#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dhj n SER 2 N 0.00 0.06 -3.91 1.61 3.41 -1.26 -3.48 113.62 110.05 2dhj n SER 2 Ca 0.00 0.95 -0.29 0.00 -0.26 0.00 0.00 58.87 59.27 2dhj n SER 2 Cb 0.00 -0.47 -0.16 0.00 -0.26 0.00 0.00 64.21 63.32 2dhj n SER 2 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2dhj s SER 3 N -4.04 3.16 0.00 4.04 0.01 -1.26 -4.87 113.70 110.74 2dhj s SER 3 Ca -0.05 -0.82 0.00 0.00 1.31 0.00 0.00 55.95 56.39 2dhj s SER 3 Cb 0.24 -1.01 0.00 0.00 0.21 0.00 0.00 66.02 65.46 2dhj s SER 3 CO 0.73 -0.19 0.00 0.61 0.41 0.00 0.00 173.24 174.79 2dhj n GLY 4 N 4.81 0.38 0.58 3.44 0.00 -1.23 -5.09 105.19 108.08 2dhj n GLY 4 Ca -0.12 -0.17 -0.11 0.00 0.00 0.00 0.00 46.02 45.62 2dhj n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dhj n SER 5 N 0.00 1.12 -4.56 1.61 7.64 -1.26 -4.45 113.62 113.71 2dhj n SER 5 Ca 0.00 0.10 -0.40 0.00 1.01 0.00 0.00 58.87 59.58 2dhj n SER 5 Cb 0.00 -0.29 -0.03 0.00 -1.01 0.00 0.00 64.21 62.88 2dhj n SER 5 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2dhj s SER 6 N -5.83 5.75 -0.37 6.43 0.15 -1.26 -4.84 113.70 113.72 2dhj s SER 6 Ca -0.15 0.33 0.13 0.00 0.70 0.00 0.00 55.95 56.96 2dhj s SER 6 Cb 0.05 -2.54 0.40 0.00 -1.71 0.00 0.00 66.02 62.22 2dhj s SER 6 CO 0.20 -2.01 0.87 0.61 1.20 0.00 0.00 173.24 174.10 2dhj n GLY 7 N 5.48 3.15 3.74 9.45 0.00 -1.26 -5.09 105.19 120.65 2dhj n GLY 7 Ca 0.16 -1.71 -0.40 0.00 0.00 0.00 0.00 46.02 44.06 2dhj n GLY 7 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2dhj s ASP 8 N -2.88 7.19 0.01 1.61 1.01 -1.26 -4.99 116.67 117.36 2dhj s ASP 8 Ca 0.36 1.42 -0.32 0.00 0.71 0.00 0.00 52.55 54.73 2dhj s ASP 8 Cb 0.39 -2.46 -0.10 0.00 1.01 0.00 0.00 42.92 41.75 2dhj s ASP 8 CO -0.05 0.00 1.91 0.00 0.21 0.00 0.00 175.17 177.24 2dhj n ALA 9 N 2.91 1.44 0.02 5.23 0.00 -1.26 -4.66 120.51 124.18 2dhj n ALA 9 Ca -0.02 0.26 -0.12 0.00 0.00 0.00 0.00 53.44 53.56 2dhj n ALA 9 Cb 0.50 -2.60 -0.07 0.00 0.00 0.00 0.00 19.45 17.29 2dhj n ALA 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dhj h ALA 10 N 9.64 0.03 -2.73 0.00 0.00 -1.33 -3.47 119.26 121.41 2dhj h ALA 10 Ca -0.49 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.30 2dhj h ALA 10 Cb 1.25 -0.01 -0.11 0.00 0.00 0.00 0.00 17.79 18.91 2dhj h ALA 10 CO 0.94 -0.43 -0.20 0.21 0.00 0.00 0.00 179.25 179.77 2dhj s LYS 11 N -5.87 1.27 0.07 0.00 2.20 -1.03 -5.02 119.74 111.36 2dhj s LYS 11 Ca -0.13 -1.10 -0.27 0.00 -0.36 0.00 0.00 55.97 54.11 2dhj s LYS 11 Cb 0.06 0.43 0.09 0.00 -1.51 0.00 0.00 37.83 36.89 2dhj s LYS 11 CO 0.67 -0.49 0.82 -1.83 -0.36 0.00 0.00 175.35 174.15 2dhj s GLU 12 N -3.95 1.02 0.00 4.03 -1.05 -1.26 -0.49 118.70 117.00 2dhj s GLU 12 Ca 0.16 -0.42 0.00 0.00 -0.15 0.00 0.00 54.97 54.56 2dhj s GLU 12 Cb 0.02 0.44 0.00 0.00 -0.44 0.00 0.00 34.13 34.15 2dhj s GLU 12 CO 0.00 -0.45 0.00 0.41 0.95 0.00 0.00 175.26 176.17 2dhj n GLY 13 N -0.32 3.72 3.61 -3.83 0.00 -0.80 -5.02 105.19 102.55 2dhj n GLY 13 Ca -0.10 -1.15 -0.43 0.00 0.00 0.00 0.00 46.02 44.34 2dhj n GLY 13 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2dhj s TRP 14 N -2.00 2.02 0.00 1.61 0.52 -1.26 -1.61 118.94 118.21 2dhj s TRP 14 Ca 0.00 0.62 0.04 0.00 0.02 0.00 0.00 56.10 56.77 2dhj s TRP 14 Cb 0.00 -4.14 -0.01 0.00 -1.15 0.00 0.00 33.47 28.17 2dhj s TRP 14 CO 0.00 -2.72 -0.12 -0.51 0.02 0.00 0.00 176.95 173.62 2dhj s LEU 15 N 6.15 2.06 -0.54 2.99 1.43 -1.19 -4.73 118.68 124.85 2dhj s LEU 15 Ca 0.74 -0.26 -0.29 0.00 -1.03 0.00 0.00 54.13 53.29 2dhj s LEU 15 Cb -0.21 -0.57 0.03 0.00 0.03 0.00 0.00 46.19 45.47 2dhj s LEU 15 CO 0.32 0.11 1.17 -1.00 0.23 0.00 0.00 176.35 177.19 2dhj s HIS 16 N -0.40 2.69 -0.43 0.29 3.76 -1.17 -2.79 115.29 117.23 2dhj s HIS 16 Ca 0.03 0.55 -0.19 0.00 -0.15 0.00 0.00 55.06 55.30 2dhj s HIS 16 Cb -0.05 -4.49 0.02 0.00 1.11 0.00 0.00 32.58 29.17 2dhj s HIS 16 CO -0.00 -1.46 0.54 0.12 -0.85 0.00 0.00 174.74 173.09 2dhj s PHE 17 N 4.76 3.12 -0.36 1.40 5.36 -0.81 -3.20 117.98 128.24 2dhj s PHE 17 Ca 0.45 -0.20 0.02 0.00 -0.96 0.00 0.00 56.93 56.24 2dhj s PHE 17 Cb -0.07 -3.13 0.11 0.00 -0.34 0.00 0.00 43.02 39.59 2dhj s PHE 17 CO 0.28 -0.79 0.11 0.50 -1.46 0.00 0.00 175.22 173.86 2dhj s ARG 18 N 2.49 1.25 0.35 10.12 3.52 -1.10 -3.14 118.95 132.44 2dhj s ARG 18 Ca 0.18 -1.70 -0.27 0.00 -0.13 0.00 0.00 55.73 53.80 2dhj s ARG 18 Cb -0.16 -2.72 -0.09 0.00 -1.56 0.00 0.00 34.95 30.42 2dhj s ARG 18 CO 0.16 -1.00 1.21 -1.25 -0.81 0.00 0.00 175.30 173.62 2dhj s PRO 19 N 0.96 4.29 0.01 5.12 0.04 -1.26 -0.46 135.00 143.70 2dhj s PRO 19 Ca 0.12 1.99 -0.20 0.00 0.04 0.00 0.00 61.00 62.94 2dhj s PRO 19 Cb -0.20 -2.94 -0.20 0.00 0.04 0.00 0.00 34.50 31.21 2dhj s PRO 19 CO -0.12 -0.16 1.18 -0.07 0.04 0.00 0.00 177.00 177.87 2dhj h LEU 20 N 3.17 0.45 -7.00 -3.56 -0.00 -0.81 -3.47 115.31 104.09 2dhj h LEU 20 Ca -0.48 -0.66 0.11 0.00 -0.00 0.00 0.00 57.88 56.85 2dhj h LEU 20 Cb 1.23 -0.13 -0.22 0.00 -0.00 0.00 0.00 40.66 41.53 2dhj h LEU 20 CO 0.65 1.03 0.59 0.54 -0.00 0.00 0.00 178.44 181.25 2dhj s VAL 21 N -3.60 0.00 0.42 1.22 0.11 -1.26 -5.05 120.40 112.25 2dhj s VAL 21 Ca -0.14 0.00 0.04 0.00 -2.93 0.00 0.00 61.98 58.95 2dhj s VAL 21 Cb 0.04 -1.00 -0.02 0.00 -1.53 0.00 0.00 36.38 33.87 2dhj s VAL 21 CO 0.79 0.00 0.15 0.42 -3.33 0.00 0.00 175.10 173.12 2dhj s THR 22 N -1.41 0.51 0.17 5.04 -4.23 -1.26 -4.25 115.64 110.20 2dhj s THR 22 Ca 0.01 -2.00 -0.33 0.00 -1.18 0.00 0.00 61.69 58.18 2dhj s THR 22 Cb -0.01 -2.29 -0.15 0.00 1.34 0.00 0.00 72.50 71.39 2dhj s THR 22 CO -0.01 0.00 1.29 0.47 -0.54 0.00 0.00 174.62 175.83 2dhj n ASP 23 N -1.44 1.87 -4.50 3.99 8.00 -1.26 -4.88 116.55 118.34 2dhj n ASP 23 Ca -0.06 1.13 -0.42 0.00 0.71 0.00 0.00 54.79 56.15 2dhj n ASP 23 Cb 0.65 -1.28 -0.03 0.00 -0.02 0.00 0.00 41.12 40.43 2dhj n ASP 23 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 2dhj s LYS 24 N -0.11 3.22 0.00 -1.24 2.47 -1.26 -3.47 119.74 119.35 2dhj s LYS 24 Ca 0.75 -0.72 0.00 0.00 -1.56 0.00 0.00 55.97 54.43 2dhj s LYS 24 Cb -0.81 -4.37 0.00 0.00 -1.46 0.00 0.00 37.83 31.19 2dhj s LYS 24 CO 0.49 -1.97 0.00 0.41 0.16 0.00 0.00 175.35 174.44 2dhj n GLY 25 N 5.50 -0.72 2.76 5.54 0.00 -1.26 -5.05 105.19 111.96 2dhj n GLY 25 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 2dhj n GLY 25 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2dhj n LYS 26 N 0.00 4.78 -4.42 1.61 3.00 -1.23 -4.77 118.16 117.13 2dhj n LYS 26 Ca 0.00 -4.30 -0.39 0.00 -0.00 0.00 0.00 58.31 53.63 2dhj n LYS 26 Cb 0.00 -2.56 -0.08 0.00 0.00 0.00 0.00 35.03 32.38 2dhj n LYS 26 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 2dhj n ARG 27 N 1.15 -0.78 -2.40 1.64 5.12 -1.26 -4.82 116.66 115.32 2dhj n ARG 27 Ca 0.42 0.12 -0.29 0.00 -1.93 0.00 0.00 57.85 56.17 2dhj n ARG 27 Cb 0.29 -4.31 0.01 0.00 -1.16 0.00 0.00 32.46 27.29 2dhj n ARG 27 CO 0.00 0.00 0.00 1.33 -1.93 0.00 0.00 177.63 177.03 2dhj n VAL 28 N -4.12 2.59 -2.55 1.55 0.24 -1.26 -5.03 118.33 109.75 2dhj n VAL 28 Ca -0.00 -4.85 0.00 0.00 -2.04 0.00 0.00 64.34 57.45 2dhj n VAL 28 Cb 0.51 -1.27 0.00 0.00 -1.47 0.00 0.00 33.84 31.61 2dhj n VAL 28 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2dhj n GLY 29 N -0.48 5.34 5.54 7.63 0.00 -1.26 -4.93 105.19 117.03 2dhj n GLY 29 Ca 0.41 -2.03 0.00 0.00 0.00 0.00 0.00 46.02 44.41 2dhj n GLY 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dhj n GLY 30 N 5.00 1.63 2.87 -0.02 0.00 -1.26 -4.79 105.19 108.62 2dhj n GLY 30 Ca 0.00 -0.36 -0.14 0.00 0.00 0.00 0.00 46.02 45.52 2dhj n GLY 30 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dhj s SER 31 N -4.00 0.19 -0.09 1.61 0.01 -1.26 -5.13 113.70 105.03 2dhj s SER 31 Ca 0.00 -0.02 -0.30 0.00 1.31 0.00 0.00 55.95 56.94 2dhj s SER 31 Cb 0.00 -0.05 -0.02 0.00 0.21 0.00 0.00 66.02 66.16 2dhj s SER 31 CO 0.00 -0.01 1.06 -0.63 0.41 0.00 0.00 173.24 174.07 2dhj s ILE 32 N 0.23 4.64 0.32 1.44 1.01 -1.26 -5.04 121.20 122.54 2dhj s ILE 32 Ca -0.02 1.92 -0.08 0.00 0.00 0.00 0.00 60.65 62.47 2dhj s ILE 32 Cb -0.04 -4.23 -0.06 0.00 0.01 0.00 0.00 42.46 38.14 2dhj s ILE 32 CO -0.01 0.01 0.63 -0.13 0.00 0.00 0.00 174.94 175.44 2dhj s ARG 33 N 2.04 3.73 0.80 2.79 1.81 -1.26 -5.09 