#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 -1.57 -4.12 1.61 2.88 -1.26 -5.00 113.62 106.16 2dhj n SER 2 Ca 0.00 -0.79 -0.16 0.00 -1.33 0.00 0.00 58.87 56.58 2dhj n SER 2 Cb 0.00 -4.17 -0.12 0.00 -0.75 0.00 0.00 64.21 59.17 2dhj n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2dhj s SER 3 N -4.28 1.35 0.30 -3.46 0.15 -1.26 -4.92 113.70 101.57 2dhj s SER 3 Ca 0.06 -0.56 -0.12 0.00 0.70 0.00 0.00 55.95 56.03 2dhj s SER 3 Cb -0.03 -0.02 0.01 0.00 -1.71 0.00 0.00 66.02 64.27 2dhj s SER 3 CO 0.80 -0.11 0.55 -0.83 1.20 0.00 0.00 173.24 174.86 2dhj s GLY 4 N -1.58 0.68 -0.12 9.45 0.00 -1.26 -5.08 107.32 109.42 2dhj s GLY 4 Ca -0.04 -0.96 0.01 0.00 0.00 0.00 0.00 44.72 43.72 2dhj s GLY 4 CO 0.01 -0.62 -0.11 -1.14 0.00 0.00 0.00 173.10 171.25 2dhj n SER 5 N -0.80 3.02 -4.35 1.64 3.41 -1.26 -4.94 113.62 110.34 2dhj n SER 5 Ca -0.02 -0.06 -0.35 0.00 -0.26 0.00 0.00 58.87 58.18 2dhj n SER 5 Cb 0.61 -0.19 -0.14 0.00 -0.26 0.00 0.00 64.21 64.23 2dhj n SER 5 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2dhj s SER 6 N -5.19 4.46 -0.13 4.04 0.01 -1.26 -4.83 113.70 110.81 2dhj s SER 6 Ca -0.16 -0.34 -0.01 0.00 1.31 0.00 0.00 55.95 56.75 2dhj s SER 6 Cb 0.04 -1.77 0.00 0.00 0.21 0.00 0.00 66.02 64.50 2dhj s SER 6 CO 0.28 -0.00 0.03 0.61 0.41 0.00 0.00 173.24 174.56 2dhj n GLY 7 N 4.70 -3.15 3.56 3.44 0.00 -1.26 -4.82 105.19 107.66 2dhj n GLY 7 Ca -0.18 0.10 -0.22 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.79 4.66 -0.30 1.61 1.01 -1.26 -4.81 116.67 116.79 2dhj s ASP 8 Ca 0.01 -0.33 -0.10 0.00 0.71 0.00 0.00 52.55 52.84 2dhj s ASP 8 Cb -0.00 -2.55 0.16 0.00 1.01 0.00 0.00 42.92 41.54 2dhj s ASP 8 CO 0.32 -3.16 0.81 0.00 0.21 0.00 0.00 175.17 173.35 2dhj s ALA 9 N 11.86 -2.54 0.24 5.23 0.00 -1.26 -4.86 121.76 130.43 2dhj s ALA 9 Ca 0.79 1.98 0.03 0.00 0.00 0.00 0.00 51.96 54.76 2dhj s ALA 9 Cb -0.09 -2.08 0.64 0.00 0.00 0.00 0.00 23.12 21.58 2dhj s ALA 9 CO 0.04 -1.12 1.20 0.00 0.00 0.00 0.00 175.76 175.88 2dhj n ALA 10 N 5.30 0.44 -3.36 0.00 0.00 0.19 -4.60 120.51 118.47 2dhj n ALA 10 Ca -0.08 0.82 -0.10 0.00 0.00 0.00 0.00 53.44 54.08 2dhj n ALA 10 Cb 0.51 -0.62 -0.03 0.00 0.00 0.00 0.00 19.45 19.31 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 -5.63 1.34 -0.03 0.00 2.20 -1.15 -5.02 119.74 111.44 2dhj s LYS 11 Ca -0.10 -0.71 -0.30 0.00 -0.36 0.00 0.00 55.97 54.50 2dhj s LYS 11 Cb 0.23 0.55 0.07 0.00 -1.51 0.00 0.00 37.83 37.17 2dhj s LYS 11 CO 0.60 -0.58 0.70 -1.83 -0.36 0.00 0.00 175.35 173.88 2dhj s GLU 12 N -3.82 1.04 0.00 4.03 -1.05 -1.26 -0.38 118.70 117.26 2dhj s GLU 12 Ca 0.05 0.16 0.00 0.00 -0.15 0.00 0.00 54.97 55.04 2dhj s GLU 12 Cb -0.01 0.49 0.00 0.00 -0.44 0.00 0.00 34.13 34.17 2dhj s GLU 12 CO -0.07 -0.34 0.00 0.41 0.95 0.00 0.00 175.26 176.21 2dhj n GLY 13 N 0.73 2.85 3.63 -3.83 0.00 -1.05 -5.03 105.19 102.50 2dhj n GLY 13 Ca -0.18 -0.62 -0.43 0.00 0.00 0.00 0.00 46.02 44.79 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 1.98 0.03 1.61 0.52 -1.26 -2.34 118.94 117.48 2dhj s TRP 14 Ca 0.00 0.45 0.02 0.00 0.02 0.00 0.00 56.10 56.59 2dhj s TRP 14 Cb 0.00 -3.98 -0.02 0.00 -1.15 0.00 0.00 33.47 28.32 2dhj s TRP 14 CO 0.00 -3.27 -0.07 -0.51 0.02 0.00 0.00 176.95 173.11 2dhj s LEU 15 N 5.22 2.21 -0.45 2.99 1.43 -1.26 -4.66 118.68 124.17 2dhj s LEU 15 Ca 0.75 -0.46 -0.25 0.00 -1.03 0.00 0.00 54.13 53.14 2dhj s LEU 15 Cb -0.27 -0.18 0.02 0.00 0.03 0.00 0.00 46.19 45.79 2dhj s LEU 15 CO 0.30 -0.16 0.88 -1.00 0.23 0.00 0.00 176.35 176.61 2dhj s HIS 16 N -1.14 2.96 -0.28 0.29 3.76 -1.10 -3.21 115.29 116.57 2dhj s HIS 16 Ca -0.08 0.37 -0.16 0.00 -0.15 0.00 0.00 55.06 55.04 2dhj s HIS 16 Cb -0.08 -3.84 -0.03 0.00 1.11 0.00 0.00 32.58 29.74 2dhj s HIS 16 CO 0.00 -1.03 0.44 0.12 -0.85 0.00 0.00 174.74 173.42 2dhj s PHE 17 N 3.58 3.24 -0.31 1.40 5.36 0.20 -2.71 117.98 128.74 2dhj s PHE 17 Ca 0.35 0.46 -0.01 0.00 -0.96 0.00 0.00 56.93 56.77 2dhj s PHE 17 Cb -0.11 -2.67 0.10 0.00 -0.34 0.00 0.00 43.02 40.01 2dhj s PHE 17 CO 0.24 -0.29 0.10 0.50 -1.46 0.00 0.00 175.22 174.32 2dhj s ARG 18 N 2.19 0.71 0.58 10.12 3.52 -1.13 -2.41 118.95 132.53 2dhj s ARG 18 Ca 0.18 -1.08 -0.18 0.00 -0.13 0.00 0.00 55.73 54.51 2dhj s ARG 18 Cb -0.16 -1.97 -0.04 0.00 -1.56 0.00 0.00 34.95 31.22 2dhj s ARG 18 CO 0.10 -0.99 1.12 -1.25 -0.81 0.00 0.00 175.30 173.47 2dhj s PRO 19 N 1.60 3.17 -0.08 5.12 0.04 -1.26 -0.14 135.00 143.46 2dhj s PRO 19 Ca 0.10 1.54 -0.04 0.00 0.04 0.00 0.00 61.00 62.64 2dhj s PRO 19 Cb -0.17 -1.99 -0.01 0.00 0.04 0.00 0.00 34.50 32.37 2dhj s PRO 19 CO -0.25 -0.98 -0.07 -0.07 0.04 0.00 0.00 177.00 175.67 2dhj h LEU 20 N 0.82 0.00 -2.23 -3.56 -0.00 -1.72 -3.44 115.31 105.17 2dhj h LEU 20 Ca -0.49 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.39 2dhj h LEU 20 Cb 1.26 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.92 2dhj h LEU 20 CO 0.56 0.40 -0.02 0.55 -0.00 0.00 0.00 178.44 179.93 2dhj n VAL 21 N -3.67 0.65 -0.28 1.22 3.14 -1.26 -4.83 118.33 113.30 2dhj n VAL 21 Ca -0.03 -0.68 0.25 0.00 -2.96 0.00 0.00 64.34 60.92 2dhj n VAL 21 Cb 0.10 0.63 0.42 0.00 -1.06 0.00 0.00 33.84 33.94 2dhj n VAL 21 CO 0.00 0.00 0.00 1.07 -6.46 0.00 0.00 176.83 171.44 2dhj n THR 22 N -0.36 -0.19 -1.74 1.55 5.66 -1.26 -3.72 114.28 114.23 2dhj n THR 22 Ca 0.01 1.19 -0.21 0.00 -3.05 0.00 0.00 64.05 62.00 2dhj n THR 22 Cb 0.39 -1.95 -0.06 0.00 -1.55 0.00 0.00 70.33 67.16 2dhj n THR 22 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 2dhj s ASP 23 N -4.46 4.38 0.16 1.09 1.11 -1.26 -4.93 116.67 112.76 2dhj s ASP 23 Ca -0.05 -0.08 0.03 0.00 0.18 0.00 0.00 52.55 52.63 2dhj s ASP 23 Cb 0.20 -2.55 -0.04 0.00 1.07 0.00 0.00 42.92 41.61 2dhj s ASP 23 CO 0.52 -3.38 0.27 -0.75 1.18 0.00 0.00 175.17 173.00 2dhj s LYS 24 N 8.17 3.36 -1.27 8.23 2.20 -1.24 -4.47 119.74 134.72 2dhj s LYS 24 Ca 0.85 -0.65 -0.16 0.00 -0.36 0.00 0.00 55.97 55.65 2dhj s LYS 24 Cb -0.11 -2.91 0.16 0.00 -1.51 0.00 0.00 37.83 33.45 2dhj s LYS 24 CO 0.07 0.51 0.40 0.41 -0.36 0.00 0.00 175.35 176.39 2dhj n GLY 25 N -0.57 -0.29 0.08 5.54 0.00 -1.26 -4.71 105.19 103.98 2dhj n GLY 25 Ca -0.07 0.05 -0.07 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.97 0.76 -3.66 1.61 3.00 -1.26 -5.02 118.16 110.62 2dhj n LYS 26 Ca 0.08 -0.04 -0.25 0.00 -0.00 0.00 0.00 58.31 58.11 2dhj n LYS 26 Cb 0.33 -1.50 0.04 0.00 0.00 0.00 0.00 35.03 33.89 2dhj n LYS 26 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.40 175.27 2dhj n ARG 27 N -2.65 -3.02 -4.85 1.64 3.00 -1.26 -4.98 116.66 104.53 2dhj n ARG 27 Ca -0.28 0.57 -0.33 0.00 -0.00 0.00 0.00 57.85 57.82 2dhj n ARG 27 Cb 1.05 -4.81 -0.15 0.00 0.00 0.00 0.00 32.46 28.55 2dhj n ARG 27 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 2dhj s VAL 28 N -3.59 2.71 0.00 5.15 1.01 -1.26 -5.10 120.40 119.32 2dhj s VAL 28 Ca 0.24 -0.78 0.00 0.00 0.00 0.00 0.00 61.98 61.44 2dhj s VAL 28 Cb -0.07 -2.11 0.00 0.00 0.00 0.00 0.00 36.38 34.20 2dhj s VAL 28 CO 0.83 0.53 0.00 0.61 0.00 0.00 0.00 175.10 177.07 2dhj n GLY 29 N 3.62 -1.70 3.01 4.51 0.00 -1.26 -3.93 105.19 109.45 2dhj n GLY 29 Ca -0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.44 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 0.00 2.65 0.27 -0.02 0.00 -1.26 -4.61 105.19 102.23 2dhj n GLY 30 Ca 0.00 -1.19 0.13 0.00 0.00 0.00 0.00 46.02 44.96 2dhj n GLY 30 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2dhj h SER 31 N 7.63 0.00 -0.71 1.61 0.02 -2.02 -3.44 113.55 116.64 2dhj h SER 31 Ca 0.43 0.00 -0.60 0.00 -0.84 0.00 0.00 61.79 60.78 2dhj h SER 31 Cb 0.58 0.00 0.02 0.00 0.14 0.00 0.00 62.40 63.13 2dhj h SER 31 CO 1.87 0.08 0.32 -0.38 -1.14 0.00 0.00 176.83 177.58 2dhj n ILE 32 N -3.72 0.00 -4.02 3.27 5.41 -1.26 -4.94 119.36 114.10 2dhj n ILE 32 Ca -0.02 0.00 -0.13 0.00 1.00 0.00 0.00 62.75 63.60 2dhj n ILE 32 Cb 0.19 -0.22 -0.13 0.00 -0.71 0.00 0.00 39.64 38.77 2dhj n ILE 32 CO 0.00 0.00 0.00 -0.60 0.00 0.00 0.00 176.55 175.95 2dhj s ARG 33 N 1.30 0.30 0.69 0.38 3.52 -1.26 -5.15 118.95 118.73 2dhj s ARG 33 Ca 0.71 -0.31 -0.14 0.00 -0.13 0.00 0.00 