#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 5.20 -0.23 1.61 0.01 -1.26 -5.10 113.70 113.93 2dhk s SER 2 Ca 0.00 0.67 -0.16 0.00 1.31 0.00 0.00 55.95 57.77 2dhk s SER 2 Cb 0.00 -1.48 0.07 0.00 0.21 0.00 0.00 66.02 64.82 2dhk s SER 2 CO 0.00 -1.36 0.59 -0.94 0.41 0.00 0.00 173.24 171.94 2dhk s SER 3 N -4.41 -0.72 -0.51 2.44 1.04 -1.26 -5.11 113.70 105.17 2dhk s SER 3 Ca 0.57 1.25 0.07 0.00 0.48 0.00 0.00 55.95 58.32 2dhk s SER 3 Cb -0.11 1.17 0.20 0.00 0.10 0.00 0.00 66.02 67.39 2dhk s SER 3 CO 0.46 -0.22 0.74 0.61 0.98 0.00 0.00 173.24 175.82 2dhk n GLY 4 N 3.73 -0.30 3.85 7.32 0.00 -1.26 -5.15 105.19 113.38 2dhk n GLY 4 Ca -0.19 0.30 -0.25 0.00 0.00 0.00 0.00 46.02 45.89 2dhk n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dhk s SER 5 N 0.32 5.74 -0.48 1.61 1.04 -1.26 -5.08 113.70 115.58 2dhk s SER 5 Ca 0.31 -0.09 -0.14 0.00 0.48 0.00 0.00 55.95 56.51 2dhk s SER 5 Cb 0.05 -1.55 0.10 0.00 0.10 0.00 0.00 66.02 64.71 2dhk s SER 5 CO -0.10 0.03 0.40 -0.55 0.98 0.00 0.00 173.24 174.00 2dhk s SER 6 N -3.38 6.01 0.00 7.02 0.15 -1.26 -4.96 113.70 117.27 2dhk s SER 6 Ca 0.32 -1.58 0.00 0.00 0.70 0.00 0.00 55.95 55.39 2dhk s SER 6 Cb -0.10 -2.13 0.00 0.00 -1.71 0.00 0.00 66.02 62.08 2dhk s SER 6 CO 0.25 -0.70 0.00 0.61 1.20 0.00 0.00 173.24 174.60 2dhk n GLY 7 N 5.13 0.70 2.04 9.45 0.00 -1.26 -4.61 105.19 116.63 2dhk n GLY 7 Ca -0.12 -1.84 -0.17 0.00 0.00 0.00 0.00 46.02 43.90 2dhk n GLY 7 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2dhk n LYS 8 N 0.91 1.90 -3.69 1.61 5.02 -1.26 -4.84 118.16 117.80 2dhk n LYS 8 Ca 0.00 -1.50 -0.05 0.00 -2.02 0.00 0.00 58.31 54.74 2dhk n LYS 8 Cb 0.00 -1.75 -0.02 0.00 -0.02 0.00 0.00 35.03 33.25 2dhk n LYS 8 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2dhk s LYS 9 N -1.12 1.12 -0.29 1.97 1.02 -1.26 -5.09 119.74 116.09 2dhk s LYS 9 Ca 0.40 -0.58 0.01 0.00 0.02 0.00 0.00 55.97 55.83 2dhk s LYS 9 Cb 0.26 0.41 0.08 0.00 -0.52 0.00 0.00 37.83 38.07 2dhk s LYS 9 CO -0.07 -0.51 0.02 -1.17 -0.92 0.00 0.00 175.35 172.70 2dhk s LEU 10 N -2.83 3.10 0.14 3.17 2.96 -1.26 -4.76 118.68 119.20 2dhk s LEU 10 Ca 0.10 -1.60 -0.02 0.00 -0.22 0.00 0.00 54.13 52.39 2dhk s LEU 10 Cb -0.01 -1.21 -0.03 0.00 0.50 0.00 0.00 46.19 45.43 2dhk s LEU 10 CO -0.01 -0.33 0.10 0.00 -1.32 0.00 0.00 176.35 174.80 2dhk n GLY 12 N -0.13 2.91 3.74 0.00 0.00 -0.24 -5.00 105.19 106.47 2dhk n GLY 12 Ca -0.05 -0.35 -0.41 0.00 0.00 0.00 0.00 46.02 45.22 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 -1.64 3.83 0.23 1.61 1.51 -1.26 -2.43 117.35 119.20 2dhk s TYR 13 Ca 0.00 1.73 0.02 0.00 -1.01 0.00 0.00 57.07 57.80 2dhk s TYR 13 Cb 0.00 -2.97 -0.05 0.00 -0.11 0.00 0.00 41.96 38.83 2dhk s TYR 13 CO 0.00 0.28 0.06 -0.51 -1.11 0.00 0.00 175.55 174.27 2dhk s LEU 14 N -0.26 1.82 -0.25 -1.29 1.43 -0.38 -4.86 118.68 114.88 2dhk s LEU 14 Ca 0.43 -1.31 -0.04 0.00 -1.03 0.00 0.00 54.13 52.19 2dhk s LEU 14 Cb -0.23 -0.02 0.01 0.00 0.03 0.00 0.00 46.19 45.98 2dhk s LEU 14 CO 0.28 -0.67 -0.02 -0.44 0.23 0.00 0.00 176.35 175.74 2dhk s SER 15 N -3.27 4.54 -0.12 2.29 0.01 -1.21 -0.72 113.70 115.22 2dhk s SER 15 Ca 0.33 -0.68 -0.24 0.00 1.31 0.00 0.00 55.95 56.66 2dhk s SER 15 Cb 0.07 -1.75 -0.03 0.00 0.21 0.00 0.00 66.02 64.53 2dhk s SER 15 CO 0.10 -0.11 0.77 -0.75 0.41 0.00 0.00 173.24 173.66 2dhk s LYS 16 N 1.42 4.36 -0.00 12.44 2.20 -0.17 -2.76 119.74 137.23 2dhk s LYS 16 Ca 0.03 0.94 -0.21 0.00 -0.36 0.00 0.00 55.97 56.37 2dhk s LYS 16 Cb -0.16 -3.52 -0.05 0.00 -1.51 0.00 0.00 37.83 32.59 2dhk s LYS 16 CO -0.02 -0.15 0.60 0.12 -0.36 0.00 0.00 175.35 175.54 2dhk s PHE 17 N 1.54 3.69 0.00 4.03 5.36 -0.37 -0.47 117.98 131.77 2dhk s PHE 17 Ca 0.38 1.21 0.00 0.00 -0.96 0.00 0.00 56.93 57.56 2dhk s PHE 17 Cb -0.17 -2.62 0.00 0.00 -0.34 0.00 0.00 