118.95 123.76 2dhj s ARG 33 Ca 0.50 0.23 -0.13 0.00 -1.72 0.00 0.00 55.73 54.61 2dhj s ARG 33 Cb -0.20 -2.55 0.20 0.00 -0.45 0.00 0.00 34.95 31.95 2dhj s ARG 33 CO 0.19 0.15 0.71 -0.35 -0.68 0.00 0.00 175.30 175.32 2dhj n PRO 34 N -0.89 -2.41 -1.12 3.54 -0.04 -1.26 -4.89 135.00 127.93 2dhj n PRO 34 Ca 0.00 -1.14 -0.39 0.00 -0.04 0.00 0.00 63.50 61.93 2dhj n PRO 34 Cb 0.54 -1.07 -0.03 0.00 -0.04 0.00 0.00 33.50 32.90 2dhj n PRO 34 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 2dhj n TRP 35 N -4.04 -0.23 -3.81 0.54 7.02 -1.26 -4.90 117.44 110.75 2dhj n TRP 35 Ca 0.10 0.78 -0.35 0.00 -1.02 0.00 0.00 57.50 57.01 2dhj n TRP 35 Cb 0.38 -1.57 -0.12 0.00 -2.42 0.00 0.00 31.31 27.59 2dhj n TRP 35 CO 0.00 0.00 0.00 0.15 -2.02 0.00 0.00 177.69 175.82 2dhj s LYS 36 N -0.65 2.10 -0.26 -0.99 1.02 -1.19 -4.98 119.74 114.79 2dhj s LYS 36 Ca 0.54 -2.13 -0.29 0.00 0.02 0.00 0.00 55.97 54.11 2dhj s LYS 36 Cb -0.78 -3.55 -0.02 0.00 -0.52 0.00 0.00 37.83 32.96 2dhj s LYS 36 CO 0.44 -1.09 1.67 -1.14 -0.92 0.00 0.00 175.35 174.31 2dhj s GLN 37 N 0.58 3.64 -0.10 1.68 0.74 -1.26 -1.93 119.66 123.00 2dhj s GLN 37 Ca 0.12 1.56 -0.14 0.00 0.05 0.00 0.00 55.36 56.96 2dhj s GLN 37 Cb -0.22 -4.09 0.03 0.00 1.10 0.00 0.00 33.01 29.84 2dhj s GLN 37 CO -0.04 -1.49 0.36 0.00 -0.55 0.00 0.00 175.29 173.57 2dhj s MET 38 N 5.00 0.50 -0.29 1.67 0.23 -1.12 -4.91 119.30 120.38 2dhj s MET 38 Ca 0.74 0.32 -0.32 0.00 -1.03 0.00 0.00 55.69 55.40 2dhj s MET 38 Cb -0.24 0.24 -0.09 0.00 -1.53 0.00 0.00 34.83 33.21 2dhj s MET 38 CO 0.31 -0.09 2.20 0.98 -2.03 0.00 0.00 175.02 176.39 2dhj n TYR 39 N 2.43 1.75 -3.67 3.16 4.19 0.62 -3.15 117.16 122.49 2dhj n TYR 39 Ca -0.15 0.12 -0.36 0.00 3.31 0.00 0.00 57.90 60.81 2dhj n TYR 39 Cb 0.57 -2.61 -0.09 0.00 0.49 0.00 0.00 39.34 37.71 2dhj n TYR 39 CO 0.00 0.00 0.00 0.08 0.91 0.00 0.00 176.86 177.85 2dhj s VAL 40 N 7.67 5.37 -0.09 2.97 1.01 -0.64 0.15 120.40 136.84 2dhj s VAL 40 Ca 1.06 0.23 0.04 0.00 0.00 0.00 0.00 61.98 63.31 2dhj s VAL 40 Cb -0.65 -3.51 -0.00 0.00 0.00 0.00 0.00 36.38 32.22 2dhj s VAL 40 CO 0.44 0.38 -0.23 -0.69 0.00 0.00 0.00 175.10 175.00 2dhj s VAL 41 N 0.73 2.17 -0.43 2.92 1.01 0.61 -1.91 120.40 125.51 2dhj s VAL 41 Ca 0.09 -0.99 -0.11 0.00 0.00 0.00 0.00 61.98 60.97 2dhj s VAL 41 Cb -0.12 -1.82 0.07 0.00 0.00 0.00 0.00 36.38 34.51 2dhj s VAL 41 CO 0.02 0.56 0.29 -0.22 0.00 0.00 0.00 175.10 175.75 2dhj s LEU 42 N 0.20 5.24 -0.45 3.92 2.96 0.36 0.28 118.68 131.19 2dhj s LEU 42 Ca -0.14 -1.44 -0.02 0.00 -0.22 0.00 0.00 54.13 52.31 2dhj s LEU 42 Cb -0.17 -2.03 0.12 0.00 0.50 0.00 0.00 46.19 44.61 2dhj s LEU 42 CO 0.07 -0.56 0.24 -0.13 -1.32 0.00 0.00 176.35 174.66 2dhj s ARG 43 N 1.48 2.07 3.86 1.98 0.52 -0.40 -0.79 118.95 127.68 2dhj s ARG 43 Ca 0.03 -1.99 0.00 0.00 -0.52 0.00 0.00 55.73 53.26 2dhj s ARG 43 Cb -0.23 -3.58 0.00 0.00 0.52 0.00 0.00 34.95 31.66 2dhj s ARG 43 CO 0.03 -1.09 0.00 0.41 0.02 0.00 0.00 175.30 174.68 2dhj n GLY 44 N 4.31 1.64 0.08 -3.53 0.00 -1.26 -2.42 105.19 104.01 2dhj n GLY 44 Ca 0.00 0.10 0.03 0.00 0.00 0.00 0.00 46.02 46.15 2dhj n GLY 44 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2dhj n HIS 45 N 0.00 0.00 -4.87 1.61 -0.00 -1.26 -4.72 115.22 105.98 2dhj n HIS 45 Ca 0.00 -0.48 -0.28 0.00 -0.00 0.00 0.00 57.72 56.96 2dhj n HIS 45 Cb 0.00 -0.07 -0.15 0.00 -0.00 0.00 0.00 29.99 29.77 2dhj n HIS 45 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.34 175.22 2dhj s SER 46 N -1.33 2.79 -0.38 4.39 0.01 -1.02 0.23 113.70 118.40 2dhj s SER 46 Ca 0.09 -0.52 -0.07 0.00 1.31 0.00 0.00 55.95 56.76 2dhj s SER 46 Cb 0.08 -0.26 0.06 0.00 0.21 0.00 0.00 66.02 66.11 2dhj s SER 46 CO 0.01 0.23 0.17 -0.76 0.41 0.00 0.00 173.24 173.30 2dhj s LEU 47 N -1.03 4.74 -0.47 2.44 1.43 -1.01 -1.27 118.68 123.50 2dhj s LEU 47 Ca 0.09 -1.38 -0.17 0.00 -1.03 0.00 0.00 54.13 51.64 2dhj s LEU 47 Cb -0.09 -1.91 0.05 0.00 0.03 0.00 0.00 46.19 44.28 2dhj s LEU 47 CO 0.01 -0.43 0.48 -0.31 0.23 0.00 0.00 176.35 176.33 2dhj s TYR 48 N 1.38 3.16 0.33 0.29 2.02 0.14 -2.92 117.35 121.75 2dhj s TYR 48 