55.73 55.86 2dhj s ARG 33 Cb -1.00 -0.18 0.02 0.00 -1.56 0.00 0.00 34.95 32.23 2dhj s ARG 33 CO 0.51 0.04 1.11 -1.25 -0.81 0.00 0.00 175.30 174.90 2dhj s PRO 34 N -0.59 2.65 0.80 5.12 0.04 -1.26 -4.96 135.00 136.80 2dhj s PRO 34 Ca -0.04 1.33 -0.17 0.00 0.04 0.00 0.00 61.00 62.16 2dhj s PRO 34 Cb -0.04 -1.94 -0.15 0.00 0.04 0.00 0.00 34.50 32.41 2dhj s PRO 34 CO -0.00 -1.36 -0.53 0.91 0.04 0.00 0.00 177.00 176.05 2dhj n TRP 35 N -2.72 -4.28 -3.96 0.56 7.02 -1.26 -4.96 117.44 107.83 2dhj n TRP 35 Ca 0.10 0.16 -0.30 0.00 -1.02 0.00 0.00 57.50 56.44 2dhj n TRP 35 Cb 0.52 -1.52 -0.16 0.00 -2.42 0.00 0.00 31.31 27.73 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 -1.59 1.85 -0.63 -0.99 1.02 -1.01 -4.98 119.74 113.41 2dhj s LYS 36 Ca 0.46 -0.71 -0.25 0.00 0.02 0.00 0.00 55.97 55.50 2dhj s LYS 36 Cb -0.30 -2.25 0.05 0.00 -0.52 0.00 0.00 37.83 34.80 2dhj s LYS 36 CO 0.76 -0.41 1.05 -1.14 -0.92 0.00 0.00 175.35 174.68 2dhj s GLN 37 N 1.48 3.25 -0.10 1.68 0.74 -1.26 -0.63 119.66 124.83 2dhj s GLN 37 Ca -0.00 -0.38 -0.04 0.00 0.05 0.00 0.00 55.36 54.99 2dhj s GLN 37 Cb -0.16 -4.13 0.05 0.00 1.10 0.00 0.00 33.01 29.87 2dhj s GLN 37 CO -0.08 -1.75 0.20 0.00 -0.55 0.00 0.00 175.29 173.11 2dhj s MET 38 N 4.47 0.11 -0.45 1.67 0.23 -1.20 -4.81 119.30 119.34 2dhj s MET 38 Ca 0.30 0.56 -0.43 0.00 -1.03 0.00 0.00 55.69 55.09 2dhj s MET 38 Cb -0.12 -0.16 -0.18 0.00 -1.53 0.00 0.00 34.83 32.84 2dhj s MET 38 CO 0.16 -0.24 1.90 0.98 -2.03 0.00 0.00 175.02 175.79 2dhj n TYR 39 N 4.84 1.56 -3.65 3.16 9.36 0.52 -4.12 117.16 128.83 2dhj n TYR 39 Ca -0.15 0.80 -0.38 0.00 3.32 0.00 0.00 57.90 61.50 2dhj n TYR 39 Cb 0.51 -2.33 -0.12 0.00 -0.63 0.00 0.00 39.34 36.78 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 4.74 4.81 -0.06 2.97 1.01 -0.99 0.34 120.40 133.23 2dhj s VAL 40 Ca 1.10 -0.13 0.03 0.00 0.00 0.00 0.00 61.98 62.98 2dhj s VAL 40 Cb -1.36 -3.35 -0.02 0.00 0.00 0.00 0.00 36.38 31.65 2dhj s VAL 40 CO 0.69 0.20 -0.14 -0.69 0.00 0.00 0.00 175.10 175.17 2dhj s VAL 41 N 1.67 3.09 -0.36 2.92 1.01 0.07 -2.53 120.40 126.27 2dhj s VAL 41 Ca 0.06 -0.70 -0.10 0.00 0.00 0.00 0.00 61.98 61.24 2dhj s VAL 41 Cb -0.16 -2.22 0.03 0.00 0.00 0.00 0.00 36.38 34.02 2dhj s VAL 41 CO 0.07 0.58 0.18 -0.22 0.00 0.00 0.00 175.10 175.72 2dhj s LEU 42 N -0.56 4.59 -0.34 3.92 2.96 0.49 -0.60 118.68 129.14 2dhj s LEU 42 Ca 0.08 -0.97 0.04 0.00 -0.22 0.00 0.00 54.13 53.05 2dhj s LEU 42 Cb -0.11 -1.99 0.10 0.00 0.50 0.00 0.00 46.19 44.68 2dhj s LEU 42 CO 0.01 -0.36 0.05 -0.13 -1.32 0.00 0.00 176.35 174.61 2dhj s ARG 43 N 1.53 1.46 4.63 1.98 0.52 -0.78 -0.64 118.95 127.65 2dhj s ARG 43 Ca 0.02 -1.84 0.00 0.00 -0.52 0.00 0.00 55.73 53.38 2dhj s ARG 43 Cb -0.19 -3.16 0.00 0.00 0.52 0.00 0.00 34.95 32.12 2dhj s ARG 43 CO 0.06 -0.94 0.00 0.41 0.02 0.00 0.00 175.30 174.85 2dhj n GLY 44 N 4.28 1.80 0.01 -3.53 0.00 -1.26 -2.73 105.19 103.76 2dhj n GLY 44 Ca 0.04 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.00 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 -4.77 1.61 1.44 -1.26 -4.81 115.22 107.43 2dhj n HIS 45 Ca 0.00 -0.36 -0.29 0.00 -2.01 0.00 0.00 57.72 55.06 2dhj n HIS 45 Cb 0.00 -0.04 -0.14 0.00 0.12 0.00 0.00 29.99 29.93 2dhj n HIS 45 CO 0.00 0.00 0.00 -1.12 -2.81 0.00 0.00 176.34 172.41 2dhj s SER 46 N -0.77 3.03 -0.35 4.39 0.01 -1.10 0.67 113.70 119.57 2dhj s SER 46 Ca 0.01 -0.60 -0.09 0.00 1.31 0.00 0.00 55.95 56.58 2dhj s SER 46 Cb 0.01 -0.26 0.03 0.00 0.21 0.00 0.00 66.02 66.01 2dhj s SER 46 CO 0.00 0.22 0.16 -0.76 0.41 0.00 0.00 173.24 173.28 2dhj s LEU 47 N -1.36 4.50 -0.40 2.44 1.43 -0.03 -1.87 118.68 123.39 2dhj s LEU 47 Ca 0.11 -0.99 -0.16 0.00 -1.03 0.00 0.00 54.13 52.07 2dhj s LEU 47 Cb -0.10 -1.97 0.02 0.00 0.03 0.00 0.00 46.19 44.17 2dhj s LEU 47 CO 0.03 -0.34 0.35 -0.31 0.23 0.00 0.00 176.35 176.30 2dhj s TYR 48 N 1.51 3.21 0.20 0.29 2.02 0.23 -3.33 117.35 121.48 2dhj s TYR 48 Ca 0.01 -0.45 -0.01 0.00 -0.37 0.00 0.00 57.07 56.26 2dhj s TYR 48 Cb -0.19 -2.70 -0.04 0.00 -0.40 0.00 0.00 