#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 3.24 0.14 1.61 0.01 -1.26 -5.10 113.70 112.34 2dhk s SER 2 Ca 0.00 -0.60 -0.25 0.00 1.31 0.00 0.00 55.95 56.42 2dhk s SER 2 Cb 0.00 -1.49 0.06 0.00 0.21 0.00 0.00 66.02 64.81 2dhk s SER 2 CO 0.00 0.05 0.85 -0.44 0.41 0.00 0.00 173.24 174.11 2dhk s SER 3 N 1.03 -0.28 0.00 2.44 0.01 -1.26 -5.12 113.70 110.52 2dhk s SER 3 Ca -0.02 -0.30 0.00 0.00 1.31 0.00 0.00 55.95 56.94 2dhk s SER 3 Cb -0.14 0.53 0.00 0.00 0.21 0.00 0.00 66.02 66.61 2dhk s SER 3 CO -0.06 -0.93 0.00 0.61 0.41 0.00 0.00 173.24 173.27 2dhk n GLY 4 N -0.41 0.06 3.14 3.44 0.00 -1.26 -5.17 105.19 105.00 2dhk n GLY 4 Ca -0.08 -0.07 -0.11 0.00 0.00 0.00 0.00 46.02 45.76 2dhk n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dhk s SER 5 N 0.00 -0.15 0.07 1.61 0.15 -1.26 -5.16 113.70 108.96 2dhk s SER 5 Ca 0.00 0.74 -0.10 0.00 0.70 0.00 0.00 55.95 57.29 2dhk s SER 5 Cb 0.00 0.79 0.01 0.00 -1.71 0.00 0.00 66.02 65.11 2dhk s SER 5 CO 0.00 -0.21 0.23 -0.44 1.20 0.00 0.00 173.24 174.02 2dhk s SER 6 N 1.93 0.02 0.47 5.45 0.01 -1.26 -5.12 113.70 115.19 2dhk s SER 6 Ca -0.05 -0.45 0.00 0.00 1.31 0.00 0.00 55.95 56.77 2dhk s SER 6 Cb -0.11 0.34 0.00 0.00 0.21 0.00 0.00 66.02 66.46 2dhk s SER 6 CO -0.11 -0.66 0.00 0.61 0.41 0.00 0.00 173.24 173.49 2dhk n GLY 7 N 0.29 -3.89 3.52 3.44 0.00 -1.26 -4.63 105.19 102.66 2dhk n GLY 7 Ca -0.17 -0.92 -0.42 0.00 0.00 0.00 0.00 46.02 44.51 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 -5.01 3.60 -0.21 1.61 2.47 -1.26 -4.92 119.74 116.01 2dhk s LYS 8 Ca 0.00 -1.35 -0.17 0.00 -1.56 0.00 0.00 55.97 52.89 2dhk s LYS 8 Cb 0.00 -5.21 0.06 0.00 -1.46 0.00 0.00 37.83 31.22 2dhk s LYS 8 CO 0.00 -2.06 0.55 -1.59 0.16 0.00 0.00 175.35 172.41 2dhk s LYS 9 N 4.17 0.61 -0.24 4.03 -2.85 -1.26 -5.04 119.74 119.16 2dhk s LYS 9 Ca 0.41 0.85 -0.01 0.00 -1.00 0.00 0.00 55.97 56.23 2dhk s LYS 9 Cb -0.02 0.22 0.07 0.00 -2.06 0.00 0.00 37.83 36.04 2dhk s LYS 9 CO -0.10 -0.10 0.01 -1.17 0.10 0.00 0.00 175.35 174.09 2dhk s LEU 10 N 0.73 2.04 0.13 2.77 2.96 -1.26 -5.04 118.68 121.01 2dhk s LEU 10 Ca -0.03 -1.15 -0.04 0.00 -0.22 0.00 0.00 54.13 52.68 2dhk s LEU 10 Cb -0.05 -0.91 -0.03 0.00 0.50 0.00 0.00 46.19 45.70 2dhk s LEU 10 CO -0.05 -0.30 0.13 0.00 -1.32 0.00 0.00 176.35 174.81 2dhk n GLY 12 N -0.10 3.91 3.77 0.00 0.00 -0.88 -5.03 105.19 106.86 2dhk n GLY 12 Ca -0.08 -0.44 -0.36 0.00 0.00 0.00 0.00 46.02 45.14 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 -1.42 2.77 0.31 1.61 1.51 -1.26 -2.91 117.35 117.96 2dhk s TYR 13 Ca 0.00 1.54 0.00 0.00 -1.01 0.00 0.00 57.07 57.61 2dhk s TYR 13 Cb 0.00 -3.31 -0.02 0.00 -0.11 0.00 0.00 41.96 38.53 2dhk s TYR 13 CO 0.00 -1.49 0.35 -0.51 -1.11 0.00 0.00 175.55 172.79 2dhk s LEU 14 N -3.48 1.23 -0.16 -1.29 1.43 -0.35 -4.87 118.68 111.19 2dhk s LEU 14 Ca 0.69 -1.52 0.00 0.00 -1.03 0.00 0.00 54.13 52.27 2dhk s LEU 14 Cb -0.25 1.00 0.03 0.00 0.03 0.00 0.00 46.19 47.00 2dhk s LEU 14 CO 0.29 -1.13 -0.11 -0.44 0.23 0.00 0.00 176.35 175.19 2dhk s SER 15 N -3.25 2.88 -0.29 2.29 0.01 -1.15 -2.01 113.70 112.18 2dhk s SER 15 Ca 0.35 -0.62 -0.19 0.00 1.31 0.00 0.00 55.95 56.80 2dhk s SER 15 Cb 0.02 -1.13 -0.02 0.00 0.21 0.00 0.00 66.02 65.10 2dhk s SER 15 CO 0.21 -0.11 0.55 -0.75 0.41 0.00 0.00 173.24 173.54 2dhk s LYS 16 N 1.50 3.94 0.56 12.44 2.20 -1.25 -2.27 119.74 136.86 2dhk s LYS 16 Ca 0.02 0.23 -0.17 0.00 -0.36 0.00 0.00 55.97 55.69 2dhk s LYS 16 Cb -0.14 -3.70 -0.05 0.00 -1.51 0.00 0.00 37.83 32.42 2dhk s LYS 16 CO -0.09 -0.47 1.03 0.12 -0.36 0.00 0.00 175.35 175.58 2dhk s PHE 17 N 2.41 3.12 0.00 4.03 5.36 -0.60 -3.38 117.98 128.92 2dhk s PHE 17 Ca 0.22 1.51 0.00 0.00 -0.96 0.00 0.00 56.93 57.70 2dhk s PHE 17 Cb -0.15 -2.95 0.00 0.00 -0.34 0.00 0.00 43.02 39.57 2dhk s PHE 17 CO 0.11 -0.86 