Ca 0.01 -0.67 -0.06 0.00 -0.37 0.00 0.00 57.07 55.99 2dhj s TYR 48 Cb -0.21 -3.22 -0.05 0.00 -0.40 0.00 0.00 41.96 38.08 2dhj s TYR 48 CO 0.02 -0.85 0.61 -0.51 -1.57 0.00 0.00 175.55 173.25 2dhj s LEU 49 N 2.09 3.98 -0.12 -1.29 1.02 -1.26 -0.28 118.68 122.82 2dhj s LEU 49 Ca 0.10 0.79 -0.10 0.00 0.02 0.00 0.00 54.13 54.94 2dhj s LEU 49 Cb -0.21 -3.64 0.03 0.00 0.02 0.00 0.00 46.19 42.40 2dhj s LEU 49 CO 0.10 -0.27 0.30 -0.31 0.02 0.00 0.00 176.35 176.19 2dhj s TYR 50 N -2.21 -0.35 0.02 0.29 2.02 0.39 -4.44 117.35 113.07 2dhj s TYR 50 Ca 0.45 0.83 0.21 0.00 -0.37 0.00 0.00 57.07 58.20 2dhj s TYR 50 Cb -0.10 0.12 0.61 0.00 -0.40 0.00 0.00 41.96 42.19 2dhj s TYR 50 CO 0.32 -0.18 1.69 1.57 -1.57 0.00 0.00 175.55 177.38 2dhj h LYS 51 N 5.90 0.00 -5.24 -0.62 2.10 -1.91 1.84 116.57 118.64 2dhj h LYS 51 Ca -0.28 0.00 -0.55 0.00 -2.00 0.00 0.00 60.65 57.82 2dhj h LYS 51 Cb 1.19 0.00 -0.13 0.00 -0.90 0.00 0.00 32.23 32.38 2dhj h LYS 51 CO 0.32 0.31 -0.57 -0.51 -2.00 0.00 0.00 179.45 177.00 2dhj s ASP 52 N -6.30 2.99 -0.02 7.07 1.01 -1.26 -4.67 116.67 115.49 2dhj s ASP 52 Ca 0.02 -1.50 0.07 0.00 0.71 0.00 0.00 52.55 51.85 2dhj s ASP 52 Cb 0.09 0.12 -0.10 0.00 1.01 0.00 0.00 42.92 44.04 2dhj s ASP 52 CO 0.67 -0.71 0.12 1.17 0.21 0.00 0.00 175.17 176.64 2dhj n LYS 53 N -0.88 0.85 0.02 8.23 4.81 -1.26 -4.66 118.16 125.26 2dhj n LYS 53 Ca -0.06 -0.05 -0.10 0.00 -0.87 0.00 0.00 58.31 57.22 2dhj n LYS 53 Cb 0.66 -1.17 -0.04 0.00 0.02 0.00 0.00 35.03 34.51 2dhj n LYS 53 CO 0.00 0.00 0.00 -0.09 1.17 0.00 0.00 177.40 178.48 2dhj h ARG 54 N 0.00 -0.33 -3.63 1.64 9.65 -2.01 -3.26 114.38 116.43 2dhj h ARG 54 Ca -0.04 0.02 -0.79 0.00 -1.10 0.00 0.00 59.98 58.07 2dhj h ARG 54 Cb 0.58 0.08 -0.28 0.00 -1.39 0.00 0.00 29.97 28.95 2dhj h ARG 54 CO 0.00 -0.22 0.30 -1.21 2.80 0.00 0.00 179.97 181.64 2dhj s GLU 55 N -6.06 3.94 0.14 0.20 2.02 -1.26 -4.80 118.70 112.87 2dhj s GLU 55 Ca -0.15 -2.98 0.15 0.00 0.02 0.00 0.00 54.97 52.01 2dhj s GLU 55 Cb 0.10 -4.47 -0.08 0.00 0.10 0.00 0.00 34.13 29.78 2dhj s GLU 55 CO 0.66 -1.26 1.09 0.37 0.02 0.00 0.00 175.26 176.15 2dhj h GLN 56 N 6.98 0.00 0.66 1.61 4.15 -1.87 -3.37 115.11 123.27 2dhj h GLN 56 Ca 0.15 0.00 -0.03 0.00 0.77 0.00 0.00 58.65 59.54 2dhj h GLN 56 Cb 0.92 0.00 0.01 0.00 0.21 0.00 0.00 27.48 28.62 2dhj h GLN 56 CO 0.92 0.46 -0.32 1.15 -1.93 0.00 0.00 178.83 179.11 2dhj h THR 57 N 0.00 0.00 -2.32 2.39 2.02 -1.92 -3.45 112.91 109.63 2dhj h THR 57 Ca -0.10 -0.25 -0.60 0.00 0.77 0.00 0.00 66.41 66.23 2dhj h THR 57 Cb 1.56 0.00 0.16 0.00 -1.74 0.00 0.00 68.15 68.13 2dhj h THR 57 CO 0.06 0.00 -0.60 0.35 0.37 0.00 0.00 175.52 175.70 2dhj n THR 58 N -5.09 1.43 -1.16 3.16 -2.24 -1.26 -4.94 114.28 104.18 2dhj n THR 58 Ca -0.11 -0.50 -0.29 0.00 -2.27 0.00 0.00 64.05 60.88 2dhj n THR 58 Cb 0.35 -0.40 0.18 0.00 -2.10 0.00 0.00 70.33 68.36 2dhj n THR 58 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 2dhj s PRO 59 N -1.51 0.24 -0.04 -0.78 0.04 -1.26 -4.89 135.00 126.81 2dhj s PRO 59 Ca 0.63 0.46 -0.39 0.00 0.04 0.00 0.00 61.00 61.73 2dhj s PRO 59 Cb -0.56 -1.72 -0.18 0.00 0.04 0.00 0.00 34.50 32.08 2dhj s PRO 59 CO 0.59 -2.84 1.29 -1.13 0.04 0.00 0.00 177.00 174.95 2dhj n SER 60 N -4.24 0.99 0.00 6.66 3.41 -1.26 -4.91 113.62 114.27 2dhj n SER 60 Ca 0.05 1.14 -0.00 0.00 -0.26 0.00 0.00 58.87 59.80 2dhj n SER 60 Cb 0.57 -1.04 -0.00 0.00 -0.26 0.00 0.00 64.21 63.48 2dhj n SER 60 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2dhj h GLU 61 N 4.22 -0.00 0.00 4.33 5.08 -1.90 -3.45 114.58 122.86 2dhj h GLU 61 Ca -0.49 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 57.78 2dhj h GLU 61 Cb 1.38 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.61 2dhj h GLU 61 CO 0.76 -0.00 -1.31 0.39 -1.00 0.00 0.00 179.01 177.86 2dhj n GLU 62 N -2.01 0.54 -0.66 2.33 -0.58 -1.26 -5.01 120.64 114.00 2dhj n GLU 62 Ca -0.00 0.23 -0.29 0.00 -0.42 0.00 0.00 57.16 56.69 2dhj n GLU 62 Cb 0.00 -1.45 0.23 0.00 -0.57 0.00 0.00 31.44 29.64 2dhj n GLU 62 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 2dhj s GLU 63 N -2.80 -0.41 0.13 3.49 0.41 -1.26 -5.05 118.70 113.21 2dhj s GLU 63 Ca -0.31 0.92 0.10 0.00 -0.41 0.00 0.00 54.97 55.28 2dhj s GLU 63 Cb 0.06 -1.61 -0.04 0.00 -1.78 0.00 0.00 34.13 30.77 2dhj s GLU 63 CO 0.44 -3.41 -0.25 1.14 -0.49 0.00 0.00 175.26 172.69 2dhj s GLN 64 N -4.56 1.34 0.38 1.61 -2.07 -1.26 -4.69 119.66 110.42 2dhj s GLN 64 Ca 0.68 -1.32 -0.26 0.00 -1.82 0.00 0.00 55.36 52.63 2dhj s GLN 64 Cb -0.24 -1.76 -0.09 0.00 -1.09 0.00 0.00 33.01 29.84 2dhj s GLN 64 CO 0.63 0.41 1.20 -1.25 -1.32 0.00 0.00 175.29 174.95 2dhj s PRO 65 N -2.10 4.12 -0.27 9.60 0.04 -1.26 -4.81 135.00 140.32 2dhj s PRO 65 Ca 0.13 1.92 0.03 0.00 0.04 0.00 0.00 61.00 63.12 2dhj s PRO 65 Cb -0.10 -2.77 0.07 0.00 0.04 0.00 0.00 34.50 31.74 2dhj s PRO 65 CO 0.06 -0.29 -0.08 0.42 0.04 0.00 0.00 177.00 177.15 2dhj s ILE 66 N -1.34 2.09 -0.47 0.56 1.01 -1.15 -4.89 121.20 117.00 2dhj s ILE 66 Ca 0.55 -1.68 -0.27 0.00 0.00 0.00 0.00 60.65 59.26 2dhj s ILE 66 Cb -0.33 -2.27 -0.05 0.00 0.01 0.00 0.00 42.46 39.83 2dhj s ILE 66 CO 0.42 -0.12 2.18 -0.44 0.00 0.00 0.00 174.94 176.98 2dhj s SER 67 N 1.12 4.92 -0.07 3.58 0.01 -1.26 -2.41 113.70 119.58 2dhj s SER 67 Ca -0.06 1.01 0.00 0.00 1.31 0.00 0.00 55.95 58.21 2dhj s SER 67 Cb -0.20 -2.51 0.10 0.00 0.21 0.00 0.00 66.02 63.62 2dhj s SER 67 CO -0.06 -2.53 1.25 1.33 0.41 0.00 0.00 173.24 173.64 2dhj n VAL 68 N 7.71 1.44 -2.07 3.43 0.24 0.64 -4.87 118.33 124.85 2dhj n VAL 68 Ca 0.30 -0.36 -0.42 0.00 -2.04 0.00 0.00 64.34 61.82 2dhj n VAL 68 Cb 0.52 -0.99 -0.03 0.00 -1.47 0.00 0.00 33.84 31.88 2dhj n VAL 68 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 2dhj s ASN 69 N 0.75 5.83 -0.67 -1.34 2.47 -1.18 -3.19 114.94 117.62 2dhj s ASN 69 Ca 0.09 1.00 -0.02 0.00 0.42 0.00 0.00 52.86 54.35 2dhj s ASN 69 Cb 0.07 -2.53 -0.02 0.00 -1.45 0.00 0.00 41.25 37.32 2dhj s ASN 69 CO 0.01 -1.81 0.57 0.00 -3.72 0.00 0.00 177.10 172.16 2dhj n ALA 70 N 10.57 -1.44 -2.37 1.71 0.00 -1.26 -4.96 120.51 122.77 2dhj n ALA 70 Ca 0.21 0.02 -0.24 0.00 0.00 0.00 0.00 53.44 53.44 2dhj n ALA 70 Cb 0.48 -2.65 -0.05 0.00 0.00 0.00 0.00 19.45 17.23 2dhj n ALA 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dhj s LEU 72 N -4.04 3.48 -0.06 0.00 0.20 -0.86 -4.97 118.68 112.43 2dhj s LEU 72 Ca 0.41 -0.32 -0.04 0.00 0.69 0.00 0.00 54.13 54.87 2dhj s LEU 72 Cb 0.00 -2.10 0.02 0.00 -0.43 0.00 0.00 46.19 43.68 2dhj s LEU 72 CO 0.24 0.07 0.14 -0.63 -0.29 0.00 0.00 176.35 175.88 2dhj s ILE 73 N -1.79 -0.01 -0.08 6.68 1.01 -1.26 -1.49 121.20 124.26 2dhj s ILE 73 Ca 0.29 0.04 -0.08 0.00 0.00 0.00 0.00 60.65 60.90 2dhj s ILE 73 Cb -0.09 -0.21 0.02 0.00 0.01 0.00 0.00 42.46 42.19 2dhj s ILE 73 CO 0.20 0.02 0.23 -1.81 0.00 0.00 0.00 174.94 173.58 2dhj s ASP 74 N 0.34 -0.22 -0.42 3.58 1.01 0.73 -5.01 116.67 116.68 2dhj s ASP 74 Ca -0.02 0.40 -0.27 0.00 0.71 0.00 0.00 52.55 53.37 2dhj s ASP 74 Cb -0.04 0.45 -0.06 0.00 1.01 0.00 0.00 42.92 44.29 2dhj s ASP 74 CO -0.01 -0.12 2.31 -0.63 0.21 0.00 0.00 175.17 176.92 2dhj s ILE 75 N -0.07 3.04 0.02 0.77 1.01 -1.26 0.33 121.20 125.04 2dhj s ILE 75 Ca -0.02 0.03 -0.27 0.00 0.00 0.00 0.00 60.65 60.39 2dhj s ILE 75 Cb -0.02 -3.09 -0.14 0.00 0.01 0.00 0.00 42.46 39.21 2dhj s ILE 75 CO 0.01 -0.08 0.72 -1.54 0.00 0.00 0.00 174.94 174.04 2dhj n SER 76 N 14.49 -0.11 -4.04 3.58 3.41 -1.16 -4.78 113.62 125.01 2dhj n SER 76 Ca 0.33 0.82 -0.36 0.00 -0.26 0.00 0.00 58.87 59.40 2dhj n SER 76 Cb 0.52 -0.66 0.05 0.00 -0.26 0.00 0.00 64.21 63.86 2dhj n SER 76 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2dhj n TYR 77 N 0.95 -3.84 0.44 7.33 0.18 -1.26 -4.76 117.16 116.19 2dhj n TYR 77 Ca 0.14 0.17 -0.05 0.00 1.88 0.00 0.00 57.90 60.04 2dhj n TYR 77 Cb 0.07 -1.45 0.06 0.00 -0.38 0.00 0.00 39.34 37.64 2dhj n TYR 77 CO 0.00 0.00 0.00 0.45 -2.08 0.00 0.00 176.86 175.23 2dhj n SER 78 N 2.95 3.04 -0.07 9.48 2.88 -1.26 -4.12 113.62 126.52 2dhj n SER 78 Ca -0.01 -2.39 -0.06 0.00 -1.33 0.00 0.00 58.87 55.08 2dhj n SER 78 Cb 0.61 -0.58 -0.03 0.00 -0.75 0.00 0.00 64.21 63.46 2dhj n SER 78 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 