43.02 39.89 2dhk s PHE 17 CO 0.15 0.35 0.00 0.41 -1.46 0.00 0.00 175.22 174.68 2dhk n GLY 18 N 2.42 2.01 6.35 13.12 0.00 0.09 -4.66 105.19 124.54 2dhk n GLY 18 Ca -0.07 0.46 0.00 0.00 0.00 0.00 0.00 46.02 46.42 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 0.00 0.51 3.55 -0.02 0.00 -1.26 -4.42 105.19 103.55 2dhk n GLY 19 Ca 0.00 0.57 -0.41 0.00 0.00 0.00 0.00 46.02 46.18 2dhk n GLY 19 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2dhk s LYS 20 N 0.00 3.47 0.00 1.61 2.36 -1.26 -4.83 119.74 121.08 2dhk s LYS 20 Ca 0.00 -0.92 0.00 0.00 -2.55 0.00 0.00 55.97 52.50 2dhk s LYS 20 Cb 0.00 -4.97 0.00 0.00 -1.05 0.00 0.00 37.83 31.81 2dhk s LYS 20 CO 0.00 -2.15 0.00 0.41 1.55 0.00 0.00 175.35 175.16 2dhk n GLY 21 N 6.33 4.41 0.19 5.54 0.00 -1.26 -4.96 105.19 115.45 2dhk n GLY 21 Ca 0.23 -1.12 0.05 0.00 0.00 0.00 0.00 46.02 45.18 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 0.00 1.61 0.13 -1.96 -3.45 132.00 128.33 2dhk h PRO 22 Ca 0.00 0.00 -0.25 0.00 -0.87 0.00 0.00 66.00 64.88 2dhk h PRO 22 Cb 0.00 0.00 0.05 0.00 0.13 0.00 0.00 31.00 31.18 2dhk h PRO 22 CO 0.00 0.36 0.09 0.44 -0.23 0.00 0.00 178.00 178.66 2dhk n ILE 23 N -3.73 0.00 -3.82 -3.56 -0.00 -1.26 -5.09 119.36 101.90 2dhk n ILE 23 Ca -0.01 -0.80 -0.30 0.00 -0.00 0.00 0.00 62.75 61.64 2dhk n ILE 23 Cb 0.45 -1.22 -0.15 0.00 -0.00 0.00 0.00 39.64 38.71 2dhk n ILE 23 CO 0.00 0.00 0.00 -0.13 -0.00 0.00 0.00 176.55 176.42 2dhk s ARG 24 N -3.98 1.01 0.05 6.28 1.81 -1.26 -4.64 118.95 118.22 2dhk s ARG 24 Ca 0.37 -1.07 -0.22 0.00 -1.72 0.00 0.00 55.73 53.09 2dhk s ARG 24 Cb -0.02 -2.31 0.05 0.00 -0.45 0.00 0.00 34.95 32.22 2dhk s ARG 24 CO 0.25 -0.84 0.51 0.20 -0.68 0.00 0.00 175.30 174.74 2dhk s GLY 25 N 1.50 -0.42 0.51 -3.53 0.00 -1.26 -4.77 107.32 99.36 2dhk s GLY 25 Ca 0.05 0.56 -0.20 0.00 0.00 0.00 0.00 44.72 45.13 2dhk s GLY 25 CO -0.16 0.27 1.08 -0.98 0.00 0.00 0.00 173.10 173.30 2dhk s TRP 26 N -2.51 2.86 -0.07 1.90 0.52 -1.26 -0.73 118.94 119.66 2dhk s TRP 26 Ca -0.05 1.56 -0.03 0.00 0.02 0.00 0.00 56.10 57.61 2dhk s TRP 26 Cb -0.01 -3.16 0.04 0.00 -1.15 0.00 0.00 33.47 29.20 2dhk s TRP 26 CO -0.02 -1.14 0.14 0.21 0.02 0.00 0.00 176.95 176.16 2dhk s LYS 27 N -3.26 0.07 -0.02 4.98 2.20 0.38 -4.91 119.74 119.18 2dhk s LYS 27 Ca 0.69 0.40 -0.30 0.00 -0.36 0.00 0.00 55.97 56.40 2dhk s LYS 27 Cb -0.19 -0.21 -0.07 0.00 -1.51 0.00 0.00 37.83 35.85 2dhk s LYS 27 CO 0.23 -0.19 1.88 -1.12 -0.36 0.00 0.00 175.35 175.78 2dhk s SER 28 N 1.39 6.43 0.04 1.43 0.01 -1.26 -1.00 113.70 120.73 2dhk s SER 28 Ca -0.07 2.43 0.02 0.00 1.31 0.00 0.00 55.95 59.64 2dhk s SER 28 Cb -0.12 -2.53 -0.02 0.00 0.21 0.00 0.00 66.02 63.56 2dhk s SER 28 CO -0.06 -1.10 -0.08 -0.60 0.41 0.00 0.00 173.24 171.81 2dhk s ARG 29 N 4.51 0.54 -0.38 12.44 6.06 0.10 -4.94 118.95 137.27 2dhk s ARG 29 Ca 0.84 -0.73 -0.17 0.00 -2.50 0.00 0.00 55.73 53.17 2dhk s ARG 29 Cb -0.38 -0.33 0.01 0.00 0.06 0.00 0.00 34.95 34.31 2dhk s ARG 29 CO 0.37 0.06 0.42 -0.46 -2.50 0.00 0.00 175.30 173.19 2dhk s TRP 30 N -1.30 3.19 -0.11 5.12 -0.00 0.11 -1.25 118.94 124.69 2dhk s TRP 30 Ca -0.09 -0.17 -0.03 0.00 -0.00 0.00 0.00 56.10 55.81 2dhk s TRP 30 Cb -0.10 -2.81 -0.03 0.00 -0.00 0.00 0.00 33.47 30.53 2dhk s TRP 30 CO 0.00 -0.58 0.00 -0.06 -0.00 0.00 0.00 176.95 176.32 2dhk s PHE 31 N 2.12 3.15 -0.15 5.86 0.40 -1.02 0.30 117.98 128.64 2dhk s PHE 31 Ca 0.13 0.09 -0.09 0.00 -0.60 0.00 0.00 56.93 56.46 2dhk s PHE 31 Cb -0.17 -1.86 0.05 0.00 0.51 0.00 0.00 43.02 41.56 2dhk s PHE 31 CO 0.13 0.34 0.37 -0.59 0.70 0.00 0.00 175.22 176.17 2dhk s PHE 32 N -0.50 -0.52 0.36 0.36 -0.12 0.12 -1.08 117.98 116.60 2dhk s PHE 32 Ca 0.09 1.15 -0.21 0.00 -0.05 0.00 0.00 56.93 57.91 2dhk s PHE 32 Cb -0.12 0.21 -0.10 0.00 -0.63 0.00 0.00 43.02 42.38 2dhk s PHE 32 CO 