#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dhj h SER 2 N 0.00 0.25 0.00 1.61 0.02 -2.12 -3.42 113.55 109.89 2dhj h SER 2 Ca 0.00 -0.97 -0.14 0.00 -0.84 0.00 0.00 61.79 59.85 2dhj h SER 2 Cb 0.00 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 62.44 2dhj h SER 2 CO 0.00 1.20 -1.39 -1.20 -1.14 0.00 0.00 176.83 174.30 2dhj n SER 3 N -4.36 1.93 0.00 3.07 7.64 -1.26 -5.13 113.62 115.51 2dhj n SER 3 Ca -0.12 0.37 0.00 0.00 1.01 0.00 0.00 58.87 60.13 2dhj n SER 3 Cb 0.65 -0.79 0.00 0.00 -1.01 0.00 0.00 64.21 63.07 2dhj n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dhj n GLY 4 N 1.42 -0.46 3.83 0.23 0.00 -1.26 -5.17 105.19 103.78 2dhj n GLY 4 Ca -0.25 -0.68 -0.07 0.00 0.00 0.00 0.00 46.02 45.01 2dhj n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dhj s SER 5 N -4.00 -0.15 -0.04 1.61 0.01 -1.26 -4.96 113.70 104.91 2dhj s SER 5 Ca 0.00 -0.78 0.05 0.00 1.31 0.00 0.00 55.95 56.52 2dhj s SER 5 Cb 0.00 0.74 -0.01 0.00 0.21 0.00 0.00 66.02 66.97 2dhj s SER 5 CO 0.00 -1.42 -0.18 -0.44 0.41 0.00 0.00 173.24 171.62 2dhj s SER 6 N -2.99 2.18 0.00 2.44 0.01 -1.26 -4.90 113.70 109.17 2dhj s SER 6 Ca 0.13 -0.35 0.00 0.00 1.31 0.00 0.00 55.95 57.04 2dhj s SER 6 Cb -0.05 -0.55 0.00 0.00 0.21 0.00 0.00 66.02 65.63 2dhj s SER 6 CO 0.08 0.17 0.00 0.61 0.41 0.00 0.00 173.24 174.51 2dhj n GLY 7 N 3.06 0.26 3.42 3.44 0.00 -1.26 -5.10 105.19 109.01 2dhj n GLY 7 Ca -0.18 0.16 -0.50 0.00 0.00 0.00 0.00 46.02 45.51 2dhj n GLY 7 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2dhj n ASP 8 N 0.00 1.56 -3.35 1.61 5.68 -1.26 -4.70 116.55 116.09 2dhj n ASP 8 Ca 0.00 0.34 -0.48 0.00 -0.50 0.00 0.00 54.79 54.15 2dhj n ASP 8 Cb 0.00 -1.16 -0.07 0.00 -1.14 0.00 0.00 41.12 38.75 2dhj n ASP 8 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2dhj n ALA 9 N 10.08 -0.99 -0.25 2.12 0.00 -1.26 -4.71 120.51 125.50 2dhj n ALA 9 Ca 0.48 0.35 0.06 0.00 0.00 0.00 0.00 53.44 54.33 2dhj n ALA 9 Cb 0.17 -1.35 0.13 0.00 0.00 0.00 0.00 19.45 18.40 2dhj n ALA 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dhj n ALA 10 N 2.79 0.22 -3.41 0.00 0.00 -0.12 -4.58 120.51 115.41 2dhj n ALA 10 Ca 0.22 0.78 -0.15 0.00 0.00 0.00 0.00 53.44 54.29 2dhj n ALA 10 Cb -0.04 -0.49 -0.05 0.00 0.00 0.00 0.00 19.45 18.87 2dhj n ALA 10 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2dhj s LYS 11 N -5.82 1.11 0.03 0.00 2.20 -1.20 -5.03 119.74 111.03 2dhj s LYS 11 Ca -0.10 -0.12 -0.12 0.00 -0.36 0.00 0.00 55.97 55.26 2dhj s LYS 11 Cb 0.20 0.51 0.01 0.00 -1.51 0.00 0.00 37.83 37.05 2dhj s LYS 11 CO 0.55 -0.41 0.26 -1.83 -0.36 0.00 0.00 175.35 173.57 2dhj s GLU 12 N -2.36 0.73 0.00 4.03 -1.05 -1.26 -0.50 118.70 118.28 2dhj s GLU 12 Ca -0.06 -0.47 0.00 0.00 -0.15 0.00 0.00 54.97 54.29 2dhj s GLU 12 Cb -0.01 0.31 0.00 0.00 -0.44 0.00 0.00 34.13 34.00 2dhj s GLU 12 CO -0.01 -0.22 0.00 0.41 0.95 0.00 0.00 175.26 176.40 2dhj n GLY 13 N 0.80 3.42 3.67 -3.83 0.00 -1.04 -5.04 105.19 103.16 2dhj n GLY 13 Ca -0.20 -0.48 -0.42 0.00 0.00 0.00 0.00 46.02 44.92 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 -1.85 2.15 0.02 1.61 0.52 -1.26 -2.82 118.94 117.31 2dhj s TRP 14 Ca 0.00 0.31 0.00 0.00 0.02 0.00 0.00 56.10 56.43 2dhj s TRP 14 Cb 0.00 -3.87 -0.02 0.00 -1.15 0.00 0.00 33.47 28.43 2dhj s TRP 14 CO 0.00 -3.59 -0.03 -0.51 0.02 0.00 0.00 176.95 172.84 2dhj s LEU 15 N 3.73 2.20 -0.49 2.99 1.43 -1.26 -4.77 118.68 122.51 2dhj s LEU 15 Ca 0.71 -0.42 -0.29 0.00 -1.03 0.00 0.00 54.13 53.11 2dhj s LEU 15 Cb -0.33 0.07 0.03 0.00 0.03 0.00 0.00 46.19 45.99 2dhj s LEU 15 CO 0.28 -0.25 1.14 -1.00 0.23 0.00 0.00 176.35 176.76 2dhj s HIS 16 N -1.21 2.79 -0.46 0.29 3.76 -1.21 -3.17 115.29 116.07 2dhj s HIS 16 Ca -0.13 0.65 -0.19 0.00 -0.15 0.00 0.00 55.06 55.24 2dhj s HIS 16 Cb -0.08 -4.44 0.04 0.00 1.11 0.00 0.00 32.58 29.21 2dhj s HIS 16 CO -0.01 -1.32 0.58 0.12 -0.85 0.00 0.00 174.74 173.26 2dhj s PHE 17 N 4.51 3.09 -0.37 1.40 5.36 -1.02 -3.32 117.98 127.61 2dhj s PHE 17 Ca 0.47 -0.36 0.03 0.00 -0.96 0.00 0.00 56.93 56.10 2dhj s PHE 17 Cb -0.07 -3.31 0.11 