2dhj h GLU 79 N 0.38 0.00 -6.36 -1.46 4.57 -1.95 -3.47 114.58 106.28 2dhj h GLU 79 Ca 0.14 0.00 -0.62 0.00 -1.18 0.00 0.00 59.36 57.70 2dhj h GLU 79 Cb 1.39 0.00 0.11 0.00 -0.16 0.00 0.00 28.75 30.09 2dhj h GLU 79 CO 0.26 0.13 -0.03 -2.37 -1.18 0.00 0.00 179.01 175.81 2dhj n THR 80 N -4.63 2.00 -0.84 0.32 5.66 -1.26 -4.79 114.28 110.75 2dhj n THR 80 Ca -0.08 -0.50 -0.08 0.00 -3.05 0.00 0.00 64.05 60.34 2dhj n THR 80 Cb 0.26 -0.76 -0.11 0.00 -1.55 0.00 0.00 70.33 68.17 2dhj n THR 80 CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 175.07 173.19 2dhj n LYS 81 N 0.77 1.67 -4.02 1.09 3.00 -1.26 -4.80 118.16 114.61 2dhj n LYS 81 Ca 0.11 -0.67 -0.08 0.00 -0.00 0.00 0.00 58.31 57.67 2dhj n LYS 81 Cb 0.31 -1.67 -0.11 0.00 0.00 0.00 0.00 35.03 33.56 2dhj n LYS 81 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 2dhj s ARG 82 N 0.66 0.41 0.52 1.64 0.52 -1.26 -5.17 118.95 116.28 2dhj s ARG 82 Ca 0.45 -0.81 0.06 0.00 -0.52 0.00 0.00 55.73 54.91 2dhj s ARG 82 Cb 0.21 0.15 0.03 0.00 0.52 0.00 0.00 34.95 35.86 2dhj s ARG 82 CO -0.00 -0.07 0.44 0.15 0.02 0.00 0.00 175.30 175.84 2dhj s LYS 83 N -2.30 2.30 -1.34 3.54 1.02 -1.26 -4.67 119.74 117.03 2dhj s LYS 83 Ca -0.08 -1.89 -0.01 0.00 0.02 0.00 0.00 55.97 54.01 2dhj s LYS 83 Cb -0.04 -2.21 0.00 0.00 -0.52 0.00 0.00 37.83 35.06 2dhj s LYS 83 CO -0.04 -0.57 0.01 0.27 -0.92 0.00 0.00 175.35 174.11 2dhj n ASN 84 N -1.78 0.74 -4.23 2.83 0.23 -1.26 -4.51 115.26 107.29 2dhj n ASN 84 Ca 0.01 -1.12 -0.31 0.00 -0.53 0.00 0.00 54.58 52.64 2dhj n ASN 84 Cb 0.64 -1.38 -0.17 0.00 -2.08 0.00 0.00 39.78 36.78 2dhj n ASN 84 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 2dhj s VAL 85 N -4.20 2.00 0.00 3.53 1.01 -1.26 -0.22 120.40 121.26 2dhj s VAL 85 Ca 0.01 -1.00 0.07 0.00 0.00 0.00 0.00 61.98 61.05 2dhj s VAL 85 Cb -0.01 -1.72 -0.02 0.00 0.00 0.00 0.00 36.38 34.64 2dhj s VAL 85 CO 0.87 0.55 -0.22 0.72 0.00 0.00 0.00 175.10 177.02 2dhj s PHE 86 N 0.18 1.94 -0.21 5.22 -0.71 0.46 -2.99 117.98 121.87 2dhj s PHE 86 Ca -0.13 -0.37 -0.09 0.00 -1.04 0.00 0.00 56.93 55.29 2dhj s PHE 86 Cb -0.16 -1.22 -0.05 0.00 -1.21 0.00 0.00 43.02 40.38 2dhj s PHE 86 CO 0.07 0.01 0.12 0.50 -1.34 0.00 0.00 175.22 174.58 2dhj s ARG 87 N -0.74 4.10 -0.03 1.99 3.52 0.15 -0.62 118.95 127.33 2dhj s ARG 87 Ca 0.08 -0.27 0.07 0.00 -0.13 0.00 0.00 55.73 55.49 2dhj s ARG 87 Cb -0.09 -3.40 -0.02 0.00 -1.56 0.00 0.00 34.95 29.88 2dhj s ARG 87 CO 0.00 0.22 -0.25 -1.17 -0.81 0.00 0.00 175.30 173.29 2dhj s LEU 88 N 0.57 2.12 -0.10 -0.88 0.20 -0.38 -0.19 118.68 120.03 2dhj s LEU 88 Ca 0.07 -0.45 0.02 0.00 0.69 0.00 0.00 54.13 54.46 2dhj s LEU 88 Cb -0.12 -1.37 0.01 0.00 -0.43 0.00 0.00 46.19 44.28 2dhj s LEU 88 CO 0.00 0.31 -0.17 -0.89 -0.29 0.00 0.00 176.35 175.31 2dhj s THR 89 N -0.55 1.56 0.17 3.68 2.01 -0.56 -1.45 115.64 120.50 2dhj s THR 89 Ca 0.08 -0.71 0.08 0.00 0.31 0.00 0.00 61.69 61.46 2dhj s THR 89 Cb -0.11 -1.40 -0.04 0.00 0.01 0.00 0.00 72.50 70.96 2dhj s THR 89 CO -0.00 0.45 -0.07 0.42 -0.69 0.00 0.00 174.62 174.73 2dhj s THR 90 N 0.73 3.36 0.65 -0.82 -4.23 -0.29 -2.03 115.64 113.00 2dhj s THR 90 Ca -0.12 -1.53 0.26 0.00 -1.18 0.00 0.00 61.69 59.12 2dhj s THR 90 Cb -0.16 -2.66 0.28 0.00 1.34 0.00 0.00 72.50 71.30 2dhj s THR 90 CO 0.03 -0.07 1.77 -1.28 -0.54 0.00 0.00 174.62 174.52 2dhj h SER 91 N 2.97 0.00 0.00 3.99 0.87 -1.90 -2.80 113.55 116.68 2dhj h SER 91 Ca -0.47 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.09 2dhj h SER 91 Cb 1.20 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.16 2dhj h SER 91 CO 0.55 0.00 -0.04 -0.78 -0.53 0.00 0.00 176.83 176.03 2dhj h ASP 92 N 0.00 0.00 -5.62 6.23 3.58 -1.94 -3.50 116.42 115.17 2dhj h ASP 92 Ca 0.06 0.00 -0.27 0.00 0.42 0.00 0.00 57.03 57.24 2dhj h ASP 92 Cb 1.04 0.00 -0.14 0.00 1.72 0.00 0.00 39.33 41.95 2dhj h ASP 92 CO -0.00 0.06 -0.53 0.00 -2.88 0.00 0.00 179.24 175.89 2dhj s GLU 94 N -3.96 2.38 0.20 0.00 2.12 -1.26 -1.14 118.70 117.03 2dhj s GLU 94 Ca 0.38 -1.17 -0.23 0.00 0.36 0.00 0.00 54.97 54.31 2dhj s GLU 94 Cb 0.05 -2.32 0.05 