41.96 38.63 2dhj s TYR 48 CO 0.05 -0.60 0.39 -0.51 -1.57 0.00 0.00 175.55 173.31 2dhj s LEU 49 N 1.87 4.23 -0.09 -1.29 1.02 -1.26 -0.75 118.68 122.41 2dhj s LEU 49 Ca 0.08 0.40 -0.12 0.00 0.02 0.00 0.00 54.13 54.51 2dhj s LEU 49 Cb -0.18 -3.17 0.03 0.00 0.02 0.00 0.00 46.19 42.89 2dhj s LEU 49 CO 0.11 -0.04 0.32 -0.31 0.02 0.00 0.00 176.35 176.45 2dhj s TYR 50 N -1.86 -0.30 0.11 0.29 2.02 0.15 -3.93 117.35 113.84 2dhj s TYR 50 Ca 0.38 0.68 -0.11 0.00 -0.37 0.00 0.00 57.07 57.65 2dhj s TYR 50 Cb -0.11 0.11 -0.12 0.00 -0.40 0.00 0.00 41.96 41.44 2dhj s TYR 50 CO 0.29 -0.24 1.32 0.87 -1.57 0.00 0.00 175.55 176.23 2dhj h LYS 51 N 5.10 0.74 -4.28 -0.62 1.57 -1.87 1.52 116.57 118.73 2dhj h LYS 51 Ca -0.27 -0.61 -0.61 0.00 -1.87 0.00 0.00 60.65 57.29 2dhj h LYS 51 Cb 1.18 0.13 -0.39 0.00 0.08 0.00 0.00 32.23 33.24 2dhj h LYS 51 CO 0.33 1.22 -0.77 -0.51 -0.57 0.00 0.00 179.45 179.14 2dhj s ASP 52 N -7.10 3.98 0.27 0.86 1.01 -1.26 -4.55 116.67 109.88 2dhj s ASP 52 Ca -0.10 -1.36 -0.04 0.00 0.71 0.00 0.00 52.55 51.76 2dhj s ASP 52 Cb 0.09 -1.19 0.53 0.00 1.01 0.00 0.00 42.92 43.36 2dhj s ASP 52 CO 0.90 -0.28 1.44 1.17 0.21 0.00 0.00 175.17 178.61 2dhj n LYS 53 N 4.64 -0.08 -1.73 8.23 4.81 -1.26 -4.34 118.16 128.43 2dhj n LYS 53 Ca -0.08 1.42 -0.42 0.00 -0.87 0.00 0.00 58.31 58.35 2dhj n LYS 53 Cb 0.44 -2.16 -0.02 0.00 0.02 0.00 0.00 35.03 33.30 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 -5.45 2.78 -2.92 1.64 1.74 -1.26 -2.73 116.66 110.45 2dhj n ARG 54 Ca 0.17 1.00 -0.11 0.00 -0.77 0.00 0.00 57.85 58.14 2dhj n ARG 54 Cb 0.55 -2.82 0.06 0.00 -1.02 0.00 0.00 32.46 29.23 2dhj n ARG 54 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2dhj n GLU 55 N 3.19 -4.26 -0.82 5.56 1.02 -1.26 -4.93 120.64 119.14 2dhj n GLU 55 Ca 0.13 0.55 0.04 0.00 -0.02 0.00 0.00 57.16 57.85 2dhj n GLU 55 Cb 0.36 -4.66 0.35 0.00 -0.02 0.00 0.00 31.44 27.46 2dhj n GLU 55 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2dhj n GLN 56 N -3.01 4.30 0.13 3.49 10.64 -1.11 -4.58 117.38 127.23 2dhj n GLN 56 Ca -0.18 -2.78 -0.15 0.00 -1.83 0.00 0.00 57.00 52.06 2dhj n GLN 56 Cb 0.61 -2.17 -0.08 0.00 -0.86 0.00 0.00 30.24 27.74 2dhj n GLN 56 CO 0.00 0.00 0.00 1.79 -1.83 0.00 0.00 177.06 177.02 2dhj h THR 57 N 3.34 0.15 -4.28 -0.39 1.35 -1.91 -3.42 112.91 107.75 2dhj h THR 57 Ca 0.04 0.00 -0.50 0.00 -0.55 0.00 0.00 66.41 65.40 2dhj h THR 57 Cb 1.88 0.15 0.08 0.00 -1.73 0.00 0.00 68.15 68.52 2dhj h THR 57 CO 0.48 0.00 0.38 0.42 -0.25 0.00 0.00 175.52 176.54 2dhj s THR 58 N -5.91 4.04 1.16 6.82 -4.23 -1.26 -5.05 115.64 111.21 2dhj s THR 58 Ca -0.16 0.78 -0.18 0.00 -1.18 0.00 0.00 61.69 60.95 2dhj s THR 58 Cb 0.07 -3.45 0.27 0.00 1.34 0.00 0.00 72.50 70.73 2dhj s THR 58 CO 0.63 -0.75 1.11 -2.16 -0.54 0.00 0.00 174.62 172.91 2dhj s PRO 59 N -4.66 -0.87 -0.43 3.99 0.04 -1.26 -4.76 135.00 127.05 2dhj s PRO 59 Ca 0.60 0.06 -0.30 0.00 0.04 0.00 0.00 61.00 61.40 2dhj s PRO 59 Cb -0.14 -1.63 -0.14 0.00 0.04 0.00 0.00 34.50 32.63 2dhj s PRO 59 CO 0.47 -3.51 1.61 0.43 0.04 0.00 0.00 177.00 176.05 2dhj n SER 60 N -4.64 0.47 0.00 6.66 7.64 -1.25 -4.79 113.62 117.71 2dhj n SER 60 Ca 0.11 0.41 0.00 0.00 1.01 0.00 0.00 58.87 60.41 2dhj n SER 60 Cb 0.59 -0.65 0.00 0.00 -1.01 0.00 0.00 64.21 63.14 2dhj n SER 60 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2dhj n GLU 61 N 5.51 0.00 -0.10 1.43 1.02 -1.26 -4.11 120.64 123.13 2dhj n GLU 61 Ca 0.41 0.91 -0.17 0.00 -0.02 0.00 0.00 57.16 58.30 2dhj n GLU 61 Cb -0.02 -1.45 -0.06 0.00 -0.02 0.00 0.00 31.44 29.89 2dhj n GLU 61 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2dhj n GLU 62 N -2.72 0.54 -0.45 3.49 -0.58 -1.26 -4.99 120.64 114.66 2dhj n GLU 62 Ca 0.00 0.37 -0.25 0.00 -0.42 0.00 0.00 57.16 56.86 2dhj n GLU 62 Cb 0.00 -1.57 0.21 0.00 -0.57 0.00 0.00 31.44 29.51 2dhj n GLU 62 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2dhj n GLU 63 N -4.43 -3.02 -4.34 3.49 4.71 -1.26 -5.04 120.64 110.75 2dhj n GLU 63 Ca -0.28 -0.89 -0.24 0.00 -0.01 0.00 0.00 57.16 