0.00 -0.34 0.00 0.00 43.02 39.40 2dhj s PHE 17 CO 0.31 -0.90 0.10 0.50 -1.46 0.00 0.00 175.22 173.77 2dhj s ARG 18 N 2.54 1.64 0.35 10.12 3.52 -1.01 -1.70 118.95 134.41 2dhj s ARG 18 Ca 0.16 -1.95 -0.27 0.00 -0.13 0.00 0.00 55.73 53.54 2dhj s ARG 18 Cb -0.17 -3.29 -0.09 0.00 -1.56 0.00 0.00 34.95 29.83 2dhj s ARG 18 CO 0.14 -0.98 1.21 -1.25 -0.81 0.00 0.00 175.30 173.61 2dhj s PRO 19 N 0.81 4.29 -0.17 5.12 0.04 -1.26 0.03 135.00 143.86 2dhj s PRO 19 Ca 0.11 1.99 -0.25 0.00 0.04 0.00 0.00 61.00 62.89 2dhj s PRO 19 Cb -0.20 -2.94 -0.23 0.00 0.04 0.00 0.00 34.50 31.16 2dhj s PRO 19 CO -0.07 -0.16 0.53 -0.07 0.04 0.00 0.00 177.00 177.27 2dhj h LEU 20 N 3.17 0.03 -8.49 -3.56 3.38 -1.52 -3.47 115.31 104.84 2dhj h LEU 20 Ca -0.48 -0.79 -0.23 0.00 0.09 0.00 0.00 57.88 56.47 2dhj h LEU 20 Cb 1.23 -0.01 -0.15 0.00 0.09 0.00 0.00 40.66 41.82 2dhj h LEU 20 CO 0.65 1.25 -0.67 -0.69 0.09 0.00 0.00 178.44 179.06 2dhj s VAL 21 N -2.30 0.52 0.04 1.22 1.01 -1.25 -5.05 120.40 114.58 2dhj s VAL 21 Ca -0.23 -1.93 0.00 0.00 0.00 0.00 0.00 61.98 59.82 2dhj s VAL 21 Cb 0.01 -1.89 0.00 0.00 0.00 0.00 0.00 36.38 34.50 2dhj s VAL 21 CO 0.66 -0.66 0.00 0.35 0.00 0.00 0.00 175.10 175.44 2dhj n THR 22 N -0.11 0.04 -1.09 3.92 -2.24 -1.26 -4.59 114.28 108.95 2dhj n THR 22 Ca -0.09 0.01 -0.36 0.00 -2.27 0.00 0.00 64.05 61.35 2dhj n THR 22 Cb 0.62 -0.75 0.07 0.00 -2.10 0.00 0.00 70.33 68.17 2dhj n THR 22 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2dhj n ASP 23 N -2.75 -2.90 0.30 3.42 5.75 -1.26 -4.92 116.55 114.19 2dhj n ASP 23 Ca 0.00 0.44 -0.15 0.00 -0.01 0.00 0.00 54.79 55.08 2dhj n ASP 23 Cb 0.11 -1.05 -0.08 0.00 -1.03 0.00 0.00 41.12 39.07 2dhj n ASP 23 CO 0.00 0.00 0.00 0.50 -0.11 0.00 0.00 177.20 177.59 2dhj h LYS 24 N -0.73 -0.74 -1.05 0.11 3.11 -1.99 -3.44 116.57 111.84 2dhj h LYS 24 Ca -0.44 0.05 -0.08 0.00 -2.81 0.00 0.00 60.65 57.38 2dhj h LYS 24 Cb 1.34 0.17 -0.20 0.00 -1.00 0.00 0.00 32.23 32.54 2dhj h LYS 24 CO 0.36 -0.43 -0.46 0.20 -2.81 0.00 0.00 179.45 176.31 2dhj s GLY 25 N -2.48 -1.21 0.23 5.01 0.00 -1.26 -5.16 107.32 102.46 2dhj s GLY 25 Ca -0.15 0.16 -0.05 0.00 0.00 0.00 0.00 44.72 44.68 2dhj s GLY 25 CO 0.50 3.62 0.29 0.54 0.00 0.00 0.00 173.10 178.05 2dhj s LYS 26 N 1.83 1.41 -0.37 2.90 1.02 -1.26 -5.08 119.74 120.19 2dhj s LYS 26 Ca 0.16 -1.51 0.09 0.00 0.02 0.00 0.00 55.97 54.73 2dhj s LYS 26 Cb -0.05 0.36 0.44 0.00 -0.52 0.00 0.00 37.83 38.07 2dhj s LYS 26 CO -0.07 -0.53 1.10 -2.13 -0.92 0.00 0.00 175.35 172.80 2dhj n ARG 27 N -0.35 2.89 -3.00 1.68 0.63 -1.26 -5.07 116.66 112.18 2dhj n ARG 27 Ca 0.01 -4.11 -0.36 0.00 -0.92 0.00 0.00 57.85 52.46 2dhj n ARG 27 Cb 0.64 -2.01 -0.06 0.00 0.45 0.00 0.00 32.46 31.48 2dhj n ARG 27 CO 0.00 0.00 0.00 0.14 -2.51 0.00 0.00 177.63 175.26 2dhj s VAL 28 N -4.73 4.46 -0.35 5.15 -7.23 -1.26 -5.05 120.40 111.38 2dhj s VAL 28 Ca 0.43 1.46 -0.07 0.00 -1.81 0.00 0.00 61.98 61.99 2dhj s VAL 28 Cb 0.41 -3.91 0.05 0.00 0.56 0.00 0.00 36.38 33.49 2dhj s VAL 28 CO -0.08 0.19 0.13 -0.83 -0.31 0.00 0.00 175.10 174.20 2dhj s GLY 29 N -1.63 1.87 0.00 2.32 0.00 -1.26 -5.00 107.32 103.62 2dhj s GLY 29 Ca 0.45 -1.85 0.00 0.00 0.00 0.00 0.00 44.72 43.32 2dhj s GLY 29 CO 0.22 0.81 0.00 0.61 0.00 0.00 0.00 173.10 174.74 2dhj n GLY 30 N 4.82 -0.02 3.60 0.20 0.00 -1.26 -5.04 105.19 107.49 2dhj n GLY 30 Ca -0.12 -2.19 -0.21 0.00 0.00 0.00 0.00 46.02 43.51 2dhj n GLY 30 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dhj n SER 31 N 0.00 -2.74 -3.96 1.61 7.64 -1.26 -5.00 113.62 109.91 2dhj n SER 31 Ca 0.00 -0.69 -0.09 0.00 1.01 0.00 0.00 58.87 59.09 2dhj n SER 31 Cb 0.00 -4.63 -0.11 0.00 -1.01 0.00 0.00 64.21 58.46 2dhj n SER 31 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2dhj s ILE 32 N -3.45 0.09 0.13 0.44 1.01 -1.26 -5.11 121.20 113.05 2dhj s ILE 32 Ca 0.17 -0.78 0.04 0.00 0.00 0.00 0.00 60.65 60.08 2dhj s ILE 32 Cb -0.08 -0.23 -0.04 0.00 0.01 0.00 0.00 42.46 42.12 2dhj s ILE 32 CO 0.77 -0.43 0.10 -0.13 0.00 0.00 0.00 174.94 175.25 2dhj s ARG 33 N -1.26 2.85 1.05 2.79 1.81 -1.26 -5.12 118.95 119.80 2dhj s ARG 33 Ca -0.14 -0.81 -0.18 0.00 -1.72 0.00 0.00 55.73 52.89 2dhj s ARG 33 Cb -0.09 -2.66 0.26 0.00 -0.45 0.00 0.00 34.95 32.02 2dhj s ARG 33 CO -0.01 0.52 0.93 -0.35 -0.68 0.00 0.00 175.30 175.71 2dhj n PRO 34 N 0.05 -2.84 -1.04 3.54 -0.04 -1.26 -4.86 135.00 128.55 2dhj n PRO 34 Ca -0.09 -1.49 -0.33 0.00 -0.04 0.00 0.00 63.50 61.56 2dhj n PRO 34 Cb 0.53 -1.40 0.01 0.00 -0.04 0.00 0.00 33.50 32.61 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 -4.52 -2.64 -3.69 0.54 7.02 -1.26 -4.89 117.44 108.00 2dhj n TRP 35 Ca 0.13 0.35 -0.30 0.00 -1.02 0.00 0.00 57.50 56.66 2dhj n TRP 35 Cb 0.50 -1.42 -0.14 0.00 -2.42 0.00 0.00 31.31 27.84 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 -0.93 1.00 -0.19 -0.99 1.02 -0.69 -4.95 119.74 114.01 2dhj s LYS 36 Ca 0.47 -1.61 -0.28 0.00 0.02 0.00 0.00 55.97 54.57 2dhj s LYS 36 Cb -0.40 -2.10 -0.05 0.00 -0.52 0.00 0.00 37.83 34.76 2dhj s LYS 36 CO 0.57 -1.11 2.09 -1.14 -0.92 0.00 0.00 175.35 174.85 2dhj s GLN 37 N 0.87 3.34 -0.19 1.68 0.74 -1.26 -2.44 119.66 122.40 2dhj s GLN 37 Ca 0.15 2.02 -0.12 0.00 0.05 0.00 0.00 55.36 57.46 2dhj s GLN 37 Cb -0.22 -4.30 0.06 0.00 1.10 0.00 0.00 33.01 29.65 2dhj s GLN 37 CO -0.08 -1.86 0.48 0.00 -0.55 0.00 0.00 175.29 173.28 2dhj s MET 38 N 5.89 0.49 -0.36 1.67 0.23 -1.19 -4.92 119.30 121.10 2dhj s MET 38 Ca 0.94 0.84 -0.41 0.00 -1.03 0.00 0.00 55.69 56.04 2dhj s MET 38 Cb -0.33 0.07 -0.16 0.00 -1.53 0.00 0.00 34.83 32.89 2dhj s MET 38 CO 0.36 -0.14 1.86 0.98 -2.03 0.00 0.00 175.02 176.05 2dhj n TYR 39 N 3.95 1.80 -3.83 3.16 9.36 0.16 -3.99 117.16 127.76 2dhj n TYR 39 Ca -0.21 0.62 -0.36 0.00 3.32 0.00 0.00 57.90 61.28 2dhj n TYR 39 Cb 0.56 -2.41 -0.13 0.00 -0.63 0.00 0.00 39.34 36.74 2dhj n TYR 39 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 2dhj s VAL 40 N 4.51 4.17 -0.07 2.97 1.01 -1.13 0.67 120.40 132.54 2dhj s VAL 40 Ca 1.05 -0.22 0.04 0.00 0.00 0.00 0.00 61.98 62.85 2dhj s VAL 40 Cb -1.17 -2.94 -0.02 0.00 0.00 0.00 0.00 36.38 32.26 2dhj s VAL 40 CO 0.66 0.37 -0.20 -0.69 0.00 0.00 0.00 175.10 175.23 2dhj s VAL 41 N 1.46 2.48 -0.30 2.92 1.01 -0.79 -2.50 120.40 124.67 2dhj s VAL 41 Ca 0.05 -0.91 -0.10 0.00 0.00 0.00 0.00 61.98 61.02 2dhj s VAL 41 Cb -0.15 -1.95 -0.02 0.00 0.00 0.00 0.00 36.38 34.27 2dhj s VAL 41 CO 0.02 0.57 0.15 -0.22 0.00 0.00 0.00 175.10 175.62 2dhj s LEU 42 N -0.23 4.01 -0.30 3.92 2.96 0.34 -0.72 118.68 128.66 2dhj s LEU 42 Ca -0.01 -0.39 -0.01 0.00 -0.22 0.00 0.00 54.13 53.50 2dhj s LEU 42 Cb -0.13 -2.01 0.10 0.00 0.50 0.00 0.00 46.19 44.64 2dhj s LEU 42 CO 0.03 -0.15 0.09 -0.13 -1.32 0.00 0.00 176.35 174.87 2dhj s ARG 43 N 1.64 0.75 4.83 1.98 0.52 -1.02 -0.95 118.95 126.71 2dhj s ARG 43 Ca 0.05 -1.07 0.00 0.00 -0.52 0.00 0.00 55.73 54.20 2dhj s ARG 43 Cb -0.17 -2.05 0.00 0.00 0.52 0.00 0.00 34.95 33.26 2dhj s ARG 43 CO 0.07 -0.96 0.00 0.41 0.02 0.00 0.00 175.30 174.84 2dhj n GLY 44 N 4.83 1.70 0.04 -3.53 0.00 -1.26 -3.21 105.19 103.76 2dhj n GLY 44 Ca -0.02 -0.31 0.01 0.00 0.00 0.00 0.00 46.02 45.70 2dhj n GLY 44 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2dhj n HIS 45 N 0.00 0.00 -4.63 1.61 8.25 -1.26 -4.80 115.22 114.40 2dhj n HIS 45 Ca 0.00 -0.39 -0.23 0.00 -0.26 0.00 0.00 57.72 56.84 2dhj n HIS 45 Cb 0.00 -0.05 -0.14 0.00 1.12 0.00 0.00 29.99 30.92 2dhj n HIS 45 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 2dhj s SER 46 N -0.94 1.95 -0.28 0.41 0.01 -1.20 0.10 113.70 113.74 2dhj s SER 46 Ca 0.04 -0.38 -0.11 0.00 1.31 0.00 0.00 55.95 56.81 2dhj s SER 46 Cb 0.03 -0.18 -0.05 0.00 0.21 0.00 0.00 66.02 66.04 2dhj s SER 46 CO 0.00 0.15 0.18 -0.76 0.41 0.00 0.00 173.24 173.22 2dhj s LEU 47 N -0.74 3.97 -0.47 2.44 1.43 -0.66 -2.42 118.68 122.22 2dhj s LEU 47 Ca 0.05 -0.05 -0.13 0.00 -1.03 0.00 0.00 54.13 52.98 2dhj s LEU 47 Cb -0.07 -2.10 0.10 0.00 0.03 0.00 0.00 46.19 44.15 2dhj s LEU 47 CO 0.00 -0.06 0.37 -0.31 0.23 0.00 0.00 176.35 176.59 2dhj s TYR 48 N 1.74 3.31 0.40 0.29 2.02 0.10 -2.96 117.35 122.24 2dhj s TYR 48 Ca 0.07 -1.37 -0.12 0.00 -0.37 0.00 