0.00 0.41 -1.46 0.00 0.00 175.22 173.41 2dhk n GLY 18 N -1.05 1.87 0.00 13.12 0.00 -1.07 -4.77 105.19 113.29 2dhk n GLY 18 Ca 0.08 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.83 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 1.00 4.44 -0.02 0.00 -1.26 -4.35 105.19 105.00 2dhk n GLY 19 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 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 0.00 -0.97 -4.34 1.61 5.02 -1.26 -4.91 118.16 113.32 2dhk n LYS 20 Ca 0.00 0.14 -0.29 0.00 -2.02 0.00 0.00 58.31 56.14 2dhk n LYS 20 Cb 0.00 -4.36 -0.06 0.00 -0.02 0.00 0.00 35.03 30.59 2dhk n LYS 20 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2dhk n GLY 21 N -1.60 3.57 0.06 0.72 0.00 -1.26 -5.07 105.19 101.61 2dhk n GLY 21 Ca -0.04 -2.35 -0.13 0.00 0.00 0.00 0.00 46.02 43.50 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 -0.02 -6.72 1.61 0.13 -1.95 -3.46 132.00 121.59 2dhk h PRO 22 Ca -0.37 0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 64.29 2dhk h PRO 22 Cb 1.14 0.00 0.04 0.00 0.13 0.00 0.00 31.00 32.32 2dhk h PRO 22 CO 0.62 0.46 -0.08 0.96 -0.23 0.00 0.00 178.00 179.73 2dhk s ILE 23 N -4.24 2.29 -0.20 -3.56 -0.00 -1.26 -5.11 121.20 109.13 2dhk s ILE 23 Ca -0.16 -0.90 -0.01 0.00 -0.00 0.00 0.00 60.65 59.58 2dhk s ILE 23 Cb 0.02 -2.39 0.01 0.00 -0.00 0.00 0.00 42.46 40.09 2dhk s ILE 23 CO 0.66 0.00 -0.14 -0.13 -0.00 0.00 0.00 174.94 175.34 2dhk s ARG 24 N -4.72 3.14 0.14 0.37 1.81 -1.26 -4.81 118.95 113.61 2dhk s ARG 24 Ca 0.62 -0.75 -0.19 0.00 -1.72 0.00 0.00 55.73 53.69 2dhk s ARG 24 Cb -0.06 -2.75 0.05 0.00 -0.45 0.00 0.00 34.95 31.74 2dhk s ARG 24 CO 0.39 -0.21 0.48 0.20 -0.68 0.00 0.00 175.30 175.48 2dhk s GLY 25 N 1.36 -0.38 0.37 -3.53 0.00 -1.26 -4.90 107.32 98.98 2dhk s GLY 25 Ca 0.05 0.13 -0.09 0.00 0.00 0.00 0.00 44.72 44.81 2dhk s GLY 25 CO -0.09 -0.15 0.71 -0.98 0.00 0.00 0.00 173.10 172.59 2dhk s TRP 26 N -3.79 3.47 0.32 1.90 0.52 -1.26 -2.58 118.94 117.51 2dhk s TRP 26 Ca 0.03 0.95 0.03 0.00 0.02 0.00 0.00 56.10 57.12 2dhk s TRP 26 Cb 0.01 -2.36 -0.04 0.00 -1.15 0.00 0.00 33.47 29.93 2dhk s TRP 26 CO -0.12 -0.02 0.12 0.15 0.02 0.00 0.00 176.95 177.10 2dhk s LYS 27 N -3.72 1.62 -0.29 4.98 1.02 -1.22 -4.97 119.74 117.17 2dhk s LYS 27 Ca 0.49 -1.93 -0.03 0.00 0.02 0.00 0.00 55.97 54.53 2dhk s LYS 27 Cb -0.10 -0.36 0.04 0.00 -0.52 0.00 0.00 37.83 36.89 2dhk s LYS 27 CO 0.30 -0.38 0.00 -1.12 -0.92 0.00 0.00 175.35 173.24 2dhk s SER 28 N -3.42 4.80 0.08 2.83 0.01 -1.26 -3.75 113.70 112.99 2dhk s SER 28 Ca 0.34 -1.10 0.01 0.00 1.31 0.00 0.00 55.95 56.51 2dhk s SER 28 Cb 0.06 -1.73 -0.04 0.00 0.21 0.00 0.00 66.02 64.52 2dhk s SER 28 CO 0.16 -0.23 -0.06 -0.60 0.41 0.00 0.00 173.24 172.93 2dhk s ARG 29 N 1.31 0.75 -0.34 12.44 6.06 -0.85 -4.96 118.95 133.36 2dhk s ARG 29 Ca -0.03 -1.26 -0.10 0.00 -2.50 0.00 0.00 55.73 51.84 2dhk s ARG 29 Cb -0.19 -0.09 0.00 0.00 0.06 0.00 0.00 34.95 34.74 2dhk s ARG 29 CO -0.01 -0.04 0.18 -0.46 -2.50 0.00 0.00 175.30 172.47 2dhk s TRP 30 N -3.56 3.20 -0.19 5.12 -0.11 -0.26 -1.21 118.94 121.93 2dhk s TRP 30 Ca 0.09 -0.67 -0.07 0.00 1.22 0.00 0.00 56.10 56.68 2dhk s TRP 30 Cb 0.05 -2.40 -0.04 0.00 -1.50 0.00 0.00 33.47 29.59 2dhk s TRP 30 CO -0.06 -0.51 0.04 -0.06 -4.62 0.00 0.00 176.95 171.74 2dhk s PHE 31 N 1.60 3.17 -0.03 5.86 0.40 -1.14 -0.40 117.98 127.44 2dhk s PHE 31 Ca 0.04 -0.09 0.01 0.00 -0.60 0.00 0.00 56.93 56.29 2dhk s PHE 31 Cb -0.18 -2.09 0.01 0.00 0.51 0.00 0.00 43.02 41.28 2dhk s PHE 31 CO 0.07 0.02 -0.04 -0.59 0.70 0.00 0.00 175.22 175.37 2dhk s PHE 32 N 0.61 0.60 0.56 0.36 -0.12 0.14 -2.07 117.98 118.06 2dhk s PHE 32 Ca 0.02 -0.13 -0.15 0.00 -0.05 0.00 0.00 56.93 56.62 2dhk s PHE 32 Cb -0.13 -0.50 -0.06 0.00 -0.63 0.00 0.00 43.02 41.70 2dhk s PHE 32 CO 0.02 -0.11 1.01 -0.47 -0.05 