0.02 -0.30 0.88 -0.47 -0.05 0.00 0.00 175.22 175.30 2dhk s TYR 33 N 1.22 3.45 -0.14 3.49 6.14 0.36 -1.02 117.35 130.83 2dhk s TYR 33 Ca -0.08 1.54 -0.03 0.00 0.64 0.00 0.00 57.07 59.13 2dhk s TYR 33 Cb -0.08 -2.77 -0.03 0.00 0.42 0.00 0.00 41.96 39.50 2dhk s TYR 33 CO -0.10 0.06 -0.05 0.34 0.64 0.00 0.00 175.55 176.43 2dhk s ASP 34 N -2.02 4.71 -0.32 4.32 -1.08 0.04 -4.66 116.67 117.66 2dhk s ASP 34 Ca 0.56 -0.13 0.10 0.00 -0.52 0.00 0.00 52.55 52.55 2dhk s ASP 34 Cb -0.12 -1.71 0.76 0.00 -1.46 0.00 0.00 42.92 40.39 2dhk s ASP 34 CO 0.17 0.19 1.81 -1.84 0.52 0.00 0.00 175.17 176.02 2dhk n GLU 35 N 3.39 3.83 -0.05 4.34 0.28 -1.26 -3.15 120.64 128.01 2dhk n GLU 35 Ca -0.18 -3.11 -0.09 0.00 -0.16 0.00 0.00 57.16 53.63 2dhk n GLU 35 Cb 0.53 -2.23 -0.04 0.00 1.43 0.00 0.00 31.44 31.13 2dhk n GLU 35 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 2dhk n ARG 36 N -0.10 0.21 -0.12 3.44 1.74 -1.26 -4.74 116.66 115.83 2dhk n ARG 36 Ca 0.40 0.08 0.04 0.00 -0.77 0.00 0.00 57.85 57.60 2dhk n ARG 36 Cb 1.38 -0.95 0.10 0.00 -1.02 0.00 0.00 32.46 31.97 2dhk n ARG 36 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2dhk n LYS 37 N -3.20 2.88 -3.75 5.56 5.02 -1.26 -5.00 118.16 118.41 2dhk n LYS 37 Ca -0.18 -1.90 -0.25 0.00 -2.02 0.00 0.00 58.31 53.96 2dhk n LYS 37 Cb 0.64 -1.20 0.02 0.00 -0.02 0.00 0.00 35.03 34.47 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 -6.09 0.36 -0.42 0.00 -0.21 -1.21 -4.32 119.66 107.77 2dhk s GLN 39 Ca 0.15 -0.69 -0.19 0.00 0.02 0.00 0.00 55.36 54.65 2dhk s GLN 39 Cb -0.05 0.09 0.02 0.00 1.00 0.00 0.00 33.01 34.07 2dhk s GLN 39 CO 0.85 -0.05 0.53 -1.17 -2.12 0.00 0.00 175.29 173.32 2dhk s LEU 40 N -1.64 4.67 -0.01 2.90 2.96 -0.47 -0.78 118.68 126.30 2dhk s LEU 40 Ca -0.13 -0.48 0.00 0.00 -0.22 0.00 0.00 54.13 53.30 2dhk s LEU 40 Cb -0.08 -2.54 -0.04 0.00 0.50 0.00 0.00 46.19 44.03 2dhk s LEU 40 CO -0.02 -0.65 0.04 -0.31 -1.32 0.00 0.00 176.35 174.09 2dhk s TYR 41 N 2.44 3.20 -0.01 5.38 1.51 -0.19 -0.18 117.35 129.49 2dhk s TYR 41 Ca 0.17 0.16 -0.08 0.00 -1.01 0.00 0.00 57.07 56.32 2dhk s TYR 41 Cb -0.16 -1.72 0.01 0.00 -0.11 0.00 0.00 41.96 39.98 2dhk s TYR 41 CO 0.16 0.51 0.16 1.52 -1.11 0.00 0.00 175.55 176.79 2dhk s TYR 42 N -1.11 -0.03 0.32 2.71 -0.85 -0.95 0.16 117.35 117.60 2dhk s TYR 42 Ca 0.20 0.03 0.05 0.00 -0.52 0.00 0.00 57.07 56.83 2dhk s TYR 42 Cb -0.12 -0.01 -0.02 0.00 0.38 0.00 0.00 41.96 42.19 2dhk s TYR 42 CO 0.11 -0.26 0.32 -1.13 -1.52 0.00 0.00 175.55 173.07 2dhk n SER 43 N 1.75 -0.83 -0.19 -0.18 3.41 0.15 -1.60 113.62 116.14 2dhk n SER 43 Ca -0.21 -2.99 -0.05 0.00 -0.26 0.00 0.00 58.87 55.36 2dhk n SER 43 Cb 0.56 1.79 0.04 0.00 -0.26 0.00 0.00 64.21 66.34 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 0.64 -3.01 4.33 3.08 -1.91 0.31 114.38 117.83 2dhk h ARG 44 Ca -0.23 -0.04 -0.07 0.00 0.07 0.00 0.00 59.98 59.71 2dhk h ARG 44 Cb 1.13 -0.15 -0.16 0.00 0.08 0.00 0.00 29.97 30.87 2dhk h ARG 44 CO 0.33 0.43 -0.08 0.95 -1.07 0.00 0.00 179.97 180.52 2dhk s THR 45 N -6.14 0.05 0.56 2.04 -4.23 -1.26 -3.84 115.64 102.82 2dhk s THR 45 Ca -0.13 -0.43 0.29 0.00 -1.18 0.00 0.00 61.69 60.23 2dhk s THR 45 Cb 0.13 -0.96 0.29 0.00 1.34 0.00 0.00 72.50 73.30 2dhk s THR 45 CO 0.74 -0.24 1.86 0.00 -0.54 0.00 0.00 174.62 176.45 2dhk h ALA 46 N 2.95 1.29 0.00 3.99 0.00 -1.92 0.31 119.26 125.88 2dhk h ALA 46 Ca -0.31 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.53 2dhk h ALA 46 Cb 1.21 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 2dhk h ALA 46 CO 0.43 -0.29 -0.31 1.96 0.00 0.00 0.00 179.25 181.05 2dhk h GLN 47 N 0.00 0.00 -6.10 0.00 7.50 -1.99 -3.40 115.11 111.13 2dhk h GLN 47 Ca 0.00 0.00 -0.51 0.00 0.50 0.00 0.00 58.65 58.64 2dhk h GLN 47 Cb 0.60 0.00 -0.07 0.00 0.05 0.00 0.00 27.48 28.05 2dhk h