0.00 57.07 55.29 2dhj s TYR 48 Cb -0.16 -3.33 -0.07 0.00 -0.40 0.00 0.00 41.96 38.00 2dhj s TYR 48 CO 0.10 -0.90 0.78 -0.51 -1.57 0.00 0.00 175.55 173.44 2dhj s LEU 49 N 1.52 3.86 -0.06 -1.29 1.02 -1.26 -1.89 118.68 120.58 2dhj s LEU 49 Ca 0.04 1.19 -0.05 0.00 0.02 0.00 0.00 54.13 55.32 2dhj s LEU 49 Cb -0.26 -4.06 0.02 0.00 0.02 0.00 0.00 46.19 41.91 2dhj s LEU 49 CO 0.03 -0.37 0.15 -0.31 0.02 0.00 0.00 176.35 175.87 2dhj s TYR 50 N -2.31 -0.17 0.16 0.29 2.02 0.21 -4.54 117.35 113.01 2dhj s TYR 50 Ca 0.52 0.43 0.19 0.00 -0.37 0.00 0.00 57.07 57.84 2dhj s TYR 50 Cb -0.10 0.05 0.70 0.00 -0.40 0.00 0.00 41.96 42.20 2dhj s TYR 50 CO 0.29 -0.09 1.74 1.57 -1.57 0.00 0.00 175.55 177.49 2dhj h LYS 51 N 6.04 0.00 -3.04 -0.62 2.10 -1.91 0.44 116.57 119.58 2dhj h LYS 51 Ca -0.27 0.00 -0.20 0.00 -2.00 0.00 0.00 60.65 58.19 2dhj h LYS 51 Cb 1.19 0.00 -0.30 0.00 -0.90 0.00 0.00 32.23 32.23 2dhj h LYS 51 CO 0.41 0.36 -0.49 -0.51 -2.00 0.00 0.00 179.45 177.22 2dhj s ASP 52 N -6.42 -0.26 -0.14 7.07 1.01 -1.26 -4.70 116.67 111.97 2dhj s ASP 52 Ca 0.00 0.51 -0.01 0.00 0.71 0.00 0.00 52.55 53.76 2dhj s ASP 52 Cb 0.11 0.40 0.05 0.00 1.01 0.00 0.00 42.92 44.49 2dhj s ASP 52 CO 0.68 -0.16 2.21 1.17 0.21 0.00 0.00 175.17 179.28 2dhj n LYS 53 N 4.20 1.47 -0.00 8.23 4.81 -1.26 -4.28 118.16 131.33 2dhj n LYS 53 Ca -0.25 -0.81 -0.00 0.00 -0.87 0.00 0.00 58.31 56.38 2dhj n LYS 53 Cb 0.53 -1.39 -0.00 0.00 0.02 0.00 0.00 35.03 34.19 2dhj n LYS 53 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 2dhj n ARG 54 N 1.14 0.03 0.14 1.64 3.00 -1.26 -4.63 116.66 116.72 2dhj n ARG 54 Ca 0.18 0.05 0.01 0.00 -0.01 0.00 0.00 57.85 58.08 2dhj n ARG 54 Cb 0.57 -0.58 0.33 0.00 0.00 0.00 0.00 32.46 32.78 2dhj n ARG 54 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.63 178.68 2dhj h GLU 55 N -0.05 0.13 -5.23 5.56 9.09 -2.02 -3.45 114.58 118.60 2dhj h GLU 55 Ca 0.00 -0.05 -0.25 0.00 0.05 0.00 0.00 59.36 59.12 2dhj h GLU 55 Cb 0.05 -0.01 -0.12 0.00 -1.65 0.00 0.00 28.75 27.02 2dhj h GLU 55 CO 0.00 0.44 -0.37 1.04 0.05 0.00 0.00 179.01 180.17 2dhj n GLN 56 N -4.12 -0.93 0.00 1.06 6.02 -1.26 -4.68 117.38 113.47 2dhj n GLN 56 Ca -0.02 0.05 0.00 0.00 -0.01 0.00 0.00 57.00 57.02 2dhj n GLN 56 Cb 0.39 -1.66 0.00 0.00 1.02 0.00 0.00 30.24 29.99 2dhj n GLN 56 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 2dhj n THR 57 N -2.16 0.00 -1.27 5.09 -2.24 -1.26 -5.06 114.28 107.37 2dhj n THR 57 Ca -0.04 0.06 -0.36 0.00 -2.27 0.00 0.00 64.05 61.44 2dhj n THR 57 Cb 0.23 -0.88 0.07 0.00 -2.10 0.00 0.00 70.33 67.65 2dhj n THR 57 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2dhj n THR 58 N -1.85 1.94 0.27 4.28 -2.24 -1.26 -4.87 114.28 110.54 2dhj n THR 58 Ca 0.00 -0.39 0.16 0.00 -2.27 0.00 0.00 64.05 61.55 2dhj n THR 58 Cb 0.00 -0.80 0.67 0.00 -2.10 0.00 0.00 70.33 68.10 2dhj n THR 58 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 2dhj h PRO 59 N -0.36 0.00 -1.29 -0.78 0.13 -1.97 -3.45 132.00 124.28 2dhj h PRO 59 Ca -0.46 0.00 0.15 0.00 -0.87 0.00 0.00 66.00 64.82 2dhj h PRO 59 Cb 1.35 0.00 -0.29 0.00 0.13 0.00 0.00 31.00 32.19 2dhj h PRO 59 CO 0.43 0.04 0.72 -1.54 -0.23 0.00 0.00 178.00 177.43 2dhj s SER 60 N -5.77 -0.21 -0.21 1.44 1.04 -1.26 -4.44 113.70 104.29 2dhj s SER 60 Ca 0.01 0.35 -0.13 0.00 0.48 0.00 0.00 55.95 56.66 2dhj s SER 60 Cb 0.09 0.34 -0.19 0.00 0.10 0.00 0.00 66.02 66.37 2dhj s SER 60 CO 0.55 -0.11 0.05 -0.62 0.98 0.00 0.00 173.24 174.09 2dhj n GLU 61 N 1.44 0.63 0.10 4.02 -0.58 -1.26 -4.93 120.64 120.05 2dhj n GLU 61 Ca -0.09 0.37 0.00 0.00 -0.42 0.00 0.00 57.16 57.02 2dhj n GLU 61 Cb 0.57 -1.64 0.00 0.00 -0.57 0.00 0.00 31.44 29.80 2dhj n GLU 61 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2dhj n GLU 62 N -4.00 0.00 -0.17 3.49 1.02 -1.26 -5.11 120.64 114.61 2dhj n GLU 62 Ca -0.40 0.00 -0.20 0.00 -0.02 0.00 0.00 57.16 56.54 2dhj n GLU 62 Cb 0.86 -0.21 0.19 0.00 -0.02 0.00 0.00 31.44 32.27 2dhj n GLU 62 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2dhj n GLU 63 N -3.42 -3.85 -4.25 3.49 -0.58 -1.26 -5.06 120.64 