0.00 0.00 175.22 175.62 2dhk s TYR 33 N 0.50 3.38 -0.17 3.49 6.14 -0.65 -0.24 117.35 129.80 2dhk s TYR 33 Ca -0.06 1.44 0.00 0.00 0.64 0.00 0.00 57.07 59.09 2dhk s TYR 33 Cb -0.10 -2.82 0.04 0.00 0.42 0.00 0.00 41.96 39.50 2dhk s TYR 33 CO -0.00 -0.64 -0.09 0.34 0.64 0.00 0.00 175.55 175.80 2dhk s ASP 34 N -3.30 2.99 -0.12 4.32 2.15 0.10 -4.82 116.67 118.00 2dhk s ASP 34 Ca 0.59 -0.70 0.02 0.00 0.43 0.00 0.00 52.55 52.88 2dhk s ASP 34 Cb -0.12 -1.08 0.20 0.00 -0.30 0.00 0.00 42.92 41.63 2dhk s ASP 34 CO 0.39 -0.15 1.19 -1.84 -0.17 0.00 0.00 175.17 174.59 2dhk n GLU 35 N 4.79 1.49 -0.05 4.34 0.28 -1.26 -2.07 120.64 128.15 2dhk n GLU 35 Ca -0.14 -0.86 -0.08 0.00 -0.16 0.00 0.00 57.16 55.93 2dhk n GLU 35 Cb 0.48 -1.40 -0.05 0.00 1.43 0.00 0.00 31.44 31.90 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 0.06 0.25 0.00 3.44 1.74 -1.26 -4.75 116.66 116.14 2dhk n ARG 36 Ca 0.15 0.07 0.00 0.00 -0.77 0.00 0.00 57.85 57.30 2dhk n ARG 36 Cb 0.78 -1.16 0.00 0.00 -1.02 0.00 0.00 32.46 31.06 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 -2.91 0.13 -3.27 5.56 5.02 -1.24 -5.02 118.16 116.43 2dhk n LYS 37 Ca -0.19 -0.72 -0.15 0.00 -2.02 0.00 0.00 58.31 55.23 2dhk n LYS 37 Cb 0.69 -0.95 0.08 0.00 -0.02 0.00 0.00 35.03 34.83 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 -5.17 1.13 -0.43 0.00 -1.52 -1.19 -3.67 119.66 108.83 2dhk s GLN 39 Ca 0.02 -1.57 -0.08 0.00 -1.95 0.00 0.00 55.36 51.78 2dhk s GLN 39 Cb -0.00 -0.03 0.09 0.00 -0.22 0.00 0.00 33.01 32.85 2dhk s GLN 39 CO 0.65 -0.24 0.27 -1.17 -0.25 0.00 0.00 175.29 174.55 2dhk s LEU 40 N -3.16 5.25 -0.18 2.90 2.96 0.27 -0.72 118.68 126.00 2dhk s LEU 40 Ca 0.29 -1.65 -0.14 0.00 -0.22 0.00 0.00 54.13 52.41 2dhk s LEU 40 Cb 0.07 -1.97 -0.04 0.00 0.50 0.00 0.00 46.19 44.75 2dhk s LEU 40 CO 0.07 -0.57 0.32 -0.31 -1.32 0.00 0.00 176.35 174.54 2dhk s TYR 41 N 1.38 3.42 0.03 5.38 1.51 0.67 -1.02 117.35 128.72 2dhk s TYR 41 Ca 0.04 0.59 0.03 0.00 -1.01 0.00 0.00 57.07 56.72 2dhk s TYR 41 Cb -0.24 -2.40 -0.02 0.00 -0.11 0.00 0.00 41.96 39.19 2dhk s TYR 41 CO 0.01 0.14 -0.11 1.52 -1.11 0.00 0.00 175.55 176.00 2dhk s TYR 42 N 0.79 0.93 0.26 2.71 -0.85 -0.94 0.28 117.35 120.53 2dhk s TYR 42 Ca 0.17 -0.33 0.00 0.00 -0.52 0.00 0.00 57.07 56.39 2dhk s TYR 42 Cb -0.14 -0.56 -0.03 0.00 0.38 0.00 0.00 41.96 41.61 2dhk s TYR 42 CO 0.05 -0.01 0.25 0.45 -1.52 0.00 0.00 175.55 174.78 2dhk s SER 43 N -1.00 0.69 0.32 -0.18 0.15 0.46 -1.14 113.70 113.01 2dhk s SER 43 Ca -0.01 -1.47 0.10 0.00 0.70 0.00 0.00 55.95 55.27 2dhk s SER 43 Cb -0.07 0.49 0.94 0.00 -1.71 0.00 0.00 66.02 65.67 2dhk s SER 43 CO 0.01 -0.99 1.70 0.03 1.20 0.00 0.00 173.24 175.18 2dhk h ARG 44 N 2.37 0.43 -3.67 5.44 3.08 -1.89 -0.68 114.38 119.46 2dhk h ARG 44 Ca -0.31 -0.03 -0.16 0.00 0.07 0.00 0.00 59.98 59.56 2dhk h ARG 44 Cb 1.24 -0.10 -0.05 0.00 0.08 0.00 0.00 29.97 31.14 2dhk h ARG 44 CO 0.44 0.29 -0.02 0.95 -1.07 0.00 0.00 179.97 180.56 2dhk s THR 45 N -5.75 0.00 0.07 2.04 -4.23 -1.26 -4.13 115.64 102.38 2dhk s THR 45 Ca -0.11 -1.36 0.19 0.00 -1.18 0.00 0.00 61.69 59.23 2dhk s THR 45 Cb 0.28 -2.67 0.13 0.00 1.34 0.00 0.00 72.50 71.58 2dhk s THR 45 CO 0.79 0.00 1.66 0.00 -0.54 0.00 0.00 174.62 176.54 2dhk h ALA 46 N 2.08 0.90 -0.04 3.99 0.00 -1.92 -3.08 119.26 121.20 2dhk h ALA 46 Ca -0.29 -0.36 -0.13 0.00 0.00 0.00 0.00 54.91 54.13 2dhk h ALA 46 Cb 1.24 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 2dhk h ALA 46 CO 0.39 0.49 -0.58 1.96 0.00 0.00 0.00 179.25 181.50 2dhk h GLN 47 N 0.00 0.13 -5.00 0.00 4.20 -1.98 -3.38 115.11 109.08 2dhk h GLN 47 Ca -0.00 -0.09 -0.43 0.00 0.06 0.00 0.00 58.65 58.19 2dhk h GLN 47 Cb 1.02 0.01 0.03 0.00 0.30 0.00 0.00 27.48 28.84 2dhk h GLN 47 CO 0.05 0.67 1.35 -0.25 -0.67 0.00 0.00 178.83 179.99 2dhk n ASP 48 N -3.87 