55.74 2dhj n GLU 63 Cb 0.60 -1.73 -0.12 0.00 -1.01 0.00 0.00 31.44 29.19 2dhj n GLU 63 CO 0.00 0.00 0.00 1.14 0.09 0.00 0.00 177.13 178.36 2dhj s GLN 64 N -4.06 1.28 0.41 3.49 -2.07 -1.26 -4.57 119.66 112.88 2dhj s GLN 64 Ca 0.53 -1.34 -0.25 0.00 -1.82 0.00 0.00 55.36 52.48 2dhj s GLN 64 Cb -0.11 -1.52 -0.08 0.00 -1.09 0.00 0.00 33.01 30.21 2dhj s GLN 64 CO 0.50 0.34 1.18 -1.25 -1.32 0.00 0.00 175.29 174.74 2dhj s PRO 65 N -2.38 3.98 -0.13 9.60 0.04 -1.26 -4.94 135.00 139.92 2dhj s PRO 65 Ca 0.13 1.86 -0.01 0.00 0.04 0.00 0.00 61.00 63.02 2dhj s PRO 65 Cb -0.08 -2.63 -0.02 0.00 0.04 0.00 0.00 34.50 31.80 2dhj s PRO 65 CO 0.06 -0.39 -0.09 0.42 0.04 0.00 0.00 177.00 177.05 2dhj s ILE 66 N -1.42 3.45 -0.46 0.56 1.01 -1.21 -4.92 121.20 118.20 2dhj s ILE 66 Ca 0.58 -0.52 -0.25 0.00 0.00 0.00 0.00 60.65 60.46 2dhj s ILE 66 Cb -0.31 -2.47 0.03 0.00 0.01 0.00 0.00 42.46 39.72 2dhj s ILE 66 CO 0.39 0.52 0.92 -0.94 0.00 0.00 0.00 174.94 175.84 2dhj s SER 67 N 0.20 6.49 0.37 3.58 1.04 -1.26 -0.85 113.70 123.27 2dhj s SER 67 Ca -0.05 0.10 0.20 0.00 0.48 0.00 0.00 55.95 56.68 2dhj s SER 67 Cb -0.15 -2.45 0.41 0.00 0.10 0.00 0.00 66.02 63.94 2dhj s SER 67 CO 0.04 -1.06 1.61 -0.37 0.98 0.00 0.00 173.24 174.44 2dhj h VAL 68 N 6.08 0.55 -0.33 5.02 -1.51 -0.12 -3.37 116.25 122.56 2dhj h VAL 68 Ca -0.24 -1.57 -0.60 0.00 -1.23 0.00 0.00 66.70 63.06 2dhj h VAL 68 Cb 1.08 2.11 -0.01 0.00 -2.13 0.00 0.00 31.29 32.33 2dhj h VAL 68 CO 1.03 0.29 0.75 -3.20 -1.23 0.00 0.00 177.57 175.20 2dhj n ASN 69 N -3.24 0.70 -2.59 4.19 5.15 -1.18 0.91 115.26 119.21 2dhj n ASN 69 Ca 0.02 0.66 -0.13 0.00 -0.60 0.00 0.00 54.58 54.53 2dhj n ASN 69 Cb 0.59 -0.65 0.06 0.00 -0.53 0.00 0.00 39.78 39.25 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 4.28 -1.15 -1.97 5.20 0.00 -1.26 -4.68 120.51 120.95 2dhj n ALA 70 Ca 0.32 0.09 -0.22 0.00 0.00 0.00 0.00 53.44 53.63 2dhj n ALA 70 Cb -0.04 -2.62 0.05 0.00 0.00 0.00 0.00 19.45 16.84 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 -4.88 3.24 0.11 0.00 1.43 0.04 -4.95 118.68 113.68 2dhj s LEU 72 Ca 0.58 -1.70 -0.12 0.00 -1.03 0.00 0.00 54.13 51.86 2dhj s LEU 72 Cb -0.10 -1.22 -0.06 0.00 0.03 0.00 0.00 46.19 44.83 2dhj s LEU 72 CO 0.40 -0.36 0.47 -0.63 0.23 0.00 0.00 176.35 176.46 2dhj s ILE 73 N 1.30 4.99 -0.29 -0.59 1.01 -1.26 -1.23 121.20 125.12 2dhj s ILE 73 Ca 0.06 0.62 -0.14 0.00 0.00 0.00 0.00 60.65 61.18 2dhj s ILE 73 Cb -0.18 -3.68 0.12 0.00 0.01 0.00 0.00 42.46 38.72 2dhj s ILE 73 CO -0.14 0.26 0.78 -1.81 0.00 0.00 0.00 174.94 174.03 2dhj s ASP 74 N -1.76 -0.86 -0.59 3.58 1.01 0.19 -4.99 116.67 113.25 2dhj s ASP 74 Ca 0.36 1.29 -0.34 0.00 0.71 0.00 0.00 52.55 54.56 2dhj s ASP 74 Cb -0.14 1.64 -0.15 0.00 1.01 0.00 0.00 42.92 45.27 2dhj s ASP 74 CO 0.19 -0.19 2.37 -0.38 0.21 0.00 0.00 175.17 177.36 2dhj n ILE 75 N 4.59 0.05 -0.90 0.77 5.41 -1.26 0.26 119.36 128.27 2dhj n ILE 75 Ca -0.16 -0.23 -0.29 0.00 1.00 0.00 0.00 62.75 63.07 2dhj n ILE 75 Cb 0.55 -1.29 -0.00 0.00 -0.71 0.00 0.00 39.64 38.19 2dhj n ILE 75 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 2dhj n SER 76 N 10.62 -1.88 -3.28 4.38 3.41 -0.84 -4.74 113.62 121.29 2dhj n SER 76 Ca 0.50 0.58 -0.11 0.00 -0.26 0.00 0.00 58.87 59.59 2dhj n SER 76 Cb 0.17 -0.61 0.10 0.00 -0.26 0.00 0.00 64.21 63.61 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 -0.64 -2.10 0.10 7.33 0.18 -1.26 -4.91 117.16 115.86 2dhj n TYR 77 Ca 0.08 -0.10 -0.15 0.00 1.88 0.00 0.00 57.90 59.61 2dhj n TYR 77 Cb 0.27 -0.81 -0.14 0.00 -0.38 0.00 0.00 39.34 38.29 2dhj n TYR 77 CO 0.00 0.00 0.00 1.03 -2.08 0.00 0.00 176.86 175.81 2dhj h SER 78 N -2.41 0.39 -0.98 9.48 0.87 -2.00 -3.31 113.55 115.58 2dhj h SER 78 Ca -0.14 -0.42 0.29 0.00 -1.23 0.00 0.00 61.79 60.30 2dhj h SER 78 Cb 0.47 -0.13 -0.18 0.00 -0.44 0.00 0.00 62.40 62.12 2dhj h SER 78 CO 0.08 1.32 0.11 -0.33 -0.53 0.00 0.00 176.83 177.49 2dhj h GLU 79 N 0.07 0.02 -5.21 2.24 4.39 -1.98 -3.37 114.58 110.73 2dhj h GLU 79 Ca -0.12 -0.00 -0.44 0.00 0.34 0.00 0.00 