GLN 47 CO 0.00 0.31 1.19 0.34 -1.50 0.00 0.00 178.83 179.17 2dhk s ASP 48 N -6.46 5.91 0.66 1.46 -1.08 0.11 -4.82 116.67 112.46 2dhk s ASP 48 Ca -0.01 -0.64 0.36 0.00 -0.52 0.00 0.00 52.55 51.74 2dhk s ASP 48 Cb 0.12 -2.56 1.99 0.00 -1.46 0.00 0.00 42.92 41.02 2dhk s ASP 48 CO 0.67 -2.00 2.14 0.00 0.52 0.00 0.00 175.17 176.50 2dhk h ALA 49 N 11.13 1.25 -2.94 3.66 0.00 -1.85 -3.38 119.26 127.13 2dhk h ALA 49 Ca -0.06 -0.00 -0.66 0.00 0.00 0.00 0.00 54.91 54.19 2dhk h ALA 49 Cb 1.05 0.00 -0.23 0.00 0.00 0.00 0.00 17.79 18.61 2dhk h ALA 49 CO 1.30 -0.18 -0.61 -0.80 0.00 0.00 0.00 179.25 178.96 2dhk s ASN 50 N -4.91 5.24 0.09 0.00 0.01 -1.26 -5.07 114.94 109.03 2dhk s ASN 50 Ca -0.04 -0.36 -0.31 0.00 -0.71 0.00 0.00 52.86 51.44 2dhk s ASN 50 Cb 0.11 -1.94 -0.07 0.00 0.41 0.00 0.00 41.25 39.76 2dhk s ASN 50 CO 0.37 -0.10 1.38 -2.16 -1.51 0.00 0.00 177.10 175.08 2dhk s PRO 51 N 1.60 4.32 0.14 -0.60 0.04 -1.26 -4.87 135.00 134.38 2dhk s PRO 51 Ca 0.05 2.03 -0.18 0.00 0.04 0.00 0.00 61.00 62.95 2dhk s PRO 51 Cb -0.16 -3.31 0.03 0.00 0.04 0.00 0.00 34.50 31.10 2dhk s PRO 51 CO 0.04 -0.44 1.72 -0.07 0.04 0.00 0.00 177.00 178.29 2dhk h LEU 52 N 7.04 -0.07 -7.65 -3.56 3.38 -1.67 -3.46 115.31 109.32 2dhk h LEU 52 Ca -0.42 0.06 -0.06 0.00 0.09 0.00 0.00 57.88 57.56 2dhk h LEU 52 Cb 1.21 0.10 -0.12 0.00 0.09 0.00 0.00 40.66 41.93 2dhk h LEU 52 CO 0.86 -0.00 -0.12 -1.81 0.09 0.00 0.00 178.44 177.46 2dhk s ASP 53 N -5.26 -0.15 0.10 -0.43 1.01 -1.17 -5.05 116.67 105.72 2dhk s ASP 53 Ca -0.13 -0.51 0.06 0.00 0.71 0.00 0.00 52.55 52.68 2dhk s ASP 53 Cb 0.11 0.48 -0.03 0.00 1.01 0.00 0.00 42.92 44.49 2dhk s ASP 53 CO 0.70 -0.91 -0.16 -0.94 0.21 0.00 0.00 175.17 174.07 2dhk s SER 54 N -2.86 2.01 -0.13 0.27 1.04 -1.26 -2.23 113.70 110.54 2dhk s SER 54 Ca 0.08 -0.72 0.00 0.00 0.48 0.00 0.00 55.95 55.79 2dhk s SER 54 Cb 0.02 -0.08 0.02 0.00 0.10 0.00 0.00 66.02 66.08 2dhk s SER 54 CO -0.07 -0.08 -0.12 -0.63 0.98 0.00 0.00 173.24 173.33 2dhk s ILE 55 N -1.62 1.33 -0.58 -1.02 1.09 0.74 -4.95 121.20 116.20 2dhk s ILE 55 Ca 0.05 -0.49 -0.27 0.00 -1.10 0.00 0.00 60.65 58.83 2dhk s ILE 55 Cb -0.08 -1.28 -0.01 0.00 -1.06 0.00 0.00 42.46 40.04 2dhk s ILE 55 CO 0.03 0.42 1.70 -0.62 -0.10 0.00 0.00 174.94 176.36 2dhk s ASP 56 N 1.49 5.62 0.53 3.58 -1.08 -1.26 -1.37 116.67 124.17 2dhk s ASP 56 Ca 0.03 0.35 0.27 0.00 -0.52 0.00 0.00 52.55 52.69 2dhk s ASP 56 Cb -0.13 -2.54 1.48 0.00 -1.46 0.00 0.00 42.92 40.27 2dhk s ASP 56 CO -0.08 -2.10 2.09 -0.07 0.52 0.00 0.00 175.17 175.52 2dhk h LEU 57 N 15.03 0.00 -0.88 -1.34 3.38 -1.91 -2.90 115.31 126.69 2dhk h LEU 57 Ca -0.27 0.00 0.23 0.00 0.09 0.00 0.00 57.88 57.93 2dhk h LEU 57 Cb 1.14 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.75 2dhk h LEU 57 CO 1.19 0.11 0.26 -1.28 0.09 0.00 0.00 178.44 178.81 2dhk h SER 58 N 0.00 0.05 -0.18 -0.43 0.87 -1.88 0.56 113.55 112.55 2dhk h SER 58 Ca -0.00 0.19 -0.09 0.00 -1.23 0.00 0.00 61.79 60.66 2dhk h SER 58 Cb 0.31 0.24 -0.05 0.00 -0.44 0.00 0.00 62.40 62.46 2dhk h SER 58 CO 0.01 -0.13 -0.25 -1.20 -0.53 0.00 0.00 176.83 174.73 2dhk n SER 59 N -5.20 2.20 -4.43 6.23 7.64 -1.11 -5.00 113.62 113.96 2dhk n SER 59 Ca 0.21 -3.76 -0.33 0.00 1.01 0.00 0.00 58.87 56.00 2dhk n SER 59 Cb 0.68 -0.57 -0.13 0.00 -1.01 0.00 0.00 64.21 63.17 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 -3.20 2.79 -0.19 -0.43 0.00 0.19 -4.45 121.76 116.47 2dhk s ALA 60 Ca 0.41 -0.86 -0.05 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 22.12 2dhk s ALA 60 CO -0.03 0.26 0.01 0.54 0.00 0.00 0.00 175.76 176.54 2dhk s VAL 61 N 0.29 4.09 -0.06 0.00 0.11 -0.53 -4.89 120.40 119.40 2dhk s VAL 61 Ca -0.07 -0.27 -0.15 0.00 -2.93 0.00 0.00 61.98 58.56 2dhk s VAL 61 Cb -0.15 -2.84 -0.05 0.00 -1.53 0.00 0.00 36.38 31.81 2dhk s