2.25 -0.52 1.46 8.00 -1.16 -4.72 116.55 117.99 2dhk n ASP 48 Ca -0.02 -2.62 0.43 0.00 0.71 0.00 0.00 54.79 53.28 2dhk n ASP 48 Cb 0.59 -1.32 0.71 0.00 -0.02 0.00 0.00 41.12 41.08 2dhk n ASP 48 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2dhk h ALA 49 N 9.48 3.04 -1.91 2.24 0.00 -1.86 -3.33 119.26 126.92 2dhk h ALA 49 Ca 0.26 0.09 -0.59 0.00 0.00 0.00 0.00 54.91 54.66 2dhk h ALA 49 Cb 0.82 0.23 -0.10 0.00 0.00 0.00 0.00 17.79 18.74 2dhk h ALA 49 CO 1.58 -1.70 0.63 -0.80 0.00 0.00 0.00 179.25 178.96 2dhk s ASN 50 N -4.23 6.55 0.33 0.00 0.01 -1.26 -5.02 114.94 111.32 2dhk s ASN 50 Ca -0.07 0.24 -0.28 0.00 -0.71 0.00 0.00 52.86 52.04 2dhk s ASN 50 Cb 0.30 -2.47 -0.10 0.00 0.41 0.00 0.00 41.25 39.40 2dhk s ASN 50 CO 0.84 -1.05 1.22 -2.16 -1.51 0.00 0.00 177.10 174.44 2dhk s PRO 51 N 3.81 4.38 -0.06 -0.60 0.04 -1.25 -4.85 135.00 136.47 2dhk s PRO 51 Ca 0.39 2.03 -0.18 0.00 0.04 0.00 0.00 61.00 63.28 2dhk s PRO 51 Cb -0.10 -3.03 -0.13 0.00 0.04 0.00 0.00 34.50 31.28 2dhk s PRO 51 CO 0.26 -0.10 0.72 -0.07 0.04 0.00 0.00 177.00 177.84 2dhk h LEU 52 N 3.36 -0.22 -8.83 -3.56 3.38 -1.48 -3.48 115.31 104.48 2dhk h LEU 52 Ca -0.48 -0.26 -0.33 0.00 0.09 0.00 0.00 57.88 56.89 2dhk h LEU 52 Cb 1.22 0.06 -0.14 0.00 0.09 0.00 0.00 40.66 41.89 2dhk h LEU 52 CO 0.65 0.32 -0.61 -0.62 0.09 0.00 0.00 178.44 178.28 2dhk s ASP 53 N -5.39 1.00 0.06 -0.43 2.15 -1.13 -5.03 116.67 107.89 2dhk s ASP 53 Ca -0.10 -1.41 0.01 0.00 0.43 0.00 0.00 52.55 51.47 2dhk s ASP 53 Cb 0.00 0.25 -0.03 0.00 -0.30 0.00 0.00 42.92 42.84 2dhk s ASP 53 CO 0.38 -0.78 -0.06 -0.94 -0.17 0.00 0.00 175.17 173.60 2dhk s SER 54 N -3.29 0.81 -0.10 -0.34 1.04 -1.26 -2.22 113.70 108.35 2dhk s SER 54 Ca 0.38 -0.80 0.02 0.00 0.48 0.00 0.00 55.95 56.03 2dhk s SER 54 Cb 0.07 0.10 0.01 0.00 0.10 0.00 0.00 66.02 66.30 2dhk s SER 54 CO 0.14 -0.39 -0.16 -0.63 0.98 0.00 0.00 173.24 173.19 2dhk s ILE 55 N -2.69 1.49 -0.74 -1.02 -1.09 -0.19 -4.89 121.20 112.08 2dhk s ILE 55 Ca 0.00 -0.65 -0.26 0.00 -2.23 0.00 0.00 60.65 57.51 2dhk s ILE 55 Cb -0.01 -1.35 0.04 0.00 -1.58 0.00 0.00 42.46 39.55 2dhk s ILE 55 CO -0.04 0.44 1.24 -0.62 -1.23 0.00 0.00 174.94 174.73 2dhk s ASP 56 N 0.85 6.17 0.43 3.58 -1.08 -1.26 -0.56 116.67 124.80 2dhk s ASP 56 Ca -0.10 -0.56 0.22 0.00 -0.52 0.00 0.00 52.55 51.60 2dhk s ASP 56 Cb -0.15 -2.54 0.34 0.00 -1.46 0.00 0.00 42.92 39.11 2dhk s ASP 56 CO 0.01 -1.77 1.60 -0.07 0.52 0.00 0.00 175.17 175.46 2dhk h LEU 57 N 12.78 0.00 -1.32 -1.34 3.38 -1.93 -3.24 115.31 123.64 2dhk h LEU 57 Ca -0.26 0.00 0.23 0.00 0.09 0.00 0.00 57.88 57.93 2dhk h LEU 57 Cb 1.05 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.71 2dhk h LEU 57 CO 1.27 0.06 0.63 -1.28 0.09 0.00 0.00 178.44 179.21 2dhk h SER 58 N 0.00 0.52 -0.65 -0.43 0.87 -1.88 -1.89 113.55 110.09 2dhk h SER 58 Ca -0.00 0.07 -0.43 0.00 -1.23 0.00 0.00 61.79 60.20 2dhk h SER 58 Cb 1.03 -0.02 -0.42 0.00 -0.44 0.00 0.00 62.40 62.55 2dhk h SER 58 CO 0.01 0.16 -0.93 -1.20 -0.53 0.00 0.00 176.83 174.33 2dhk n SER 59 N -4.63 3.65 -4.56 6.23 7.64 -1.24 -5.07 113.62 115.65 2dhk n SER 59 Ca 0.23 -3.10 -0.26 0.00 1.01 0.00 0.00 58.87 56.75 2dhk n SER 59 Cb 0.75 -0.40 -0.10 0.00 -1.01 0.00 0.00 64.21 63.45 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 -3.67 3.00 -0.05 -0.43 0.00 -0.71 -4.22 121.76 115.67 2dhk s ALA 60 Ca 0.42 -2.08 -0.01 0.00 0.00 0.00 0.00 51.96 50.29 2dhk s ALA 60 Cb 0.38 -0.08 0.03 0.00 0.00 0.00 0.00 23.12 23.45 2dhk s ALA 60 CO 0.01 0.07 0.01 0.54 0.00 0.00 0.00 175.76 176.38 2dhk s VAL 61 N -2.60 0.27 -0.05 0.00 0.11 -0.40 -4.94 120.40 112.78 2dhk s VAL 61 Ca 0.33 0.13 -0.24 0.00 -2.93 0.00 0.00 61.98 59.27 2dhk s VAL 61 Cb 0.02 -0.41 -0.04 0.00 -1.53 0.00 0.00 36.38 34.43 2dhk s VAL 61 CO 0.17 0.21 0.74 -0.36 -3.33 0.00 0.00 175.10 172.53 