59.36 59.14 2dhj h GLU 79 Cb 1.94 -0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 30.53 2dhj h GLU 79 CO 0.20 0.01 1.64 0.25 -1.16 0.00 0.00 179.01 179.94 2dhj n THR 80 N -5.44 -0.03 -0.22 1.13 -2.24 -1.25 -4.77 114.28 101.46 2dhj n THR 80 Ca 0.25 -0.34 0.02 0.00 -2.27 0.00 0.00 64.05 61.72 2dhj n THR 80 Cb 0.83 -1.25 0.12 0.00 -2.10 0.00 0.00 70.33 67.93 2dhj n THR 80 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 2dhj h LYS 81 N 14.29 0.15 -7.22 -0.78 6.56 -1.94 -3.41 116.57 124.22 2dhj h LYS 81 Ca -0.09 -0.01 -0.49 0.00 -1.06 0.00 0.00 60.65 59.00 2dhj h LYS 81 Cb 1.26 -0.03 0.20 0.00 -0.57 0.00 0.00 32.23 33.08 2dhj h LYS 81 CO 1.32 0.10 0.14 1.03 -2.06 0.00 0.00 179.45 179.98 2dhj s ARG 82 N -6.12 0.26 0.46 3.15 0.52 -1.26 -5.04 118.95 110.92 2dhj s ARG 82 Ca -0.13 1.28 0.07 0.00 -0.52 0.00 0.00 55.73 56.43 2dhj s ARG 82 Cb 0.20 -1.66 -0.00 0.00 0.52 0.00 0.00 34.95 34.00 2dhj s ARG 82 CO 0.74 -3.06 0.37 0.15 0.02 0.00 0.00 175.30 173.52 2dhj s LYS 83 N -4.57 2.38 -1.38 3.54 3.01 -1.26 -4.69 119.74 116.75 2dhj s LYS 83 Ca 0.67 -1.76 -0.03 0.00 -1.01 0.00 0.00 55.97 53.85 2dhj s LYS 83 Cb -0.24 -2.22 0.00 0.00 -1.01 0.00 0.00 37.83 34.36 2dhj s LYS 83 CO 0.61 -0.35 0.43 0.27 0.51 0.00 0.00 175.35 176.82 2dhj n ASN 84 N -1.59 -0.77 -4.23 2.83 0.23 -1.26 -4.55 115.26 105.91 2dhj n ASN 84 Ca 0.01 -1.03 -0.33 0.00 -0.53 0.00 0.00 54.58 52.70 2dhj n ASN 84 Cb 0.63 -2.95 -0.15 0.00 -2.08 0.00 0.00 39.78 35.22 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 -3.93 2.53 -0.09 3.53 1.01 -1.26 -1.73 120.40 120.45 2dhj s VAL 85 Ca 0.06 -0.81 0.03 0.00 0.00 0.00 0.00 61.98 61.25 2dhj s VAL 85 Cb -0.02 -2.06 -0.01 0.00 0.00 0.00 0.00 36.38 34.28 2dhj s VAL 85 CO 0.90 0.52 -0.19 0.72 0.00 0.00 0.00 175.10 177.04 2dhj s PHE 86 N 0.91 2.64 -0.19 5.22 -0.71 -0.57 -1.98 117.98 123.30 2dhj s PHE 86 Ca -0.04 -0.72 -0.21 0.00 -1.04 0.00 0.00 56.93 54.92 2dhj s PHE 86 Cb -0.15 -1.72 -0.02 0.00 -1.21 0.00 0.00 43.02 39.91 2dhj s PHE 86 CO -0.02 -0.22 0.65 0.50 -1.34 0.00 0.00 175.22 174.79 2dhj s ARG 87 N 0.10 4.22 -0.11 1.99 3.52 0.14 -2.52 118.95 126.29 2dhj s ARG 87 Ca -0.09 0.66 0.03 0.00 -0.13 0.00 0.00 55.73 56.21 2dhj s ARG 87 Cb -0.15 -3.58 0.00 0.00 -1.56 0.00 0.00 34.95 29.67 2dhj s ARG 87 CO 0.06 -0.24 -0.23 -1.17 -0.81 0.00 0.00 175.30 172.90 2dhj s LEU 88 N 1.92 2.08 -0.19 -0.88 0.20 -0.96 0.53 118.68 121.37 2dhj s LEU 88 Ca 0.30 -0.56 -0.02 0.00 0.69 0.00 0.00 54.13 54.53 2dhj s LEU 88 Cb -0.16 -1.40 -0.01 0.00 -0.43 0.00 0.00 46.19 44.20 2dhj s LEU 88 CO 0.11 0.13 -0.08 -0.89 -0.29 0.00 0.00 176.35 175.32 2dhj s THR 89 N 0.52 3.16 0.06 3.68 2.01 -0.37 -2.35 115.64 122.35 2dhj s THR 89 Ca -0.15 -0.58 0.04 0.00 0.31 0.00 0.00 61.69 61.31 2dhj s THR 89 Cb -0.17 -2.40 -0.04 0.00 0.01 0.00 0.00 72.50 69.91 2dhj s THR 89 CO 0.05 0.47 -0.01 0.42 -0.69 0.00 0.00 174.62 174.86 2dhj s THR 90 N 1.07 4.01 0.58 -0.82 -4.23 -0.44 -0.78 115.64 115.04 2dhj s THR 90 Ca 0.00 -0.87 0.34 0.00 -1.18 0.00 0.00 61.69 59.99 2dhj s THR 90 Cb -0.15 -2.86 0.50 0.00 1.34 0.00 0.00 72.50 71.33 2dhj s THR 90 CO -0.01 0.21 1.56 -1.28 -0.54 0.00 0.00 174.62 174.56 2dhj h SER 91 N 3.78 0.00 0.00 3.99 0.87 -1.82 -2.26 113.55 118.12 2dhj h SER 91 Ca -0.48 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.08 2dhj h SER 91 Cb 1.17 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.13 2dhj h SER 91 CO 0.58 0.00 0.00 -0.67 -0.53 0.00 0.00 176.83 176.21 2dhj n ASP 92 N -3.64 0.00 -3.44 6.23 2.03 -1.26 -5.06 116.55 111.41 2dhj n ASP 92 Ca 0.26 0.36 -0.17 0.00 0.52 0.00 0.00 54.79 55.76 2dhj n ASP 92 Cb 1.45 -0.37 -0.07 0.00 -0.72 0.00 0.00 41.12 41.41 2dhj n ASP 92 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2dhj s GLU 94 N -3.42 2.62 0.09 0.00 2.12 -1.26 -1.32 118.70 117.53 2dhj s GLU 94 Ca 0.37 -1.00 -0.26 0.00 0.36 0.00 0.00 54.97 54.44 2dhj s GLU 94 Cb 0.02 -2.48 0.08 0.00 0.26 0.00 0.00 34.13 32.00 2dhj s GLU 94 CO 0.23 0.47 0.83 0.00 -0.54 0.00 0.00 175.26 176.25 2dhj s LEU 