VAL 61 CO 0.04 0.44 0.40 -0.36 -3.33 0.00 0.00 175.10 172.29 2dhk s PHE 62 N 0.78 3.62 0.17 1.54 0.08 -1.26 0.35 117.98 123.25 2dhk s PHE 62 Ca 0.01 0.88 0.01 0.00 0.12 0.00 0.00 56.93 57.94 2dhk s PHE 62 Cb -0.14 -2.36 -0.04 0.00 -0.57 0.00 0.00 43.02 39.91 2dhk s PHE 62 CO 0.02 0.45 0.03 0.34 -0.10 0.00 0.00 175.22 175.96 2dhk s ASP 63 N -0.34 0.93 -0.05 1.36 2.15 0.18 -4.97 116.67 115.92 2dhk s ASP 63 Ca 0.23 -1.20 0.06 0.00 0.43 0.00 0.00 52.55 52.07 2dhk s ASP 63 Cb -0.15 0.18 -0.01 0.00 -0.30 0.00 0.00 42.92 42.63 2dhk s ASP 63 CO 0.10 -0.63 -0.25 0.00 -0.17 0.00 0.00 175.17 174.22 2dhk s LYS 65 N -0.27 -2.15 0.15 0.00 -0.14 -0.92 -4.94 119.74 111.49 2dhk s LYS 65 Ca -0.00 0.05 -0.01 0.00 -1.36 0.00 0.00 55.97 54.65 2dhk s LYS 65 Cb -0.13 -1.48 -0.03 0.00 -1.68 0.00 0.00 37.83 34.52 2dhk s LYS 65 CO 0.03 -4.34 1.36 0.00 -0.76 0.00 0.00 175.35 171.63 2dhk h ALA 66 N -3.03 0.48 -0.54 5.17 0.00 -2.01 -3.15 119.26 116.17 2dhk h ALA 66 Ca -0.44 -0.70 -0.28 0.00 0.00 0.00 0.00 54.91 53.49 2dhk h ALA 66 Cb 1.32 -0.05 -0.17 0.00 0.00 0.00 0.00 17.79 18.89 2dhk h ALA 66 CO 0.31 0.85 0.36 -0.25 0.00 0.00 0.00 179.25 180.52 2dhk n ASP 67 N -3.72 3.41 0.18 0.00 9.92 -1.26 -4.52 116.55 120.56 2dhk n ASP 67 Ca -0.05 -2.87 0.15 0.00 -0.53 0.00 0.00 54.79 51.49 2dhk n ASP 67 Cb 0.80 -0.68 0.53 0.00 -0.64 0.00 0.00 41.12 41.13 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 1.46 1.96 -0.54 2.24 0.00 -1.82 -0.87 119.26 121.70 2dhk h ALA 68 Ca 0.35 -0.01 0.16 0.00 0.00 0.00 0.00 54.91 55.40 2dhk h ALA 68 Cb 2.02 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.81 2dhk h ALA 68 CO 0.60 -0.82 0.90 1.05 0.00 0.00 0.00 179.25 180.98 2dhk h GLU 69 N 0.00 0.00 0.05 0.00 4.11 -1.90 0.49 114.58 117.33 2dhk h GLU 69 Ca 0.13 0.00 -0.38 0.00 0.07 0.00 0.00 59.36 59.18 2dhk h GLU 69 Cb 1.49 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.69 2dhk h GLU 69 CO -0.00 0.00 -2.28 -1.91 0.07 0.00 0.00 179.01 174.88 2dhk n GLU 70 N -3.12 0.69 0.00 1.06 2.13 -0.33 -4.46 120.64 116.60 2dhk n GLU 70 Ca 0.12 0.20 0.00 0.00 0.66 0.00 0.00 57.16 58.14 2dhk n GLU 70 Cb 1.08 -1.59 0.00 0.00 0.27 0.00 0.00 31.44 31.20 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 2.12 0.24 3.25 8.31 0.00 0.17 -3.11 105.19 116.17 2dhk n GLY 71 Ca -0.41 -0.68 -0.28 0.00 0.00 0.00 0.00 46.02 44.64 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 0.00 1.78 0.25 -0.61 1.09 -1.26 0.67 121.20 123.12 2dhk s ILE 72 Ca 0.00 -0.96 -0.03 0.00 -1.10 0.00 0.00 60.65 58.56 2dhk s ILE 72 Cb 0.00 -1.48 -0.03 0.00 -1.06 0.00 0.00 42.46 39.90 2dhk s ILE 72 CO 0.00 0.50 0.27 0.72 -0.10 0.00 0.00 174.94 176.34 2dhk s PHE 73 N -0.50 1.04 -0.12 3.97 -0.71 -0.81 -2.16 117.98 118.68 2dhk s PHE 73 Ca 0.08 -1.25 -0.12 0.00 -1.04 0.00 0.00 56.93 54.60 2dhk s PHE 73 Cb -0.09 -0.34 0.03 0.00 -1.21 0.00 0.00 43.02 41.41 2dhk s PHE 73 CO -0.01 -0.82 0.34 -1.21 -1.34 0.00 0.00 175.22 172.19 2dhk s GLU 74 N -3.90 0.41 -0.29 1.99 2.02 0.99 -2.53 118.70 117.39 2dhk s GLU 74 Ca 0.34 0.44 -0.06 0.00 0.02 0.00 0.00 54.97 55.72 2dhk s GLU 74 Cb 0.04 0.20 0.02 0.00 0.10 0.00 0.00 34.13 34.48 2dhk s GLU 74 CO 0.14 -0.05 0.06 0.42 0.02 0.00 0.00 175.26 175.85 2dhk s ILE 75 N 0.11 3.75 -0.21 -1.63 1.01 -0.94 0.48 121.20 123.77 2dhk s ILE 75 Ca -0.01 -0.83 -0.25 0.00 0.00 0.00 0.00 60.65 59.56 2dhk s ILE 75 Cb -0.02 -2.96 -0.01 0.00 0.01 0.00 0.00 42.46 39.47 2dhk s ILE 75 CO 0.01 0.05 0.84 -0.54 0.00 0.00 0.00 174.94 175.30 2dhk s LYS 76 N 1.45 4.24 0.11 2.79 3.01 0.15 -2.21 119.74 129.29 2dhk s LYS 76 Ca 0.01 1.00 0.06 0.00 -1.01 0.00 0.00 55.97 56.03 2dhk s LYS 76 Cb -0.18 -3.61 -0.04 0.00 -1.01 0.00 0.00 37.83 33.00 2dhk s LYS 76 CO 0.01 -0.43 -0.14 0.95 0.51 0.00 0.00 175.35 176.26 2dhk s THR 77 N 2.52 1.25 -2.00 2.17 -4.23 -1.26 -1.45 115.64 112.64 2dhk s THR 77 Ca 0.37 -1.64 0.09 0.00 -1.18 0.00 0.00 61.69 59.33 2dhk s THR 77 Cb -0.16 -1.44 0.25 0.00 1.34 0.00 0.00 72.50 72.49 2dhk s THR 77 CO 0.10 -0.40 0.97 -0.81 -0.54 0.00 0.00 174.62 173.94 2dhk n PRO 78 N 0.66 0.49 -0.04 3.99 -0.04 -1.26 -3.23 135.00 135.57 2dhk n PRO 78 Ca -0.16 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.20 2dhk n PRO 78 Cb 0.57 -1.28 -0.03 0.00 -0.04 0.00 0.00 33.50 32.71 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 -0.78 0.77 -3.63 3.54 7.64 -1.26 -5.08 113.62 114.82 2dhk n SER 79 Ca 0.07 0.13 -0.03 0.00 1.01 0.00 0.00 58.87 60.04 2dhk n SER 79 Cb 0.03 -0.31 -0.07 0.00 -1.01 0.00 0.00 64.21 62.86 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 -2.19 0.47 -0.39 1.43 1.70 -1.20 -5.12 118.95 113.65 2dhk s ARG 80 Ca -0.13 0.84 -0.29 0.00 -0.47 0.00 0.00 55.73 55.68 2dhk s ARG 80 Cb 0.05 0.12 0.00 0.00 -0.57 0.00 0.00 34.95 34.55 2dhk s ARG 80 CO 0.16 -0.10 1.48 0.08 -1.08 0.00 0.00 175.30 175.84 2dhk s VAL 81 N 1.49 3.84 0.37 4.99 1.01 -1.26 -4.15 120.40 126.70 2dhk s VAL 81 Ca -0.09 0.86 -0.06 0.00 0.00 0.00 0.00 61.98 62.69 2dhk s VAL 81 Cb -0.04 -4.10 -0.05 0.00 0.00 0.00 0.00 36.38 32.19 2dhk s VAL 81 CO -0.16 -0.67 0.67 -0.63 0.00 0.00 0.00 175.10 174.30 2dhk s ILE 82 N 5.60 4.93 -0.27 2.22 -1.09 -0.94 -4.97 121.20 126.68 2dhk s ILE 82 Ca 0.64 0.22 -0.01 0.00 -2.23 0.00 0.00 60.65 59.27 2dhk s ILE 82 Cb -0.16 -3.77 0.09 0.00 -1.58 0.00 0.00 42.46 37.04 2dhk s ILE 82 CO 0.32 -0.52 0.07 -0.89 -1.23 0.00 0.00 174.94 172.69 2dhk s THR 83 N -2.34 0.78 -0.02 2.92 2.01 -1.26 -2.21 115.64 115.52 2dhk s THR 83 Ca 0.47 -1.13 0.08 0.00 0.31 0.00 0.00 61.69 61.42 2dhk s THR 83 Cb -0.10 -1.47 -0.02 0.00 0.01 0.00 0.00 72.50 70.92 2dhk s THR 83 CO 0.34 -0.51 -0.25 -0.76 -0.69 0.00 0.00 174.62 172.75 2dhk s LEU 84 N 1.69 2.06 0.06 4.42 1.43 -1.05 -1.24 118.68 126.05 2dhk s LEU 84 Ca 0.06 -0.46 0.07 0.00 -1.03 0.00 0.00 54.13 52.77 2dhk s LEU 84 Cb -0.17 -1.29 -0.03 0.00 0.03 0.00 0.00 46.19 44.72 2dhk s LEU 84 CO -0.20 0.30 -0.18 -1.59 0.23 0.00 0.00 176.35 174.92 2dhk s LYS 85 N -0.63 2.00 0.39 1.70 -2.85 -1.11 -1.93 119.74 117.31 2dhk s LYS 85 Ca 0.10 -1.03 0.04 0.00 -1.00 0.00 0.00 55.97 54.08 2dhk s LYS 85 Cb -0.10 -2.17 0.07 0.00 -2.06 0.00 0.00 37.83 33.57 2dhk s LYS 85 CO -0.01 0.52 0.54 0.00 0.10 0.00 0.00 175.35 176.51 2dhk n ALA 86 N 1.34 0.54 0.13 0.59 0.00 0.21 -3.31 120.51 120.01 2dhk n ALA 86 Ca -0.16 -1.27 -0.05 0.00 0.00 0.00 0.00 53.44 51.96 2dhk n ALA 86 Cb 0.52 0.30 -0.03 0.00 0.00 0.00 0.00 19.45 20.25 2dhk n ALA 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dhk h ALA 87 N -0.02 -0.59 -4.84 0.00 0.00 -1.87 -3.44 119.26 108.50 2dhk h ALA 87 Ca -0.18 -0.08 -0.53 0.00 0.00 0.00 0.00 54.91 54.12 2dhk h ALA 87 Cb 0.77 0.14 -0.11 0.00 0.00 0.00 0.00 17.79 18.59 2dhk h ALA 87 CO 0.23 -0.56 -0.40 0.25 0.00 0.00 0.00 179.25 178.76 2dhk n THR 88 N -3.67 0.00 -0.21 0.00 -2.24 -1.25 -4.70 114.28 102.21 2dhk n THR 88 Ca -0.04 -2.04 -0.08 0.00 -2.27 0.00 0.00 64.05 59.62 2dhk n THR 88 Cb 0.14 0.52 0.03 0.00 -2.10 0.00 0.00 70.33 68.91 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 0.93 0.00 -0.78 1.63 -1.76 -1.98 116.57 114.61 2dhk h LYS 89 Ca -0.33 -0.20 0.00 0.00 -0.85 0.00 0.00 60.65 59.28 2dhk h LYS 89 Cb 1.07 -0.14 0.00 0.00 -0.60 0.00 0.00 32.23 32.56 2dhk h LYS 89 CO 0.54 0.82 0.00 0.94 -3.45 0.00 0.00 179.45 178.30 2dhk n GLN 90 N -4.41 0.19 0.09 1.90 7.27 -1.26 -3.18 117.38 117.99 2dhk n GLN 90 Ca 0.03 0.37 -0.04 0.00 0.07 0.00 0.00 57.00 57.43 2dhk n GLN 90 Cb 0.20 -1.83 -0.02 0.00 2.41 0.00 0.00 30.24 31.00 2dhk n GLN 90 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2dhk h ALA 91 N 2.34 -0.45 -0.59 1.69 0.00 -1.75 -3.27 119.26 117.23 2dhk