2dhk s PHE 62 N 1.63 3.60 0.24 1.54 0.08 -1.26 -0.74 117.98 123.06 2dhk s PHE 62 Ca -0.01 1.33 0.02 0.00 0.12 0.00 0.00 56.93 58.39 2dhk s PHE 62 Cb -0.13 -2.84 -0.05 0.00 -0.57 0.00 0.00 43.02 39.43 2dhk s PHE 62 CO -0.03 0.10 0.05 0.34 -0.10 0.00 0.00 175.22 175.57 2dhk s ASP 63 N 0.74 1.44 -0.10 1.36 2.15 0.99 -4.98 116.67 118.27 2dhk s ASP 63 Ca 0.39 -1.29 0.01 0.00 0.43 0.00 0.00 52.55 52.09 2dhk s ASP 63 Cb -0.18 0.10 -0.02 0.00 -0.30 0.00 0.00 42.92 42.51 2dhk s ASP 63 CO 0.20 -0.63 -0.11 0.00 -0.17 0.00 0.00 175.17 174.46 2dhk s LYS 65 N -0.14 -1.24 0.01 0.00 -0.14 -0.95 -4.92 119.74 112.36 2dhk s LYS 65 Ca 0.00 0.02 -0.25 0.00 -1.36 0.00 0.00 55.97 54.39 2dhk s LYS 65 Cb -0.13 -1.59 -0.18 0.00 -1.68 0.00 0.00 37.83 34.25 2dhk s LYS 65 CO 0.03 -3.74 1.39 0.00 -0.76 0.00 0.00 175.35 172.26 2dhk h ALA 66 N -2.61 0.03 -0.20 5.17 0.00 -2.00 -3.02 119.26 116.63 2dhk h ALA 66 Ca -0.46 -0.19 -0.12 0.00 0.00 0.00 0.00 54.91 54.13 2dhk h ALA 66 Cb 1.30 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 19.03 2dhk h ALA 66 CO 0.36 -0.28 0.16 -0.25 0.00 0.00 0.00 179.25 179.24 2dhk n ASP 67 N -4.88 4.64 -0.06 0.00 8.00 -1.26 -4.45 116.55 118.53 2dhk n ASP 67 Ca -0.08 -2.53 0.24 0.00 0.71 0.00 0.00 54.79 53.14 2dhk n ASP 67 Cb 0.21 -0.86 0.72 0.00 -0.02 0.00 0.00 41.12 41.16 2dhk n ASP 67 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2dhk h ALA 68 N 1.47 2.57 -1.49 2.24 0.00 -1.78 -1.77 119.26 120.50 2dhk h ALA 68 Ca 0.13 -0.02 0.49 0.00 0.00 0.00 0.00 54.91 55.50 2dhk h ALA 68 Cb 1.15 0.05 -0.12 0.00 0.00 0.00 0.00 17.79 18.87 2dhk h ALA 68 CO 0.28 -0.88 0.99 -0.85 0.00 0.00 0.00 179.25 178.79 2dhk n GLU 69 N -4.13 -0.03 0.09 0.00 0.28 -1.26 0.23 120.64 115.82 2dhk n GLU 69 Ca 0.13 1.17 -0.18 0.00 -0.16 0.00 0.00 57.16 58.12 2dhk n GLU 69 Cb 0.79 -2.40 -0.14 0.00 1.43 0.00 0.00 31.44 31.11 2dhk n GLU 69 CO 0.00 0.00 0.00 1.49 -0.16 0.00 0.00 177.13 178.46 2dhk h GLU 70 N 0.00 0.31 0.00 3.44 4.81 -1.69 -3.37 114.58 118.08 2dhk h GLU 70 Ca 0.87 -0.53 0.00 0.00 -0.13 0.00 0.00 59.36 59.56 2dhk h GLU 70 Cb 2.98 0.20 0.00 0.00 0.63 0.00 0.00 28.75 32.56 2dhk h GLU 70 CO -0.34 1.22 0.00 0.41 -0.73 0.00 0.00 179.01 179.57 2dhk n GLY 71 N 1.64 0.49 3.34 1.92 0.00 0.62 -2.86 105.19 110.34 2dhk n GLY 71 Ca -0.14 -0.47 -0.31 0.00 0.00 0.00 0.00 46.02 45.10 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 2.19 0.25 -0.61 1.09 -1.25 0.69 121.20 123.56 2dhk s ILE 72 Ca 0.00 -1.21 -0.04 0.00 -1.10 0.00 0.00 60.65 58.31 2dhk s ILE 72 Cb 0.00 -1.81 -0.02 0.00 -1.06 0.00 0.00 42.46 39.57 2dhk s ILE 72 CO 0.00 0.48 0.30 0.72 -0.10 0.00 0.00 174.94 176.34 2dhk s PHE 73 N -0.72 0.99 -0.01 3.97 -0.71 -0.49 -2.24 117.98 118.77 2dhk s PHE 73 Ca 0.11 -1.21 -0.12 0.00 -1.04 0.00 0.00 56.93 54.67 2dhk s PHE 73 Cb -0.10 -0.29 0.01 0.00 -1.21 0.00 0.00 43.02 41.43 2dhk s PHE 73 CO 0.01 -0.84 0.24 -1.21 -1.34 0.00 0.00 175.22 172.07 2dhk s GLU 74 N -3.87 0.58 -0.23 1.99 2.02 0.02 -2.11 118.70 117.10 2dhk s GLU 74 Ca 0.33 -0.26 -0.00 0.00 0.02 0.00 0.00 54.97 55.06 2dhk s GLU 74 Cb 0.03 0.25 0.03 0.00 0.10 0.00 0.00 34.13 34.54 2dhk s GLU 74 CO 0.14 -0.15 -0.10 0.42 0.02 0.00 0.00 175.26 175.59 2dhk s ILE 75 N -1.31 2.59 -0.25 -1.63 1.01 -0.50 -0.01 121.20 121.10 2dhk s ILE 75 Ca -0.14 -1.09 -0.23 0.00 0.00 0.00 0.00 60.65 59.20 2dhk s ILE 75 Cb -0.06 -2.29 -0.01 0.00 0.01 0.00 0.00 42.46 40.10 2dhk s ILE 75 CO 0.03 0.25 0.75 -0.54 0.00 0.00 0.00 174.94 175.43 2dhk s LYS 76 N 1.28 4.16 0.09 2.79 3.01 0.08 -1.79 119.74 129.37 2dhk s LYS 76 Ca -0.00 0.80 0.05 0.00 -1.01 0.00 0.00 55.97 55.81 2dhk s LYS 76 Cb -0.16 -3.65 -0.03 0.00 -1.01 0.00 0.00 37.83 32.98 2dhk s LYS 76 CO -0.06 -0.47 -0.14 0.95 0.51 0.00 0.00 175.35 176.13 2dhk s THR 77 N 2.70 1.20 -1.44 2.17 -4.23 -1.26 -1.28 