96 N -2.70 3.27 -0.18 0.00 1.43 0.80 -2.27 118.68 119.04 2dhj s LEU 96 Ca 0.07 -0.83 -0.13 0.00 -1.03 0.00 0.00 54.13 52.21 2dhj s LEU 96 Cb -0.02 -1.90 0.05 0.00 0.03 0.00 0.00 46.19 44.36 2dhj s LEU 96 CO -0.05 -0.75 0.45 -0.36 0.23 0.00 0.00 176.35 175.86 2dhj s PHE 97 N -2.53 -0.59 -0.05 0.29 0.08 -1.05 -2.84 117.98 111.30 2dhj s PHE 97 Ca 0.47 1.32 0.06 0.00 0.12 0.00 0.00 56.93 58.89 2dhj s PHE 97 Cb -0.03 0.25 -0.01 0.00 -0.57 0.00 0.00 43.02 42.66 2dhj s PHE 97 CO 0.27 -0.31 -0.23 -1.14 -0.10 0.00 0.00 175.22 173.71 2dhj s GLN 98 N 0.89 2.33 0.47 0.44 0.74 -1.10 -1.50 119.66 121.93 2dhj s GLN 98 Ca -0.05 -0.84 0.08 0.00 0.05 0.00 0.00 55.36 54.60 2dhj s GLN 98 Cb -0.06 -2.00 0.02 0.00 1.10 0.00 0.00 33.01 32.07 2dhj s GLN 98 CO -0.07 0.36 0.50 0.00 -0.55 0.00 0.00 175.29 175.53 2dhj s ALA 99 N -0.15 4.35 0.05 1.58 0.00 -0.71 -2.70 121.76 124.19 2dhj s ALA 99 Ca -0.03 -1.78 -0.16 0.00 0.00 0.00 0.00 51.96 49.99 2dhj s ALA 99 Cb -0.13 -1.16 -0.24 0.00 0.00 0.00 0.00 23.12 21.59 2dhj s ALA 99 CO 0.03 -0.41 1.15 0.93 0.00 0.00 0.00 175.76 177.46 2dhj h GLU 100 N 0.73 0.60 -4.16 0.00 5.08 -1.90 -3.46 114.58 111.48 2dhj h GLU 100 Ca -0.38 -0.67 -0.18 0.00 -1.00 0.00 0.00 59.36 57.13 2dhj h GLU 100 Cb 1.28 0.20 -0.19 0.00 0.50 0.00 0.00 28.75 30.53 2dhj h GLU 100 CO 0.52 1.27 -0.70 0.34 -1.00 0.00 0.00 179.01 179.44 2dhj s ASP 101 N -7.14 0.43 0.06 1.42 2.15 -1.26 -5.05 116.67 107.28 2dhj s ASP 101 Ca -0.11 -0.64 -0.15 0.00 0.43 0.00 0.00 52.55 52.08 2dhj s ASP 101 Cb 0.06 0.11 -0.05 0.00 -0.30 0.00 0.00 42.92 42.74 2dhj s ASP 101 CO 0.89 -0.36 1.25 -0.09 -0.17 0.00 0.00 175.17 176.69 2dhj h ARG 102 N 4.21 -0.15 -1.00 4.34 2.43 -1.93 0.15 114.38 122.43 2dhj h ARG 102 Ca -0.33 0.01 0.39 0.00 -0.81 0.00 0.00 59.98 59.24 2dhj h ARG 102 Cb 1.19 0.03 -0.17 0.00 -0.42 0.00 0.00 29.97 30.60 2dhj h ARG 102 CO 0.48 -0.10 0.49 0.22 -1.51 0.00 0.00 179.97 179.55 2dhj h ASP 103 N -0.15 0.27 -0.13 -3.80 3.58 -2.00 0.65 116.42 114.84 2dhj h ASP 103 Ca 0.04 0.25 -0.01 0.00 0.42 0.00 0.00 57.03 57.73 2dhj h ASP 103 Cb 0.26 0.27 -0.01 0.00 1.72 0.00 0.00 39.33 41.57 2dhj h ASP 103 CO -0.30 -0.38 0.04 -0.78 -2.88 0.00 0.00 179.24 174.94 2dhj h ASP 104 N 0.05 0.19 -0.31 2.28 1.82 -1.18 -2.70 116.42 116.58 2dhj h ASP 104 Ca 0.80 -0.21 0.06 0.00 -0.39 0.00 0.00 57.03 57.30 2dhj h ASP 104 Cb 2.05 -0.05 -0.06 0.00 0.68 0.00 0.00 39.33 41.95 2dhj h ASP 104 CO -0.76 0.35 -0.06 -0.03 -1.61 0.00 0.00 179.24 177.13 2dhj h MET 105 N 0.03 0.02 -0.71 0.28 4.05 0.16 -1.80 114.93 116.96 2dhj h MET 105 Ca 0.04 -0.00 0.11 0.00 -0.28 0.00 0.00 59.70 59.57 2dhj h MET 105 Cb 0.23 -0.00 -0.08 0.00 -0.80 0.00 0.00 31.60 30.94 2dhj h MET 105 CO -0.00 0.01 0.32 -0.07 0.23 0.00 0.00 176.91 177.39 2dhj h LEU 106 N 0.02 0.36 0.02 3.39 -0.00 -1.26 -2.89 115.31 114.94 2dhj h LEU 106 Ca 0.15 0.08 0.00 0.00 -0.00 0.00 0.00 57.88 58.11 2dhj h LEU 106 Cb 0.22 0.03 -0.01 0.00 -0.00 0.00 0.00 40.66 40.91 2dhj h LEU 106 CO -0.30 0.19 -0.06 0.00 -0.00 0.00 0.00 178.44 178.26 2dhj h ALA 107 N 1.47 -0.64 -0.83 1.53 0.00 -1.00 -2.75 119.26 117.06 2dhj h ALA 107 Ca 0.37 -0.01 0.10 0.00 0.00 0.00 0.00 54.91 55.36 2dhj h ALA 107 Cb 0.46 0.47 -0.12 0.00 0.00 0.00 0.00 17.79 18.61 2dhj h ALA 107 CO -0.32 -0.65 -0.41 0.91 0.00 0.00 0.00 179.25 178.78 2dhj n TRP 108 N -2.78 -0.18 -0.36 0.00 7.02 -1.08 -0.21 117.44 119.86 2dhj n TRP 108 Ca -0.01 1.02 -0.09 0.00 -1.02 0.00 0.00 57.50 57.41 2dhj n TRP 108 Cb 0.05 -0.68 -0.06 0.00 -2.42 0.00 0.00 31.31 28.20 2dhj n TRP 108 CO 0.00 0.00 0.00 0.82 -2.02 0.00 0.00 177.69 176.49 2dhj h ILE 109 N 0.00 0.01 0.04 -0.99 2.04 -1.30 0.63 117.51 117.93 2dhj h ILE 109 Ca 0.21 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 66.07 2dhj h ILE 109 Cb 0.41 0.01 -0.00 0.00 -0.74 0.00 0.00 36.82 36.50 2dhj h ILE 109 CO -0.80 0.00 -0.05 0.50 0.00 0.00 0.00 178.15 177.80 2dhj h LYS 110 N -0.07 -0.09 -0.64 2.37 3.64 -0.30 0.27 116.57 121.75 2dhj h LYS 110 Ca 0.19 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.64 