h ALA 91 Ca 0.00 -0.06 0.12 0.00 0.00 0.00 0.00 54.91 54.97 2dhk h ALA 91 Cb 0.42 0.11 -0.10 0.00 0.00 0.00 0.00 17.79 18.22 2dhk h ALA 91 CO 0.00 -0.43 0.02 0.00 0.00 0.00 0.00 179.25 178.84 2dhk h MET 92 N -0.61 0.13 -1.26 0.00 -0.00 -1.60 0.69 114.93 112.28 2dhk h MET 92 Ca -0.03 -0.01 0.40 0.00 -0.00 0.00 0.00 59.70 60.06 2dhk h MET 92 Cb 0.21 -0.03 -0.12 0.00 -0.00 0.00 0.00 31.60 31.66 2dhk h MET 92 CO 0.05 0.09 0.82 -0.07 -0.00 0.00 0.00 176.91 177.79 2dhk h LEU 93 N 0.14 0.28 -0.17 -0.10 3.38 -1.67 0.72 115.31 117.88 2dhk h LEU 93 Ca 0.31 0.13 -0.13 0.00 0.09 0.00 0.00 57.88 58.27 2dhk h LEU 93 Cb 0.48 0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.34 2dhk h LEU 93 CO -0.48 -0.13 -0.39 0.22 0.09 0.00 0.00 178.44 177.75 2dhk h TYR 94 N 0.14 0.73 0.02 1.13 3.20 -0.91 -1.66 116.97 119.62 2dhk h TYR 94 Ca 0.77 -0.27 -0.00 0.00 3.14 0.00 0.00 58.73 62.37 2dhk h TYR 94 Cb 2.37 -0.13 0.00 0.00 1.54 0.00 0.00 36.73 40.50 2dhk h TYR 94 CO -0.00 1.02 -0.01 -1.49 -1.64 0.00 0.00 178.16 176.03 2dhk h TRP 95 N 0.23 -0.03 -0.72 -3.82 4.06 0.44 0.19 115.95 116.30 2dhk h TRP 95 Ca 0.00 -0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 2dhk h TRP 95 Cb 0.99 0.01 -0.04 0.00 -1.00 0.00 0.00 29.16 29.13 2dhk h TRP 95 CO 0.09 0.21 0.47 -0.07 -3.56 0.00 0.00 178.44 175.58 2dhk h LEU 96 N -0.27 0.84 0.54 -4.49 3.38 -0.88 0.30 115.31 114.72 2dhk h LEU 96 Ca -0.00 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 2dhk h LEU 96 Cb 0.26 -0.21 0.01 0.00 0.09 0.00 0.00 40.66 40.80 2dhk h LEU 96 CO 0.01 0.62 -0.26 -0.61 0.09 0.00 0.00 178.44 178.28 2dhk h GLN 97 N 0.98 -0.70 0.53 1.13 5.75 -1.22 -2.98 115.11 118.59 2dhk h GLN 97 Ca 0.26 0.05 -0.02 0.00 -0.15 0.00 0.00 58.65 58.79 2dhk h GLN 97 Cb -0.09 0.16 -0.02 0.00 1.07 0.00 0.00 27.48 28.60 2dhk h GLN 97 CO -0.05 -0.41 -0.44 1.96 -2.65 0.00 0.00 178.83 177.24 2dhk h GLN 98 N -1.10 -0.91 -0.94 1.69 1.08 -0.58 -2.45 115.11 111.89 2dhk h GLN 98 Ca -0.07 0.06 0.29 0.00 -1.45 0.00 0.00 58.65 57.48 2dhk h GLN 98 Cb 0.62 0.21 -0.17 0.00 -0.05 0.00 0.00 27.48 28.08 2dhk h GLN 98 CO 0.12 -0.61 0.12 1.28 -0.95 0.00 0.00 178.83 178.80 2dhk n LEU 99 N -5.54 -0.01 0.32 1.46 4.77 0.10 0.06 117.00 118.16 2dhk n LEU 99 Ca -0.12 1.59 -0.17 0.00 -0.03 0.00 0.00 56.01 57.28 2dhk n LEU 99 Cb 0.43 -0.62 -0.09 0.00 -2.33 0.00 0.00 43.42 40.81 2dhk n LEU 99 CO 0.30 -1.65 0.68 1.56 -1.33 0.00 0.00 177.39 176.95 2dhk h GLN 100 N 0.00 -0.75 -0.82 3.23 4.20 -1.28 -2.76 115.11 116.94 2dhk h GLN 100 Ca 0.62 0.05 0.26 0.00 0.06 0.00 0.00 58.65 59.64 2dhk h GLN 100 Cb 1.38 0.17 -0.15 0.00 0.30 0.00 0.00 27.48 29.18 2dhk h GLN 100 CO -0.85 -0.50 0.15 -1.33 -0.67 0.00 0.00 178.83 175.63 2dhk n MET 101 N -5.43 -0.06 0.15 1.46 2.81 0.11 0.99 117.12 117.15 2dhk n MET 101 Ca -0.13 1.19 -0.14 0.00 -1.81 0.00 0.00 57.70 56.82 2dhk n MET 101 Cb 0.32 -1.97 -0.08 0.00 -0.71 0.00 0.00 33.22 30.78 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 -0.32 0.34 0.03 1.79 -1.32 -0.96 116.57 116.13 2dhk h LYS 102 Ca 0.56 0.02 -0.02 0.00 -2.18 0.00 0.00 60.65 59.03 2dhk h LYS 102 Cb 1.27 0.07 0.00 0.00 -1.58 0.00 0.00 32.23 31.99 2dhk h LYS 102 CO -0.73 -0.17 -0.16 -0.09 -1.08 0.00 0.00 179.45 177.22 2dhk h ARG 103 N -0.39 -0.44 -0.98 3.15 2.43 0.70 -3.24 114.38 115.62 2dhk h ARG 103 Ca -0.03 0.03 0.34 0.00 -0.81 0.00 0.00 59.98 59.51 2dhk h ARG 103 Cb 0.30 0.10 -0.17 0.00 -0.42 0.00 0.00 29.97 29.78 2dhk h ARG 103 CO 0.06 -0.29 0.42 2.35 -1.51 0.00 0.00 179.97 181.00 2dhk h TRP 104 N -0.92 0.65 -0.29 2.20 7.01 0.52 0.34 115.95 125.46 2dhk h TRP 104 Ca -0.05 0.05 0.07 0.00 2.11 0.00 0.00 58.89 61.06 2dhk h TRP 104 Cb 0.35 -0.12 -0.07 0.00 -2.10 0.00 0.00 29.16 27.22 2dhk h TRP 104 CO 0.02 -0.34 -0.15 0.93 -2.79 0.00 0.00 178.44 176.11 2dhk h GLU 