54 2dhk h HIS 107 CO -0.11 0.00 -0.08 -0.91 0.86 0.00 0.00 177.93 177.68 2dhk h ASN 108 N 0.00 0.37 -1.81 2.45 -0.26 -0.18 -3.46 115.58 112.70 2dhk h ASN 108 Ca 0.28 -0.41 -0.53 0.00 -0.56 0.00 0.00 56.30 55.07 2dhk h ASN 108 Cb 1.19 -0.10 0.18 0.00 -1.06 0.00 0.00 38.32 38.53 2dhk h ASN 108 CO -0.00 0.70 -1.20 -1.54 -1.06 0.00 0.00 177.43 174.33 2dhk n SER 109 N -4.61 -3.84 -4.64 5.81 3.41 -0.24 -4.77 113.62 104.75 2dhk n SER 109 Ca -0.05 0.49 -0.43 0.00 -0.26 0.00 0.00 58.87 58.62 2dhk n SER 109 Cb 0.31 -0.75 -0.03 0.00 -0.26 0.00 0.00 64.21 63.49 2dhk n SER 109 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 2dhk s PRO 110 N -1.13 3.93 0.46 4.33 0.04 -1.26 -5.01 135.00 136.36 2dhk s PRO 110 Ca 0.48 1.77 -0.08 0.00 0.04 0.00 0.00 61.00 63.21 2dhk s PRO 110 Cb -0.38 -3.99 0.11 0.00 0.04 0.00 0.00 34.50 30.28 2dhk s PRO 110 CO 0.63 -1.13 0.41 -0.35 0.04 0.00 0.00 177.00 176.60 2dhk n PRO 111 N 7.42 -1.83 -2.58 0.56 -0.04 -1.26 -5.01 135.00 132.26 2dhk n PRO 111 Ca 0.18 -0.65 -0.33 0.00 -0.04 0.00 0.00 63.50 62.65 2dhk n PRO 111 Cb 0.45 -0.62 -0.04 0.00 -0.04 0.00 0.00 33.50 33.25 2dhk n PRO 111 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2dhk s ALA 112 N -2.99 2.94 -0.52 0.55 0.00 -1.26 -4.96 121.76 115.52 2dhk s ALA 112 Ca 0.27 0.47 -0.27 0.00 0.00 0.00 0.00 51.96 52.43 2dhk s ALA 112 Cb -0.03 -3.20 -0.02 0.00 0.00 0.00 0.00 23.12 19.87 2dhk s ALA 112 CO 0.20 -0.20 1.80 -1.25 0.00 0.00 0.00 175.76 176.32 2dhk s PRO 113 N -3.38 2.90 0.45 0.00 0.04 -1.26 -4.98 135.00 128.78 2dhk s PRO 113 Ca 0.64 0.86 0.07 0.00 0.04 0.00 0.00 61.00 62.61 2dhk s PRO 113 Cb -0.13 -4.30 -0.02 0.00 0.04 0.00 0.00 34.50 30.08 2dhk s PRO 113 CO 0.20 -2.39 0.27 0.45 0.04 0.00 0.00 177.00 175.57 2dhk s SER 114 N 7.19 4.61 0.00 6.66 0.15 -1.26 -5.14 113.70 125.91 2dhk s SER 114 Ca 0.70 -1.06 0.00 0.00 0.70 0.00 0.00 55.95 56.29 2dhk s SER 114 Cb -0.15 -0.25 0.00 0.00 -1.71 0.00 0.00 66.02 63.91 2dhk s SER 114 CO 0.25 -0.72 0.00 0.61 1.20 0.00 0.00 173.24 174.59 2dhk n GLY 115 N -1.44 -0.25 3.75 9.45 0.00 -1.26 -4.91 105.19 110.53 2dhk n GLY 115 Ca -0.01 -0.07 -0.41 0.00 0.00 0.00 0.00 46.02 45.53 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 0.00 4.43 -0.37 1.61 0.04 -1.26 -5.02 135.00 134.43 2dhk s PRO 116 Ca 0.00 2.06 0.03 0.00 0.04 0.00 0.00 61.00 63.13 2dhk s PRO 116 Cb 0.00 -3.15 0.11 0.00 0.04 0.00 0.00 34.50 31.50 2dhk s PRO 116 CO 0.00 -0.13 0.10 -1.12 0.04 0.00 0.00 177.00 175.89 2dhk s SER 117 N -0.21 4.58 0.14 6.66 0.01 -1.26 -5.09 113.70 118.53 2dhk s SER 117 Ca 0.51 -2.26 -0.35 0.00 1.31 0.00 0.00 55.95 55.16 2dhk s SER 117 Cb -0.37 -1.53 -0.15 0.00 0.21 0.00 0.00 66.02 64.18 2dhk s SER 117 CO 0.44 -0.36 1.46 -1.54 0.41 0.00 0.00 173.24 173.65 2dhk n SER 118 N 4.10 2.45 0.00 2.44 3.41 -1.26 -5.28 113.62 119.48 2dhk n SER 118 Ca 0.04 1.10 0.00 0.00 -0.26 0.00 0.00 58.87 59.75 2dhk n SER 118 Cb 0.40 -1.33 0.00 0.00 -0.26 0.00 0.00 64.21 63.02 2dhk n SER 118 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49