105.71 2dhj n GLU 63 Ca 0.00 -0.97 -0.20 0.00 -0.42 0.00 0.00 57.16 55.58 2dhj n GLU 63 Cb 0.00 -1.24 -0.11 0.00 -0.57 0.00 0.00 31.44 29.52 2dhj n GLU 63 CO 0.00 0.00 0.00 1.14 -0.48 0.00 0.00 177.13 177.79 2dhj s GLN 64 N -4.38 1.05 0.37 3.49 -2.07 -1.26 -4.84 119.66 112.02 2dhj s GLN 64 Ca 0.44 -1.21 -0.27 0.00 -1.82 0.00 0.00 55.36 52.50 2dhj s GLN 64 Cb -0.08 -1.05 -0.09 0.00 -1.09 0.00 0.00 33.01 30.70 2dhj s GLN 64 CO 0.37 0.22 1.20 -1.25 -1.32 0.00 0.00 175.29 174.51 2dhj s PRO 65 N -2.41 4.20 -0.18 9.60 0.04 -1.26 -4.84 135.00 140.15 2dhj s PRO 65 Ca 0.08 1.95 -0.03 0.00 0.04 0.00 0.00 61.00 63.05 2dhj s PRO 65 Cb -0.07 -2.85 -0.01 0.00 0.04 0.00 0.00 34.50 31.61 2dhj s PRO 65 CO 0.04 -0.23 -0.07 0.42 0.04 0.00 0.00 177.00 177.19 2dhj s ILE 66 N -1.30 3.35 -0.70 0.56 1.01 -1.16 -4.91 121.20 118.05 2dhj s ILE 66 Ca 0.53 -0.53 -0.27 0.00 0.00 0.00 0.00 60.65 60.39 2dhj s ILE 66 Cb -0.34 -2.48 0.01 0.00 0.01 0.00 0.00 42.46 39.66 2dhj s ILE 66 CO 0.43 0.47 1.56 -0.94 0.00 0.00 0.00 174.94 176.46 2dhj s SER 67 N 0.93 5.75 0.42 3.58 1.04 -1.26 -1.66 113.70 122.50 2dhj s SER 67 Ca -0.01 -0.16 0.29 0.00 0.48 0.00 0.00 55.95 56.54 2dhj s SER 67 Cb -0.15 -2.55 1.09 0.00 0.10 0.00 0.00 66.02 64.52 2dhj s SER 67 CO 0.00 -2.09 1.84 -0.37 0.98 0.00 0.00 173.24 173.60 2dhj h VAL 68 N 6.48 0.00 -0.23 5.02 -1.51 -0.70 -3.39 116.25 121.92 2dhj h VAL 68 Ca -0.24 -0.47 -0.77 0.00 -1.23 0.00 0.00 66.70 63.99 2dhj h VAL 68 Cb 1.09 1.39 -0.03 0.00 -2.13 0.00 0.00 31.29 31.61 2dhj h VAL 68 CO 1.26 0.00 1.27 -3.20 -1.23 0.00 0.00 177.57 175.66 2dhj n ASN 69 N -2.76 0.96 -1.71 4.19 5.15 -0.99 0.38 115.26 120.48 2dhj n ASN 69 Ca 0.02 0.71 -0.07 0.00 -0.60 0.00 0.00 54.58 54.63 2dhj n ASN 69 Cb 0.32 -0.94 0.03 0.00 -0.53 0.00 0.00 39.78 38.66 2dhj n ASN 69 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2dhj n ALA 70 N 7.38 -0.58 -1.99 5.20 0.00 -1.26 -4.78 120.51 124.48 2dhj n ALA 70 Ca 0.51 0.06 -0.22 0.00 0.00 0.00 0.00 53.44 53.78 2dhj n ALA 70 Cb -0.01 -1.68 0.09 0.00 0.00 0.00 0.00 19.45 17.84 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 -5.00 2.47 0.07 0.00 1.43 -0.33 -4.97 118.68 112.35 2dhj s LEU 72 Ca 0.64 -1.51 -0.12 0.00 -1.03 0.00 0.00 54.13 52.11 2dhj s LEU 72 Cb -0.06 -0.98 -0.06 0.00 0.03 0.00 0.00 46.19 45.12 2dhj s LEU 72 CO 0.42 -0.37 0.43 -0.63 0.23 0.00 0.00 176.35 176.44 2dhj s ILE 73 N 1.52 5.03 -0.29 -0.59 1.01 -1.26 -1.86 121.20 124.76 2dhj s ILE 73 Ca 0.06 0.61 -0.13 0.00 0.00 0.00 0.00 60.65 61.19 2dhj s ILE 73 Cb -0.18 -3.68 0.12 0.00 0.01 0.00 0.00 42.46 38.74 2dhj s ILE 73 CO -0.17 0.35 0.74 -1.81 0.00 0.00 0.00 174.94 174.04 2dhj s ASP 74 N -1.59 -0.95 -0.80 3.58 1.01 0.11 -4.99 116.67 113.03 2dhj s ASP 74 Ca 0.32 1.38 -0.34 0.00 0.71 0.00 0.00 52.55 54.62 2dhj s ASP 74 Cb -0.15 1.86 -0.19 0.00 1.01 0.00 0.00 42.92 45.45 2dhj s ASP 74 CO 0.17 -0.20 2.52 -0.38 0.21 0.00 0.00 175.17 177.49 2dhj n ILE 75 N 4.92 0.00 -0.95 0.77 5.41 -1.26 -0.44 119.36 127.81 2dhj n ILE 75 Ca -0.14 -0.08 -0.32 0.00 1.00 0.00 0.00 62.75 63.21 2dhj n ILE 75 Cb 0.53 -0.75 0.02 0.00 -0.71 0.00 0.00 39.64 38.73 2dhj n ILE 75 CO 0.00 0.00 0.00 -1.20 0.00 0.00 0.00 176.55 175.35 2dhj n SER 76 N 10.18 -4.11 -3.49 4.38 7.64 -1.21 -4.72 113.62 122.29 2dhj n SER 76 Ca 0.60 0.35 -0.16 0.00 1.01 0.00 0.00 58.87 60.67 2dhj n SER 76 Cb 0.07 -0.68 0.15 0.00 -1.01 0.00 0.00 64.21 62.74 2dhj n SER 76 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dhj n TYR 77 N -1.69 -2.55 -0.03 1.43 0.18 -1.26 -4.89 117.16 108.35 2dhj n TYR 77 Ca 0.02 -0.08 -0.12 0.00 1.88 0.00 0.00 57.90 59.61 2dhj n TYR 77 Cb 0.43 -1.36 -0.14 0.00 -0.38 0.00 0.00 39.34 37.89 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 -1.47 1.11 -2.51 9.48 2.88 -1.26 -4.36 113.62 117.49 2dhj n SER 78 Ca 0.07 0.32 -0.19 0.00 -1.33 0.00 0.00 58.87 57.73 2dhj n SER 78 Cb 0.31 -0.16 -0.10 0.00 -0.75 0.00 0.00 64.21 63.51 2dhj n SER 78 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2dhj n GLU 79 N -3.12 2.32 0.00 -1.46 1.02 -1.26 -3.82 120.64 114.32 