0.00 0.26 0.00 0.00 34.13 32.17 2dhj s GLU 94 CO 0.15 0.44 0.80 0.00 -0.54 0.00 0.00 175.26 176.11 2dhj s LEU 96 N -2.87 3.03 -0.05 0.00 1.43 0.39 -1.25 118.68 119.37 2dhj s LEU 96 Ca 0.10 -1.17 -0.13 0.00 -1.03 0.00 0.00 54.13 51.89 2dhj s LEU 96 Cb -0.03 -1.28 0.02 0.00 0.03 0.00 0.00 46.19 44.94 2dhj s LEU 96 CO 0.01 -0.53 0.31 -0.36 0.23 0.00 0.00 176.35 176.01 2dhj s PHE 97 N -2.64 -0.22 -0.01 0.29 0.08 0.21 -2.69 117.98 112.99 2dhj s PHE 97 Ca 0.39 0.43 0.02 0.00 0.12 0.00 0.00 56.93 57.89 2dhj s PHE 97 Cb 0.05 0.10 -0.00 0.00 -0.57 0.00 0.00 43.02 42.60 2dhj s PHE 97 CO 0.21 -0.32 -0.08 -1.14 -0.10 0.00 0.00 175.22 173.78 2dhj s GLN 98 N -0.88 0.77 0.32 0.44 0.74 -1.19 -0.40 119.66 119.45 2dhj s GLN 98 Ca -0.10 -0.29 0.03 0.00 0.05 0.00 0.00 55.36 55.05 2dhj s GLN 98 Cb -0.04 -0.74 0.03 0.00 1.10 0.00 0.00 33.01 33.36 2dhj s GLN 98 CO 0.03 0.15 0.27 0.00 -0.55 0.00 0.00 175.29 175.19 2dhj n ALA 99 N 3.05 0.52 -0.12 1.58 0.00 0.69 -3.05 120.51 123.18 2dhj n ALA 99 Ca -0.15 -1.26 -0.26 0.00 0.00 0.00 0.00 53.44 51.76 2dhj n ALA 99 Cb 0.56 0.50 -0.11 0.00 0.00 0.00 0.00 19.45 20.40 2dhj n ALA 99 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2dhj n GLU 100 N -1.32 0.58 -4.30 0.00 1.02 -1.26 -4.83 120.64 110.52 2dhj n GLU 100 Ca 0.00 0.39 -0.25 0.00 -0.02 0.00 0.00 57.16 57.29 2dhj n GLU 100 Cb 0.36 -1.60 -0.13 0.00 -0.02 0.00 0.00 31.44 30.05 2dhj n GLU 100 CO 0.00 0.00 0.00 0.16 1.18 0.00 0.00 177.13 178.47 2dhj s ASP 101 N -7.22 2.63 0.20 1.62 -4.77 -1.26 -4.99 116.67 102.88 2dhj s ASP 101 Ca -0.35 -0.69 -0.21 0.00 -3.30 0.00 0.00 52.55 48.00 2dhj s ASP 101 Cb 0.11 -0.15 0.14 0.00 -1.09 0.00 0.00 42.92 41.93 2dhj s ASP 101 CO 0.54 0.07 1.56 -0.09 0.70 0.00 0.00 175.17 177.95 2dhj h ARG 102 N 4.06 -0.07 -0.47 2.11 2.43 -1.95 0.15 114.38 120.64 2dhj h ARG 102 Ca -0.47 0.01 0.10 0.00 -0.81 0.00 0.00 59.98 58.80 2dhj h ARG 102 Cb 1.18 0.02 -0.10 0.00 -0.42 0.00 0.00 29.97 30.65 2dhj h ARG 102 CO 0.40 -0.05 -0.21 0.22 -1.51 0.00 0.00 179.97 178.81 2dhj h ASP 103 N -0.08 -0.74 -0.48 -3.80 3.58 -2.00 -0.67 116.42 112.24 2dhj h ASP 103 Ca 0.27 0.17 0.08 0.00 0.42 0.00 0.00 57.03 57.97 2dhj h ASP 103 Cb 0.56 0.40 -0.06 0.00 1.72 0.00 0.00 39.33 41.95 2dhj h ASP 103 CO -0.87 -0.24 0.12 0.44 -2.88 0.00 0.00 179.24 175.81 2dhj h ASP 104 N -0.11 0.05 0.00 2.28 3.32 -1.17 -1.12 116.42 119.67 2dhj h ASP 104 Ca 0.22 0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.35 2dhj h ASP 104 Cb 0.46 0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.10 2dhj h ASP 104 CO -0.54 0.06 0.00 0.80 -1.72 0.00 0.00 179.24 177.83 2dhj n MET 105 N -5.08 0.00 -0.32 3.56 1.56 -0.35 -2.27 117.12 114.22 2dhj n MET 105 Ca 0.05 0.60 0.12 0.00 -0.27 0.00 0.00 57.70 58.19 2dhj n MET 105 Cb 0.22 -1.47 0.26 0.00 2.15 0.00 0.00 33.22 34.37 2dhj n MET 105 CO 0.00 0.00 0.00 -0.07 -0.73 0.00 0.00 175.97 175.17 2dhj h LEU 106 N 0.00 -0.40 -0.75 -0.89 3.38 -1.26 0.44 115.31 115.84 2dhj h LEU 106 Ca 0.00 0.25 0.17 0.00 0.09 0.00 0.00 57.88 58.39 2dhj h LEU 106 Cb 0.00 0.43 -0.12 0.00 0.09 0.00 0.00 40.66 41.06 2dhj h LEU 106 CO 0.00 -0.29 0.12 0.00 0.09 0.00 0.00 178.44 178.36 2dhj h ALA 107 N 1.90 0.91 0.31 1.53 0.00 -0.97 -1.73 119.26 121.21 2dhj h ALA 107 Ca 0.55 0.20 -0.02 0.00 0.00 0.00 0.00 54.91 55.64 2dhj h ALA 107 Cb 1.09 0.30 0.00 0.00 0.00 0.00 0.00 17.79 19.18 2dhj h ALA 107 CO -0.83 -0.38 -0.15 -1.49 0.00 0.00 0.00 179.25 176.39 2dhj h TRP 108 N 0.20 -0.39 -0.86 0.00 4.06 0.32 0.15 115.95 119.43 2dhj h TRP 108 Ca 0.42 -0.01 0.18 0.00 2.06 0.00 0.00 58.89 61.54 2dhj h TRP 108 Cb 0.75 0.13 -0.16 0.00 -1.00 0.00 0.00 29.16 28.87 2dhj h TRP 108 CO -0.32 -0.24 -0.20 -0.89 -3.56 0.00 0.00 178.44 173.23 2dhj n ILE 109 N -3.15 -0.36 0.12 1.49 5.41 -1.03 -0.19 119.36 121.65 2dhj n ILE 109 Ca -0.05 1.96 -0.05 0.00 1.00 0.00 0.00 62.75 65.61 2dhj n ILE 109 Cb 0.17 -2.73 -0.02 0.00 -0.71 0.00 0.00 39.64 36.34 2dhj n ILE 109 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.55 177.05 2dhj h LYS 110 N 0.00 -0.31 -0.96 0.38 3.64 -1.25 0.34 116.57 118.40 