105 N 0.13 -0.10 -0.91 2.65 4.39 -1.22 0.20 114.58 119.71 2dhk h GLU 105 Ca 0.73 0.01 0.10 0.00 0.34 0.00 0.00 59.36 60.54 2dhk h GLU 105 Cb 1.75 0.02 -0.08 0.00 -0.10 0.00 0.00 28.75 30.35 2dhk h GLU 105 CO -0.73 -0.07 0.56 0.35 -1.16 0.00 0.00 179.01 177.96 2dhk h PHE 106 N -0.10 1.01 -0.27 4.33 3.57 -0.36 0.44 116.94 125.57 2dhk h PHE 106 Ca 0.15 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.62 2dhk h PHE 106 Cb 0.34 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 38.75 2dhk h PHE 106 CO -0.34 0.43 -0.10 0.45 -2.23 0.00 0.00 178.31 176.52 2dhk h HIS 107 N 0.93 0.61 0.22 0.41 3.86 -0.95 -3.35 115.15 116.88 2dhk h HIS 107 Ca 0.44 -0.14 -0.01 0.00 -1.16 0.00 0.00 60.37 59.49 2dhk h HIS 107 Cb 0.37 -0.15 0.00 0.00 1.06 0.00 0.00 27.41 28.70 2dhk h HIS 107 CO -0.03 0.77 -0.11 -0.91 0.86 0.00 0.00 177.93 178.52 2dhk h ASN 108 N 0.28 -0.25 -2.90 2.45 -0.26 0.08 -3.43 115.58 111.55 2dhk h ASN 108 Ca 0.06 0.01 -0.55 0.00 -0.56 0.00 0.00 56.30 55.26 2dhk h ASN 108 Cb 0.60 0.07 -0.02 0.00 -1.06 0.00 0.00 38.32 37.91 2dhk h ASN 108 CO 0.03 -0.10 0.86 -0.55 -1.06 0.00 0.00 177.43 176.61 2dhk s SER 109 N -3.27 6.89 0.08 5.81 0.15 0.15 -4.98 113.70 118.53 2dhk s SER 109 Ca -0.04 1.96 -0.31 0.00 0.70 0.00 0.00 55.95 58.26 2dhk s SER 109 Cb 0.00 -2.55 -0.07 0.00 -1.71 0.00 0.00 66.02 61.69 2dhk s SER 109 CO 0.13 -0.73 1.38 -2.16 1.20 0.00 0.00 173.24 173.06 2dhk s PRO 110 N 2.88 4.32 1.10 5.44 0.04 -1.26 -4.58 135.00 142.93 2dhk s PRO 110 Ca 0.61 2.03 -0.16 0.00 0.04 0.00 0.00 61.00 63.53 2dhk s PRO 110 Cb -0.28 -3.35 0.24 0.00 0.04 0.00 0.00 34.50 31.15 2dhk s PRO 110 CO 0.23 -0.47 1.10 -1.25 0.04 0.00 0.00 177.00 176.65 2dhk s PRO 111 N 1.47 -0.39 0.44 0.56 0.04 -1.26 -4.96 135.00 130.90 2dhk s PRO 111 Ca 0.64 0.23 -0.24 0.00 0.04 0.00 0.00 61.00 61.68 2dhk s PRO 111 Cb -0.35 -1.67 -0.10 0.00 0.04 0.00 0.00 34.50 32.42 2dhk s PRO 111 CO 0.29 -3.22 0.98 0.00 0.04 0.00 0.00 177.00 175.09 2dhk n ALA 112 N -4.47 0.09 -2.04 8.56 0.00 -1.26 -4.83 120.51 116.56 2dhk n ALA 112 Ca 0.09 0.20 -0.35 0.00 0.00 0.00 0.00 53.44 53.37 2dhk n ALA 112 Cb 0.58 -2.07 -0.04 0.00 0.00 0.00 0.00 19.45 17.93 2dhk n ALA 112 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2dhk s PRO 113 N -2.06 2.60 0.45 0.00 0.04 -1.26 -4.97 135.00 129.79 2dhk s PRO 113 Ca 0.64 0.39 0.01 0.00 0.04 0.00 0.00 61.00 62.08 2dhk s PRO 113 Cb -0.54 -4.56 -0.00 0.00 0.04 0.00 0.00 34.50 29.44 2dhk s PRO 113 CO 0.56 -2.90 0.66 -1.12 0.04 0.00 0.00 177.00 174.24 2dhk s SER 114 N 8.13 5.83 0.00 6.66 0.01 -1.26 -5.11 113.70 127.96 2dhk s SER 114 Ca 0.68 0.25 0.00 0.00 1.31 0.00 0.00 55.95 58.19 2dhk s SER 114 Cb -0.11 -1.50 0.00 0.00 0.21 0.00 0.00 66.02 64.62 2dhk s SER 114 CO 0.15 -0.70 0.00 0.61 0.41 0.00 0.00 173.24 173.72 2dhk n GLY 115 N -2.06 -1.63 3.77 3.44 0.00 -1.26 -4.97 105.19 102.47 2dhk n GLY 115 Ca 0.01 -1.33 -0.38 0.00 0.00 0.00 0.00 46.02 44.32 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 3.99 -0.04 1.61 0.04 -1.26 -4.98 135.00 134.37 2dhk s PRO 116 Ca 0.00 1.86 -0.26 0.00 0.04 0.00 0.00 61.00 62.65 2dhk s PRO 116 Cb 0.00 -2.64 -0.21 0.00 0.04 0.00 0.00 34.50 31.70 2dhk s PRO 116 CO 0.00 -0.38 1.18 0.66 0.04 0.00 0.00 177.00 178.50 2dhk h SER 117 N 2.53 0.07 -1.96 6.66 4.64 -2.07 -3.45 113.55 119.96 2dhk h SER 117 Ca -0.49 -0.59 -0.51 0.00 -0.47 0.00 0.00 61.79 59.73 2dhk h SER 117 Cb 1.24 -0.02 -0.05 0.00 -0.31 0.00 0.00 62.40 63.26 2dhk h SER 117 CO 0.62 0.64 -0.50 -0.55 -0.87 0.00 0.00 176.83 176.18 2dhk s SER 118 N -5.88 5.16 0.00 4.97 0.15 -1.26 -5.30 113.70 111.53 2dhk s SER 118 Ca -0.16 -0.51 0.00 0.00 0.70 0.00 0.00 55.95 55.98 2dhk s SER 118 Cb 0.01 -1.01 0.00 0.00 -1.71 0.00 0.00 66.02 63.31 2dhk s SER 118 CO 0.69 -0.24 0.00 0.61 1.20 0.00 0.00 173.24 175.50