2dhj n GLU 79 Ca -0.23 -1.29 0.02 0.00 -0.02 0.00 0.00 57.16 55.64 2dhj n GLU 79 Cb 1.06 -2.22 -0.00 0.00 -0.02 0.00 0.00 31.44 30.26 2dhj n GLU 79 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 2dhj n THR 80 N 3.00 0.00 -2.04 2.62 -1.04 -1.26 -4.99 114.28 110.57 2dhj n THR 80 Ca 0.50 -0.46 -0.11 0.00 -2.04 0.00 0.00 64.05 61.94 2dhj n THR 80 Cb 0.59 1.04 -0.02 0.00 -1.82 0.00 0.00 70.33 70.12 2dhj n THR 80 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 2dhj n LYS 81 N -0.39 -1.93 -3.93 -2.82 4.81 -1.25 -4.91 118.16 107.73 2dhj n LYS 81 Ca 0.01 0.56 -0.14 0.00 -0.87 0.00 0.00 58.31 57.88 2dhj n LYS 81 Cb 0.07 -5.01 -0.14 0.00 0.02 0.00 0.00 35.03 29.97 2dhj n LYS 81 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 2dhj s ARG 82 N -4.26 0.12 0.15 1.64 0.52 -1.26 -5.16 118.95 110.70 2dhj s ARG 82 Ca 0.00 -0.02 -0.00 0.00 -0.52 0.00 0.00 55.73 55.19 2dhj s ARG 82 Cb 0.00 -0.16 -0.04 0.00 0.52 0.00 0.00 34.95 35.26 2dhj s ARG 82 CO 0.00 -0.00 0.32 0.15 0.02 0.00 0.00 175.30 175.78 2dhj s LYS 83 N 0.18 3.49 -1.39 3.54 1.02 -1.26 -4.39 119.74 120.92 2dhj s LYS 83 Ca -0.01 -0.41 -0.08 0.00 0.02 0.00 0.00 55.97 55.49 2dhj s LYS 83 Cb -0.03 -2.92 0.01 0.00 -0.52 0.00 0.00 37.83 34.37 2dhj s LYS 83 CO -0.00 0.49 1.01 0.09 -0.92 0.00 0.00 175.35 176.01 2dhj n ASN 84 N -0.32 -6.26 -4.64 2.83 5.03 -1.26 -4.40 115.26 106.24 2dhj n ASN 84 Ca -0.05 -0.46 -0.35 0.00 0.87 0.00 0.00 54.58 54.59 2dhj n ASN 84 Cb 0.53 -4.94 -0.10 0.00 -1.02 0.00 0.00 39.78 34.25 2dhj n ASN 84 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2dhj s VAL 85 N -3.27 4.25 -0.01 2.41 1.01 -1.26 -0.10 120.40 123.42 2dhj s VAL 85 Ca 0.50 -0.26 0.04 0.00 0.00 0.00 0.00 61.98 62.26 2dhj s VAL 85 Cb -0.22 -2.81 -0.01 0.00 0.00 0.00 0.00 36.38 33.34 2dhj s VAL 85 CO 0.62 0.57 -0.14 0.72 0.00 0.00 0.00 175.10 176.87 2dhj s PHE 86 N -0.51 1.27 -0.06 5.22 -0.71 0.42 -3.35 117.98 120.26 2dhj s PHE 86 Ca 0.09 -0.25 -0.18 0.00 -1.04 0.00 0.00 56.93 55.55 2dhj s PHE 86 Cb -0.12 -0.82 -0.05 0.00 -1.21 0.00 0.00 43.02 40.82 2dhj s PHE 86 CO 0.02 -0.03 0.49 0.50 -1.34 0.00 0.00 175.22 174.86 2dhj s ARG 87 N -0.28 4.24 -0.03 1.99 3.52 0.41 -2.15 118.95 126.66 2dhj s ARG 87 Ca 0.04 0.51 0.03 0.00 -0.13 0.00 0.00 55.73 56.19 2dhj s ARG 87 Cb -0.06 -3.36 0.00 0.00 -1.56 0.00 0.00 34.95 29.97 2dhj s ARG 87 CO -0.00 0.33 -0.11 -1.17 -0.81 0.00 0.00 175.30 173.54 2dhj s LEU 88 N 0.02 1.81 -0.12 -0.88 0.20 -0.98 0.09 118.68 118.82 2dhj s LEU 88 Ca 0.27 -0.22 0.00 0.00 0.69 0.00 0.00 54.13 54.86 2dhj s LEU 88 Cb -0.16 -0.65 0.02 0.00 -0.43 0.00 0.00 46.19 44.97 2dhj s LEU 88 CO 0.13 0.08 -0.11 -0.89 -0.29 0.00 0.00 176.35 175.27 2dhj s THR 89 N 0.17 1.25 0.30 3.68 2.01 -0.78 -1.43 115.64 120.84 2dhj s THR 89 Ca -0.03 -0.44 0.07 0.00 0.31 0.00 0.00 61.69 61.60 2dhj s THR 89 Cb -0.09 -1.21 -0.03 0.00 0.01 0.00 0.00 72.50 71.18 2dhj s THR 89 CO 0.01 0.40 0.31 0.42 -0.69 0.00 0.00 174.62 175.07 2dhj s THR 90 N 1.54 4.07 0.44 -0.82 -4.23 0.13 -1.19 115.64 115.58 2dhj s THR 90 Ca 0.03 -1.27 0.15 0.00 -1.18 0.00 0.00 61.69 59.42 2dhj s THR 90 Cb -0.13 -3.36 0.34 0.00 1.34 0.00 0.00 72.50 70.69 2dhj s THR 90 CO -0.08 -0.24 1.97 0.28 -0.54 0.00 0.00 174.62 176.01 2dhj h SER 91 N 1.24 0.35 0.18 3.99 0.02 -1.83 -2.96 113.55 114.54 2dhj h SER 91 Ca -0.47 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.49 2dhj h SER 91 Cb 1.25 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.73 2dhj h SER 91 CO 0.58 0.20 -0.09 -2.24 -1.14 0.00 0.00 176.83 174.15 2dhj h ASP 92 N 0.38 -0.20 -5.27 3.07 3.04 -1.95 -3.49 116.42 112.00 2dhj h ASP 92 Ca 0.30 0.01 -0.13 0.00 -3.24 0.00 0.00 57.03 53.96 2dhj h ASP 92 Cb 0.64 0.05 -0.05 0.00 -1.04 0.00 0.00 39.33 38.94 2dhj h ASP 92 CO -0.08 0.20 0.01 0.00 -2.04 0.00 0.00 179.24 177.33 2dhj s GLU 94 N -2.96 2.45 0.28 0.00 2.12 -1.26 -0.69 118.70 118.63 2dhj s GLU 94 Ca 0.23 -1.34 -0.20 0.00 0.36 0.00 0.00 54.97 54.02 2dhj s GLU 94 Cb -0.02 -2.26 0.06 0.00 0.26 0.00 0.00 34.13 32.16 2dhj s GLU 94 CO 0.15 0.35 0.87 0.00 -0.54 0.00 