2dhj h LYS 110 Ca 0.42 0.02 0.14 0.00 -1.27 0.00 0.00 60.65 59.97 2dhj h LYS 110 Cb 0.66 0.07 -0.15 0.00 -0.41 0.00 0.00 32.23 32.40 2dhj h LYS 110 CO -0.88 -0.21 -0.39 2.41 -2.27 0.00 0.00 179.45 178.11 2dhj n THR 111 N -3.17 -0.52 0.09 1.00 -1.04 0.50 0.23 114.28 111.37 2dhj n THR 111 Ca -0.04 2.27 -0.13 0.00 -2.04 0.00 0.00 64.05 64.10 2dhj n THR 111 Cb 0.13 -2.97 -0.08 0.00 -1.82 0.00 0.00 70.33 65.59 2dhj n THR 111 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 2dhj h ILE 112 N 0.00 0.94 -0.79 12.58 2.04 -0.65 -2.48 117.51 129.15 2dhj h ILE 112 Ca 0.32 -0.18 0.16 0.00 1.00 0.00 0.00 64.86 66.17 2dhj h ILE 112 Cb 0.56 1.05 -0.05 0.00 -0.74 0.00 0.00 36.82 37.64 2dhj h ILE 112 CO -0.95 0.04 0.53 1.56 0.00 0.00 0.00 178.15 179.33 2dhj h GLN 113 N -0.23 0.38 -0.12 2.37 4.20 0.15 0.22 115.11 122.08 2dhj h GLN 113 Ca -0.02 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.66 2dhj h GLN 113 Cb 0.19 -0.08 -0.00 0.00 0.30 0.00 0.00 27.48 27.88 2dhj h GLN 113 CO 0.03 0.25 0.01 0.93 -0.67 0.00 0.00 178.83 179.38 2dhj h GLU 114 N 0.39 0.20 -0.36 1.46 5.08 0.21 -3.19 114.58 118.38 2dhj h GLU 114 Ca 0.39 -0.06 -0.12 0.00 -1.00 0.00 0.00 59.36 58.57 2dhj h GLU 114 Cb 0.96 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.18 2dhj h GLU 114 CO -0.13 0.41 -0.26 0.77 -1.00 0.00 0.00 179.01 178.81 2dhj h SER 115 N -0.05 0.84 -0.41 1.42 0.02 -0.85 -3.25 113.55 111.27 2dhj h SER 115 Ca 0.03 -0.44 -0.54 0.00 -0.84 0.00 0.00 61.79 60.01 2dhj h SER 115 Cb 0.32 -0.23 -0.06 0.00 0.14 0.00 0.00 62.40 62.56 2dhj h SER 115 CO 0.00 1.10 1.96 -1.54 -1.14 0.00 0.00 176.83 177.21 2dhj n SER 116 N -4.22 7.39 -3.61 3.07 3.41 0.65 -4.75 113.62 115.57 2dhj n SER 116 Ca -0.02 -2.77 -0.02 0.00 -0.26 0.00 0.00 58.87 55.80 2dhj n SER 116 Cb 0.46 -1.43 -0.04 0.00 -0.26 0.00 0.00 64.21 62.94 2dhj n SER 116 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 2dhj s ASN 117 N 1.46 -1.06 0.05 4.04 3.84 -1.23 -4.20 114.94 117.85 2dhj s ASN 117 Ca 0.64 1.45 -0.30 0.00 0.21 0.00 0.00 52.86 54.85 2dhj s ASN 117 Cb 0.25 2.18 -0.05 0.00 -0.55 0.00 0.00 41.25 43.08 2dhj s ASN 117 CO -0.08 -0.23 1.15 -0.76 -2.79 0.00 0.00 177.10 174.39 2dhj s LEU 118 N 2.86 4.37 -0.91 3.21 1.43 -1.26 -4.98 118.68 123.40 2dhj s LEU 118 Ca -0.03 1.94 -0.14 0.00 -1.03 0.00 0.00 54.13 54.86 2dhj s LEU 118 Cb -0.12 -3.58 0.21 0.00 0.03 0.00 0.00 46.19 42.73 2dhj s LEU 118 CO -0.18 -0.42 0.92 0.20 0.23 0.00 0.00 176.35 177.10 2dhj s ASN 119 N 1.02 6.85 0.22 2.29 0.01 -1.26 -4.89 114.94 119.18 2dhj s ASN 119 Ca 0.57 -2.73 -0.08 0.00 -0.71 0.00 0.00 52.86 49.90 2dhj s ASN 119 Cb -0.28 -2.26 0.28 0.00 0.41 0.00 0.00 41.25 39.41 2dhj s ASN 119 CO 0.29 -0.63 1.79 -1.28 -1.51 0.00 0.00 177.10 175.77 2dhj h SER 120 N 7.77 0.50 -3.12 -1.22 0.87 -1.99 -3.41 113.55 112.95 2dhj h SER 120 Ca 0.14 0.04 -0.59 0.00 -1.23 0.00 0.00 61.79 60.15 2dhj h SER 120 Cb 1.00 -0.05 -0.05 0.00 -0.44 0.00 0.00 62.40 62.87 2dhj h SER 120 CO 0.88 0.31 -0.18 -0.83 -0.53 0.00 0.00 176.83 176.49 2dhj s GLY 121 N -3.09 2.46 0.51 5.77 0.00 -1.26 -4.98 107.32 106.73 2dhj s GLY 121 Ca -0.13 -0.22 0.33 0.00 0.00 0.00 0.00 44.72 44.70 2dhj s GLY 121 CO 0.76 0.09 1.96 -0.56 0.00 0.00 0.00 173.10 175.35 2dhj h PRO 122 N 4.20 0.00 -6.54 2.90 0.13 -2.04 -3.45 132.00 127.19 2dhj h PRO 122 Ca -0.50 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.04 2dhj h PRO 122 Cb 1.21 0.00 0.15 0.00 0.13 0.00 0.00 31.00 32.49 2dhj h PRO 122 CO 0.64 0.00 -0.19 -1.13 -0.23 0.00 0.00 178.00 177.09 2dhj n SER 123 N -2.95 -0.18 -3.64 1.44 3.41 -1.26 -5.01 113.62 105.42 2dhj n SER 123 Ca 0.01 0.86 -0.06 0.00 -0.26 0.00 0.00 58.87 59.41 2dhj n SER 123 Cb 0.28 -1.23 -0.07 0.00 -0.26 0.00 0.00 64.21 62.93 2dhj n SER 123 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2dhj s SER 124 N -1.02 -0.95 0.00 4.04 0.15 -1.26 -5.10 113.70 109.56 2dhj s SER 124 Ca 0.67 1.50 0.00 0.00 0.70 0.00 0.00 55.95 58.82 2dhj s SER 124 Cb -0.51 1.47 0.00 0.00 -1.71 0.00 0.00 66.02 65.28 2dhj s SER 124 CO 0.55 -0.24 0.00 0.61 1.20 0.00 0.00 173.24 175.36