115.64 113.50 2dhk s THR 77 Ca 0.32 -1.50 0.15 0.00 -1.18 0.00 0.00 61.69 59.48 2dhk s THR 77 Cb -0.15 -1.29 0.26 0.00 1.34 0.00 0.00 72.50 72.66 2dhk s THR 77 CO 0.08 -0.32 1.40 -0.81 -0.54 0.00 0.00 174.62 174.43 2dhk n PRO 78 N 0.93 0.21 -0.11 3.99 -0.04 -1.26 -3.31 135.00 135.41 2dhk n PRO 78 Ca -0.19 0.14 -0.23 0.00 -0.04 0.00 0.00 63.50 63.19 2dhk n PRO 78 Cb 0.55 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.44 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 -1.28 1.64 -3.57 3.54 2.88 -1.26 -5.05 113.62 110.52 2dhk n SER 79 Ca 0.07 0.28 -0.02 0.00 -1.33 0.00 0.00 58.87 57.88 2dhk n SER 79 Cb 0.12 -0.68 -0.05 0.00 -0.75 0.00 0.00 64.21 62.84 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 -2.45 0.44 -0.14 -1.46 1.70 -1.21 -5.13 118.95 110.69 2dhk s ARG 80 Ca -0.31 0.92 -0.29 0.00 -0.47 0.00 0.00 55.73 55.57 2dhk s ARG 80 Cb 0.12 0.34 -0.02 0.00 -0.57 0.00 0.00 34.95 34.82 2dhk s ARG 80 CO 0.40 -0.12 1.33 0.08 -1.08 0.00 0.00 175.30 175.91 2dhk s VAL 81 N 2.02 4.15 0.18 4.99 1.01 -1.26 -4.24 120.40 127.25 2dhk s VAL 81 Ca -0.07 1.40 0.04 0.00 0.00 0.00 0.00 61.98 63.35 2dhk s VAL 81 Cb -0.06 -3.90 -0.03 0.00 0.00 0.00 0.00 36.38 32.38 2dhk s VAL 81 CO -0.17 -0.12 0.26 -0.63 0.00 0.00 0.00 175.10 174.44 2dhk s ILE 82 N 3.52 5.05 -0.29 2.22 -1.09 -0.74 -4.98 121.20 124.89 2dhk s ILE 82 Ca 0.58 -0.90 -0.01 0.00 -2.23 0.00 0.00 60.65 58.09 2dhk s ILE 82 Cb -0.24 -3.64 0.09 0.00 -1.58 0.00 0.00 42.46 37.09 2dhk s ILE 82 CO 0.18 -0.17 0.08 -0.89 -1.23 0.00 0.00 174.94 172.90 2dhk s THR 83 N -1.83 0.88 0.04 2.92 2.01 -1.26 -1.41 115.64 116.98 2dhk s THR 83 Ca 0.33 -1.25 0.08 0.00 0.31 0.00 0.00 61.69 61.16 2dhk s THR 83 Cb -0.10 -1.58 -0.03 0.00 0.01 0.00 0.00 72.50 70.80 2dhk s THR 83 CO 0.27 -0.55 -0.21 -0.76 -0.69 0.00 0.00 174.62 172.67 2dhk s LEU 84 N 1.64 2.42 0.07 4.42 1.43 -0.90 -1.55 118.68 126.21 2dhk s LEU 84 Ca 0.07 -0.48 0.08 0.00 -1.03 0.00 0.00 54.13 52.77 2dhk s LEU 84 Cb -0.17 -1.42 -0.03 0.00 0.03 0.00 0.00 46.19 44.59 2dhk s LEU 84 CO -0.21 0.26 -0.21 -1.59 0.23 0.00 0.00 176.35 174.83 2dhk s LYS 85 N -1.30 1.30 0.50 1.70 -2.85 -0.96 -1.39 119.74 116.73 2dhk s LYS 85 Ca 0.13 -1.05 0.08 0.00 -1.00 0.00 0.00 55.97 54.13 2dhk s LYS 85 Cb -0.10 -1.49 0.04 0.00 -2.06 0.00 0.00 37.83 34.21 2dhk s LYS 85 CO 0.04 0.37 0.57 0.00 0.10 0.00 0.00 175.35 176.42 2dhk s ALA 86 N -0.95 4.47 0.00 0.59 0.00 0.22 -2.93 121.76 123.15 2dhk s ALA 86 Ca 0.07 -1.80 0.00 0.00 0.00 0.00 0.00 51.96 50.23 2dhk s ALA 86 Cb -0.09 -1.24 0.00 0.00 0.00 0.00 0.00 23.12 21.79 2dhk s ALA 86 CO 0.03 -0.52 0.90 0.00 0.00 0.00 0.00 175.76 176.18 2dhk n ALA 87 N -1.91 -0.26 -4.29 0.00 0.00 -1.26 -4.59 120.51 108.19 2dhk n ALA 87 Ca 0.08 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.36 2dhk n ALA 87 Cb 0.62 0.16 -0.03 0.00 0.00 0.00 0.00 19.45 20.19 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 -2.02 0.00 -0.20 0.00 -2.24 -1.24 -4.60 114.28 103.98 2dhk n THR 88 Ca 0.00 -1.16 -0.08 0.00 -2.27 0.00 0.00 64.05 60.54 2dhk n THR 88 Cb 0.00 0.18 0.02 0.00 -2.10 0.00 0.00 70.33 68.43 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 0.90 -0.31 -0.78 1.63 -1.70 -2.70 116.57 113.61 2dhk h LYS 89 Ca -0.20 -0.20 -0.06 0.00 -0.85 0.00 0.00 60.65 59.33 2dhk h LYS 89 Cb 0.62 -0.13 -0.02 0.00 -0.60 0.00 0.00 32.23 32.11 2dhk h LYS 89 CO 0.33 0.82 -0.06 0.37 -3.45 0.00 0.00 179.45 177.46 2dhk h GLN 90 N 0.81 0.51 0.33 1.90 4.15 -1.93 -2.78 115.11 118.09 2dhk h GLN 90 Ca 0.18 -0.13 -0.01 0.00 0.77 0.00 0.00 58.65 59.47 2dhk h GLN 90 Cb 0.31 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 27.93 2dhk h GLN 90 CO -0.00 0.58 -0.28 0.00 -1.93 0.00 0.00 178.83 177.20 2dhk h ALA 91 N 1.46 -1.01 -0.76 3.38 0.00 -1.87 -2.81 119.26 117.65 2dhk h ALA 91 Ca 0.10 -0.12 0.15 0.00 0.00 0.00 0.00 54.91 55.04 2dhk h ALA 91 Cb 0.41 0.48 -0.10 0.00 0.00 0.00 0.00 17.79 18.58 2dhk h ALA 91 CO 0.02 -1.02 0.29 0.00 0.00 0.00 0.00 179.25 178.54 2dhk h MET 92 N -0.59 0.41 -1.18 0.00 -0.00 -1.55 0.12 114.93 112.15 2dhk h MET 92 Ca -0.04 -0.02 0.33 0.00 -0.00 0.00 0.00 59.70 59.97 2dhk h MET 92 Cb 0.50 -0.09 -0.08 0.00 -0.00 0.00 0.00 31.60 31.93 2dhk h MET 92 CO -0.01 0.27 0.80 -0.07 -0.00 0.00 0.00 176.91 177.91 2dhk h LEU 93 N 0.42 0.21 -0.13 -0.10 3.38 -1.25 0.51 115.31 118.35 2dhk h LEU 93 Ca 0.42 0.05 -0.23 0.00 0.09 0.00 0.00 57.88 58.21 2dhk h LEU 93 Cb 0.65 0.02 0.01 0.00 0.09 0.00 0.00 40.66 41.44 2dhk h LEU 93 CO -0.42 0.01 -0.83 0.22 0.09 0.00 0.00 178.44 177.51 2dhk h TYR 94 N 0.17 1.08 0.03 1.13 3.20 -0.51 -2.14 116.97 119.92 2dhk h TYR 94 Ca 0.63 -0.50 -0.00 0.00 3.14 0.00 0.00 58.73 62.00 2dhk h TYR 94 Cb 2.07 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 40.18 2dhk h TYR 94 CO -0.00 1.34 -0.01 -1.49 -1.64 0.00 0.00 178.16 176.35 2dhk h TRP 95 N 0.52 -0.03 -0.16 -3.82 4.06 0.00 -0.76 115.95 115.76 2dhk h TRP 95 Ca -0.07 -0.00 0.01 0.00 2.06 0.00 0.00 58.89 60.89 2dhk h TRP 95 Cb 1.47 0.01 -0.01 0.00 -1.00 0.00 0.00 29.16 29.63 2dhk h TRP 95 CO 0.09 0.36 0.08 -0.07 -3.56 0.00 0.00 178.44 175.34 2dhk h LEU 96 N -0.44 0.11 0.84 -4.49 3.38 -0.94 0.47 115.31 114.25 2dhk h LEU 96 Ca -0.00 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 2dhk h LEU 96 Cb 0.41 -0.01 0.01 0.00 0.09 0.00 0.00 40.66 41.16 2dhk h LEU 96 CO 0.01 0.09 -0.40 -0.61 0.09 0.00 0.00 178.44 177.61 2dhk h GLN 97 N 0.17 -1.09 0.67 1.13 5.75 -1.42 -2.68 115.11 117.64 2dhk h GLN 97 Ca 0.07 0.07 -0.03 0.00 -0.15 0.00 0.00 58.65 58.61 2dhk h GLN 97 Cb 0.02 0.25 -0.01 0.00 1.07 0.00 0.00 27.48 28.81 2dhk h GLN 97 CO -0.05 -0.72 -0.44 1.96 -2.65 0.00 0.00 178.83 176.93 2dhk h GLN 98 N -1.15 -1.01 -0.86 1.69 1.08 -1.09 -2.63 115.11 111.14 2dhk h GLN 98 Ca -0.12 0.07 0.27 0.00 -1.45 0.00 0.00 58.65 57.43 2dhk h GLN 98 Cb 0.87 0.23 -0.16 0.00 -0.05 0.00 0.00 27.48 28.37 2dhk h GLN 98 CO 0.19 -0.67 0.14 1.28 -0.95 0.00 0.00 178.83 178.81 2dhk n LEU 99 N -5.57 0.01 0.31 1.46 4.77 0.17 0.18 117.00 118.33 2dhk n LEU 99 Ca -0.13 1.46 -0.18 0.00 -0.03 0.00 0.00 56.01 57.13 2dhk n LEU 99 Cb 0.45 -0.58 -0.09 0.00 -2.33 0.00 0.00 43.42 40.87 2dhk n LEU 99 CO 0.34 -1.52 0.59 1.56 -1.33 0.00 0.00 177.39 177.03 2dhk h GLN 100 N 0.00 -0.90 -0.74 3.23 4.20 -1.11 -2.74 115.11 117.05 2dhk h GLN 100 Ca 0.58 0.06 0.15 0.00 0.06 0.00 0.00 58.65 59.50 2dhk h GLN 100 Cb 1.31 0.21 -0.14 0.00 0.30 0.00 0.00 27.48 29.16 2dhk h GLN 100 CO -0.77 -0.60 -0.17 -1.33 -0.67 0.00 0.00 178.83 175.28 2dhk n MET 101 N -5.53 -0.07 0.13 1.46 2.81 0.13 0.81 117.12 116.87 2dhk n MET 101 Ca -0.12 1.15 -0.14 0.00 -1.81 0.00 0.00 57.70 56.78 2dhk n MET 101 Cb 0.42 -1.72 -0.06 0.00 -0.71 0.00 0.00 33.22 31.15 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 -0.57 0.48 0.03 1.79 -1.39 0.12 116.57 117.03 2dhk h LYS 102 Ca 0.36 0.04 -0.02 0.00 -2.18 0.00 0.00 60.65 58.84 2dhk h LYS 102 Cb 0.56 0.13 0.00 0.00 -1.58 0.00 0.00 32.23 31.34 2dhk h LYS 102 CO -0.75 -0.38 -0.23 -0.09 -1.08 0.00 0.00 179.45 176.91 2dhk h ARG 103 N -0.59 -0.62 -0.95 3.15 2.43 0.34 -3.08 114.38 115.06 2dhk h ARG 103 Ca 0.02 0.04 0.19 0.00 -0.81 0.00 0.00 59.98 59.42 2dhk h ARG 103 Cb 0.61 0.14 -0.18 0.00 -0.42 0.00 0.00 29.97 30.12 2dhk h ARG 103 CO -0.18 -0.41 -0.26 2.35 -1.51 0.00 0.00 179.97 179.96 2dhk h TRP 104 N -1.01 -0.57 -0.10 2.20 7.01 0.37 0.57 115.95 124.42 2dhk h TRP 104 Ca -0.07 0.09 0.04 0.00 2.11 0.00 0.00 58.89 61.06 2dhk h TRP 104 Cb 0.49 0.40 -0.06 0.00 -2.10 0.00 0.00 29.16 27.89 2dhk h TRP 104 CO 0.02 -0.41 -0.47 0.93 -2.79 0.00 0.00 178.44 175.73 2dhk h GLU 105 N -0.00 -0.53 -0.95 2.65 5.08 -0.81 -0.78 114.58 119.24 2dhk h GLU 105 Ca 0.44 0.04 0.29 0.00 -1.00 0.00 0.00 59.36 59.13 2dhk h GLU 105 Cb 0.68 0.12 -0.16 0.00 0.50 0.00 0.00 28.75 29.89 2dhk h GLU 105 CO -0.98 -0.35 0.26 0.35 -1.00 0.00 0.00 179.01 177.28 2dhk h PHE 106 N -0.55 0.36 -0.25 4.33 3.57 -0.79 0.51 116.94 124.12 2dhk h PHE 106 Ca 0.05 0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.59 2dhk h PHE 106 Cb 0.66 -0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.39 2dhk h PHE 106 CO -0.51 -0.33 0.10 0.45 -2.23 0.00 0.00 178.31 175.80 2dhk h HIS 107 N 0.12 0.39 0.64 0.41 3.86 -0.88 -3.28 115.15 116.41 2dhk h HIS 107 Ca 0.64 -0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.79 2dhk h HIS 107 Cb 1.41 -0.12 0.01 0.00 1.06 0.00 0.00 27.41 29.77 2dhk h HIS 107 CO -0.27 0.40 -0.31 -0.91 0.86 0.00 0.00 177.93 177.70 2dhk h ASN 108 N 0.26 -0.73 -1.47 2.45 2.35 0.69 -3.44 115.58 115.68 2dhk h ASN 108 Ca 0.08 0.03 -0.70 0.00 -0.55 0.00 0.00 56.30 55.16 2dhk h ASN 108 Cb 0.18 0.19 0.07 0.00 0.05 0.00 0.00 38.32 38.81 2dhk h ASN 108 CO -0.01 -0.40 0.16 -1.54 -1.65 0.00 0.00 177.43 174.00 2dhk n SER 109 N -4.99 0.71 -4.77 5.81 3.41 0.10 -4.91 113.62 108.98 2dhk n SER 109 Ca -0.11 1.14 -0.32 0.00 -0.26 0.00 0.00 58.87 59.32 2dhk n SER 109 Cb 0.34 -1.09 0.06 0.00 -0.26 0.00 0.00 64.21 63.27 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 -0.10 2.59 0.45 4.33 0.04 -1.26 -4.89 135.00 136.16 2dhk s PRO 110 Ca 0.81 1.31 -0.23 0.00 0.04 0.00 0.00 61.00 62.92 2dhk s PRO 110 Cb -1.02 -1.93 -0.08 0.00 0.04 0.00 0.00 34.50 31.52 2dhk s PRO 110 CO 0.53 -1.40 1.17 -1.25 0.04 0.00 0.00 177.00 176.09 2dhk s PRO 111 N -4.40 3.80 0.45 0.56 0.04 -1.26 -5.01 135.00 129.18 2dhk s PRO 111 Ca 0.65 1.79 -0.22 0.00 0.04 0.00 0.00 61.00 63.26 2dhk s PRO 111 Cb -0.19 -2.45 -0.08 0.00 0.04 0.00 0.00 34.50 31.82 2dhk s PRO 111 CO 0.47 -0.52 1.08 0.00 0.04 0.00 0.00 177.00 178.06 2dhk s ALA 112 N -1.52 2.96 1.25 8.56 0.00 -1.26 -5.04 121.76 126.70 2dhk s ALA 112 Ca 0.63 0.73 -0.21 0.00 0.00 0.00 0.00 51.96 53.11 2dhk s ALA 112 Cb -0.29 -3.30 0.31 0.00 0.00 0.00 0.00 23.12 19.84 2dhk s ALA 112 CO 0.36 -0.38 1.11 -1.25 0.00 0.00 0.00 175.76 175.59 2dhk s PRO 113 N -2.83 -1.58 -0.16 0.00 0.04 -1.26 -5.02 135.00 124.19 2dhk s PRO 113 Ca 0.63 -0.19 -0.21 0.00 0.04 0.00 0.00 61.00 61.27 2dhk s PRO 113 Cb -0.22 -1.57 -0.18 0.00 0.04 0.00 0.00 34.50 32.58 2dhk s PRO 113 CO 0.27 -3.93 0.37 0.77 0.04 0.00 0.00 177.00 174.52 2dhk h SER 114 N -2.73 0.00 -6.10 6.66 0.02 -2.04 -3.49 113.55 105.86 2dhk h SER 114 Ca -0.43 -0.60 -0.19 0.00 -0.84 0.00 0.00 61.79 59.74 2dhk h SER 114 Cb 1.28 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.83 2dhk h SER 114 CO 0.29 1.11 -1.00 0.61 -1.14 0.00 0.00 176.83 176.70 2dhk n GLY 115 N 1.56 -0.63 0.06 -3.77 0.00 -1.26 -4.92 105.19 96.23 2dhk n GLY 115 Ca -0.17 0.88 -0.13 0.00 0.00 0.00 0.00 46.02 46.60 2dhk n GLY 115 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dhk h PRO 116 N 2.48 -0.01 -6.66 1.61 0.13 -2.06 -3.45 132.00 124.04 2dhk h PRO 116 Ca -0.27 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.28 2dhk h PRO 116 Cb 1.10 0.00 0.17 0.00 0.13 0.00 0.00 31.00 32.40 2dhk h PRO 116 CO 0.16 0.48 -0.17 0.45 -0.23 0.00 0.00 178.00 178.69 2dhk n SER 117 N -4.86 -0.28 -3.47 1.44 2.88 -1.26 -5.01 113.62 103.05 2dhk n SER 117 Ca -0.08 0.75 0.01 0.00 -1.33 0.00 0.00 58.87 58.21 2dhk n SER 117 Cb 0.25 -1.27 -0.04 0.00 -0.75 0.00 0.00 64.21 62.40 2dhk n SER 117 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2dhk s SER 118 N -1.25 -0.91 0.00 -3.46 0.15 -1.26 -5.21 113.70 101.76 2dhk s SER 118 Ca 0.72 1.12 0.00 0.00 0.70 0.00 0.00 55.95 58.49 2dhk s SER 118 Cb -0.42 1.98 0.00 0.00 -1.71 0.00 0.00 66.02 65.87 2dhk s SER 118 CO 0.51 -0.17 0.00 0.61 1.20 0.00 0.00 173.24 175.39