0.00 175.26 176.09 2dhj s LEU 96 N -3.11 2.76 -0.13 0.00 1.43 0.10 -2.31 118.68 117.42 2dhj s LEU 96 Ca 0.16 -1.14 -0.13 0.00 -1.03 0.00 0.00 54.13 51.98 2dhj s LEU 96 Cb -0.04 -1.07 0.04 0.00 0.03 0.00 0.00 46.19 45.14 2dhj s LEU 96 CO 0.08 -0.18 0.38 -0.36 0.23 0.00 0.00 176.35 176.49 2dhj s PHE 97 N -2.58 -0.40 -0.02 0.29 0.08 -0.91 -2.40 117.98 112.03 2dhj s PHE 97 Ca 0.33 0.96 0.04 0.00 0.12 0.00 0.00 56.93 58.38 2dhj s PHE 97 Cb 0.01 0.14 -0.01 0.00 -0.57 0.00 0.00 43.02 42.60 2dhj s PHE 97 CO 0.17 -0.22 -0.14 -1.14 -0.10 0.00 0.00 175.22 173.79 2dhj s GLN 98 N 0.08 1.27 0.54 0.44 0.74 -1.21 -0.44 119.66 121.08 2dhj s GLN 98 Ca -0.01 -0.50 0.07 0.00 0.05 0.00 0.00 55.36 54.97 2dhj s GLN 98 Cb -0.03 -1.19 0.05 0.00 1.10 0.00 0.00 33.01 32.95 2dhj s GLN 98 CO 0.01 0.27 0.56 0.00 -0.55 0.00 0.00 175.29 175.58 2dhj s ALA 99 N -0.18 4.52 -0.01 1.58 0.00 0.86 -3.33 121.76 125.20 2dhj s ALA 99 Ca 0.02 -1.68 -0.03 0.00 0.00 0.00 0.00 51.96 50.28 2dhj s ALA 99 Cb -0.07 -1.06 -0.28 0.00 0.00 0.00 0.00 23.12 21.71 2dhj s ALA 99 CO 0.00 -0.59 0.80 0.93 0.00 0.00 0.00 175.76 176.90 2dhj h GLU 100 N 0.54 0.25 -3.97 0.00 5.08 -1.86 -3.44 114.58 111.18 2dhj h GLU 100 Ca -0.34 -0.43 -0.15 0.00 -1.00 0.00 0.00 59.36 57.44 2dhj h GLU 100 Cb 1.29 0.16 -0.19 0.00 0.50 0.00 0.00 28.75 30.51 2dhj h GLU 100 CO 0.50 1.11 -0.65 0.16 -1.00 0.00 0.00 179.01 179.13 2dhj s ASP 101 N -6.97 0.27 0.20 1.42 -4.77 -1.26 -5.00 116.67 100.57 2dhj s ASP 101 Ca -0.10 -0.60 -0.13 0.00 -3.30 0.00 0.00 52.55 48.41 2dhj s ASP 101 Cb 0.07 0.15 0.23 0.00 -1.09 0.00 0.00 42.92 42.29 2dhj s ASP 101 CO 0.85 -0.41 1.65 -0.09 0.70 0.00 0.00 175.17 177.86 2dhj h ARG 102 N 4.09 0.04 -0.74 2.11 2.43 -1.93 0.53 114.38 120.91 2dhj h ARG 102 Ca -0.32 -0.00 0.09 0.00 -0.81 0.00 0.00 59.98 58.94 2dhj h ARG 102 Cb 1.19 -0.01 -0.07 0.00 -0.42 0.00 0.00 29.97 30.66 2dhj h ARG 102 CO 0.49 0.03 0.39 -0.44 -1.51 0.00 0.00 179.97 178.93 2dhj h ASP 103 N 0.05 0.53 -0.52 -3.80 3.32 -2.00 -1.21 116.42 112.79 2dhj h ASP 103 Ca 0.29 0.06 -0.02 0.00 0.02 0.00 0.00 57.03 57.37 2dhj h ASP 103 Cb 0.46 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.94 2dhj h ASP 103 CO -0.56 0.30 0.23 -0.78 -1.72 0.00 0.00 179.24 176.72 2dhj h ASP 104 N 0.66 0.70 0.11 6.45 1.82 -1.37 -2.58 116.42 122.21 2dhj h ASP 104 Ca 0.36 -0.15 0.00 0.00 -0.39 0.00 0.00 57.03 56.86 2dhj h ASP 104 Cb 0.36 -0.18 -0.01 0.00 0.68 0.00 0.00 39.33 40.18 2dhj h ASP 104 CO -0.26 0.65 -0.11 -0.03 -1.61 0.00 0.00 179.24 177.89 2dhj h MET 105 N 0.70 -0.23 -0.91 0.28 4.05 -0.24 -2.44 114.93 116.15 2dhj h MET 105 Ca 0.18 0.02 0.15 0.00 -0.28 0.00 0.00 59.70 59.77 2dhj h MET 105 Cb 0.15 0.05 -0.10 0.00 -0.80 0.00 0.00 31.60 30.91 2dhj h MET 105 CO -0.02 -0.15 0.51 -0.07 0.23 0.00 0.00 176.91 177.41 2dhj h LEU 106 N -0.24 0.65 -0.67 3.39 -0.00 -1.15 -0.29 115.31 117.00 2dhj h LEU 106 Ca 0.00 0.09 0.03 0.00 -0.00 0.00 0.00 57.88 58.01 2dhj h LEU 106 Cb 0.23 -0.02 -0.04 0.00 -0.00 0.00 0.00 40.66 40.82 2dhj h LEU 106 CO -0.03 0.27 0.41 0.00 -0.00 0.00 0.00 178.44 179.09 2dhj h ALA 107 N 1.58 0.88 0.32 1.53 0.00 -1.04 -1.74 119.26 120.78 2dhj h ALA 107 Ca 0.50 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.38 2dhj h ALA 107 Cb 0.70 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2dhj h ALA 107 CO -0.36 0.16 -0.15 -1.49 0.00 0.00 0.00 179.25 177.41 2dhj h TRP 108 N 0.80 -0.40 -0.50 0.00 4.06 -0.71 0.51 115.95 119.71 2dhj h TRP 108 Ca 0.28 -0.01 0.10 0.00 2.06 0.00 0.00 58.89 61.31 2dhj h TRP 108 Cb 0.05 0.13 -0.10 0.00 -1.00 0.00 0.00 29.16 28.24 2dhj h TRP 108 CO -0.05 -0.10 -0.25 0.82 -3.56 0.00 0.00 178.44 175.30 2dhj h ILE 109 N -0.69 0.30 0.64 1.49 2.04 -1.10 0.84 117.51 121.04 2dhj h ILE 109 Ca -0.04 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.78 2dhj h ILE 109 Cb 0.48 0.30 0.01 0.00 -0.74 0.00 0.00 36.82 36.87 2dhj h ILE 109 CO 0.07 0.00 -0.31 0.50 0.00 0.00 0.00 178.15 178.41 2dhj h LYS 110 N -0.14 -0.83 -0.95 2.37 3.64 -1.32 0.20 116.57 119.55 2dhj h LYS 110 Ca 0.23 0.06 0.11 0.00 -1.27 0.00 0.00 60.65 59.77 2dhj h LYS 110 Cb 0.49 0.19 -0.13 0.00 -0.41 0.00 0.00 32.23 32.37 2dhj h LYS 110 CO -0.58 -0.55 -0.51 1.15 -2.27 0.00 0.00 179.45 176.68 2dhj h THR 111 N -1.05 0.01 0.57 1.00 2.02 -0.63 0.52 112.91 115.34 2dhj h THR 111 Ca -0.09 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.06 2dhj h THR 111 Cb 0.66 0.01 0.01 0.00 -1.74 0.00 0.00 68.15 67.08 2dhj h THR 111 CO 0.15 0.00 -0.27 0.40 0.37 0.00 0.00 175.52 176.16 2dhj h ILE 112 N -0.03 0.44 -1.02 3.11 2.04 -0.89 -2.33 117.51 118.83 2dhj h ILE 112 Ca 0.22 -0.02 0.28 0.00 1.00 0.00 0.00 64.86 66.34 2dhj h ILE 112 Cb 0.49 0.45 -0.06 0.00 -0.74 0.00 0.00 36.82 36.95 2dhj h ILE 112 CO -0.93 0.00 0.71 1.56 0.00 0.00 0.00 178.15 179.49 2dhj h GLN 113 N -0.78 0.15 -0.05 2.37 4.20 0.35 0.42 115.11 121.76 2dhj h GLN 113 Ca -0.08 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.61 2dhj h GLN 113 Cb 0.59 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.34 2dhj h GLN 113 CO 0.13 0.10 -0.02 0.93 -0.67 0.00 0.00 178.83 179.30 2dhj h GLU 114 N 0.16 0.10 -0.36 1.46 4.39 0.50 -0.00 114.58 120.82 2dhj h GLU 114 Ca 0.52 -0.04 0.01 0.00 0.34 0.00 0.00 59.36 60.18 2dhj h GLU 114 Cb 1.75 -0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 30.38 2dhj h GLU 114 CO -0.11 0.47 0.23 0.77 -1.16 0.00 0.00 179.01 179.21 2dhj h SER 115 N -0.27 0.39 0.05 1.42 0.02 -0.50 -3.03 113.55 111.64 2dhj h SER 115 Ca 0.01 -0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2dhj h SER 115 Cb 0.43 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.88 2dhj h SER 115 CO 0.01 0.28 -0.03 0.77 -1.14 0.00 0.00 176.83 176.72 2dhj h SER 116 N 0.47 -0.06 -2.91 3.07 4.64 -1.29 -3.41 113.55 114.06 2dhj h SER 116 Ca 0.13 -0.21 -0.57 0.00 -0.47 0.00 0.00 61.79 60.68 2dhj h SER 116 Cb -0.04 0.02 -0.03 0.00 -0.31 0.00 0.00 62.40 62.03 2dhj h SER 116 CO -0.04 0.18 1.06 0.20 -0.87 0.00 0.00 176.83 177.35 2dhj s ASN 117 N -5.35 6.53 0.15 4.97 0.01 -0.02 -4.01 114.94 117.22 2dhj s ASN 117 Ca -0.14 1.50 -0.17 0.00 -0.71 0.00 0.00 52.86 53.34 2dhj s ASN 117 Cb 0.04 -2.54 0.01 0.00 0.41 0.00 0.00 41.25 39.18 2dhj s ASN 117 CO 0.65 -1.15 1.80 -0.07 -1.51 0.00 0.00 177.10 176.82 2dhj h LEU 118 N 11.23 0.39 -8.83 0.60 4.07 -1.80 -3.40 115.31 117.57 2dhj h LEU 118 Ca -0.31 -0.00 -0.55 0.00 0.08 0.00 0.00 57.88 57.10 2dhj h LEU 118 Cb 1.13 -0.09 -0.00 0.00 1.08 0.00 0.00 40.66 42.78 2dhj h LEU 118 CO 1.01 0.28 1.49 0.54 -1.08 0.00 0.00 178.44 180.68 2dhj s ASN 119 N -5.51 5.24 -0.31 -0.43 4.22 -1.26 -4.84 114.94 112.06 2dhj s ASN 119 Ca -0.13 1.48 -0.02 0.00 -2.14 0.00 0.00 52.86 52.05 2dhj s ASN 119 Cb 0.11 -2.51 0.15 0.00 1.28 0.00 0.00 41.25 40.27 2dhj s ASN 119 CO 0.72 -2.19 2.23 -1.54 -2.04 0.00 0.00 177.10 174.28 2dhj n SER 120 N 12.66 6.34 0.00 3.54 3.41 -1.26 -4.92 113.62 133.38 2dhj n SER 120 Ca 0.30 -3.02 0.00 0.00 -0.26 0.00 0.00 58.87 55.89 2dhj n SER 120 Cb 0.48 -1.11 0.00 0.00 -0.26 0.00 0.00 64.21 63.32 2dhj n SER 120 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dhj n GLY 121 N 0.63 0.93 0.00 5.00 0.00 -1.26 -4.84 105.19 105.64 2dhj n GLY 121 Ca 0.32 -1.90 0.05 0.00 0.00 0.00 0.00 46.02 44.50 2dhj n GLY 121 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dhj n PRO 122 N -0.36 0.49 -1.10 1.61 -0.04 -1.26 -4.87 135.00 129.46 2dhj n PRO 122 Ca 0.00 0.00 -0.46 0.00 -0.04 0.00 0.00 63.50 63.00 2dhj n PRO 122 Cb 0.00 -1.35 -0.08 0.00 -0.04 0.00 0.00 33.50 32.03 2dhj n PRO 122 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2dhj n SER 123 N -0.85 0.73 0.11 3.54 3.41 -1.26 -4.82 113.62 114.48 2dhj n SER 123 Ca 0.08 0.71 -0.13 0.00 -0.26 0.00 0.00 58.87 59.27 2dhj n SER 123 Cb 0.04 -0.63 -0.08 0.00 -0.26 0.00 0.00 64.21 63.28 2dhj n SER 123 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 2dhj h SER 124 N 4.55 -0.24 -0.01 4.04 0.87 -2.04 -3.50 113.55 117.22 2dhj h SER 124 Ca -0.22 -0.22 0.00 0.00 -1.23 0.00 0.00 61.79 60.12 2dhj h SER 124 Cb 0.98 0.06 0.00 0.00 -0.44 0.00 0.00 62.40 63.00 2dhj h SER 124 CO 0.72 0.11 0.00 0.61 -0.53 0.00 0.00 176.83 177.74