2dhj h LYS 110 Cb 0.49 0.02 -0.08 0.00 -0.41 0.00 0.00 32.23 32.25 2dhj h LYS 110 CO -0.89 -0.06 -0.38 2.41 -2.27 0.00 0.00 179.45 178.27 2dhj n THR 111 N -2.61 -0.43 0.14 1.00 -1.04 -0.82 0.04 114.28 110.55 2dhj n THR 111 Ca -0.01 1.91 -0.15 0.00 -2.04 0.00 0.00 64.05 63.76 2dhj n THR 111 Cb 0.04 -2.40 -0.08 0.00 -1.82 0.00 0.00 70.33 66.08 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 0.16 -1.01 12.58 2.04 -0.84 -1.39 117.51 129.05 2dhj h ILE 112 Ca 0.10 0.00 0.28 0.00 1.00 0.00 0.00 64.86 66.24 2dhj h ILE 112 Cb 0.26 0.16 -0.13 0.00 -0.74 0.00 0.00 36.82 36.36 2dhj h ILE 112 CO -0.60 0.00 0.59 1.56 0.00 0.00 0.00 178.15 179.70 2dhj h GLN 113 N -0.68 0.46 -0.16 2.37 4.20 0.13 0.17 115.11 121.60 2dhj h GLN 113 Ca 0.01 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.69 2dhj h GLN 113 Cb 0.69 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.36 2dhj h GLN 113 CO -0.22 0.31 0.07 0.93 -0.67 0.00 0.00 178.83 179.25 2dhj h GLU 114 N 0.48 0.23 -0.10 1.46 5.08 0.66 -2.91 114.58 119.48 2dhj h GLU 114 Ca 0.68 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 59.00 2dhj h GLU 114 Cb 1.41 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 30.62 2dhj h GLU 114 CO -0.53 0.29 0.04 0.77 -1.00 0.00 0.00 179.01 178.59 2dhj h SER 115 N 0.12 0.14 -0.69 1.42 0.02 0.00 -3.01 113.55 111.56 2dhj h SER 115 Ca 0.05 -0.16 -0.38 0.00 -0.84 0.00 0.00 61.79 60.46 2dhj h SER 115 Cb 0.14 -0.04 -0.14 0.00 0.14 0.00 0.00 62.40 62.50 2dhj h SER 115 CO -0.01 0.27 0.19 -1.20 -1.14 0.00 0.00 176.83 174.93 2dhj n SER 116 N -4.92 6.13 -4.24 3.07 7.64 0.15 -4.87 113.62 116.59 2dhj n SER 116 Ca -0.06 -2.98 -0.33 0.00 1.01 0.00 0.00 58.87 56.52 2dhj n SER 116 Cb 0.11 -1.26 -0.16 0.00 -1.01 0.00 0.00 64.21 61.90 2dhj n SER 116 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 2dhj s ASN 117 N 0.80 3.38 0.21 6.43 3.84 -1.10 -4.07 114.94 124.42 2dhj s ASN 117 Ca 0.56 -0.52 -0.30 0.00 0.21 0.00 0.00 52.86 52.81 2dhj s ASN 117 Cb 0.34 -1.49 -0.08 0.00 -0.55 0.00 0.00 41.25 39.47 2dhj s ASN 117 CO -0.13 0.11 0.99 -0.76 -2.79 0.00 0.00 177.10 174.52 2dhj s LEU 118 N 0.62 4.59 0.26 3.21 1.43 -1.26 -5.03 118.68 122.50 2dhj s LEU 118 Ca -0.10 1.98 0.12 0.00 -1.03 0.00 0.00 54.13 55.09 2dhj s LEU 118 Cb -0.16 -3.61 -0.05 0.00 0.03 0.00 0.00 46.19 42.40 2dhj s LEU 118 CO 0.03 0.02 -0.19 0.54 0.23 0.00 0.00 176.35 176.98 2dhj s ASN 119 N -0.77 3.66 0.98 2.29 2.20 -1.26 -5.11 114.94 116.92 2dhj s ASN 119 Ca 0.44 -0.95 -0.15 0.00 -0.94 0.00 0.00 52.86 51.25 2dhj s ASN 119 Cb -0.27 -0.35 -0.06 0.00 -2.00 0.00 0.00 41.25 38.58 2dhj s ASN 119 CO 0.33 0.05 -0.20 -0.24 -2.94 0.00 0.00 177.10 174.10 2dhj n SER 120 N -0.45 -4.04 -3.59 3.54 2.88 -1.26 -5.02 113.62 105.68 2dhj n SER 120 Ca -0.07 0.25 -0.07 0.00 -1.33 0.00 0.00 58.87 57.65 2dhj n SER 120 Cb 0.59 -0.98 -0.04 0.00 -0.75 0.00 0.00 64.21 63.03 2dhj n SER 120 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2dhj s GLY 121 N -1.51 -0.18 0.50 0.46 0.00 -1.26 -5.02 107.32 100.31 2dhj s GLY 121 Ca 0.48 2.15 0.32 0.00 0.00 0.00 0.00 44.72 47.68 2dhj s GLY 121 CO 0.75 0.95 1.95 -0.56 0.00 0.00 0.00 173.10 176.19 2dhj h PRO 122 N 2.31 0.00 -5.48 2.90 0.13 -2.09 -3.43 132.00 126.35 2dhj h PRO 122 Ca -0.14 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.48 2dhj h PRO 122 Cb 1.17 0.00 -0.28 0.00 0.13 0.00 0.00 31.00 32.02 2dhj h PRO 122 CO 0.27 0.00 -0.82 -1.12 -0.23 0.00 0.00 178.00 176.11 2dhj s SER 123 N -5.37 1.85 -0.14 1.44 0.01 -1.26 -5.06 113.70 105.17 2dhj s SER 123 Ca 0.01 -0.33 -0.14 0.00 1.31 0.00 0.00 55.95 56.81 2dhj s SER 123 Cb 0.09 -0.19 -0.06 0.00 0.21 0.00 0.00 66.02 66.08 2dhj s SER 123 CO 0.51 0.16 -0.27 -1.20 0.41 0.00 0.00 173.24 172.84 2dhj n SER 124 N 2.50 1.72 0.00 2.44 7.64 -1.26 -5.14 113.62 121.52 2dhj n SER 124 Ca -0.15 0.28 0.08 0.00 1.01 0.00 0.00 58.87 60.09 2dhj n SER 124 Cb 0.55 -0.65 0.45 0.00 -1.01 0.00 0.00 64.21 63.54 2dhj n SER 124 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64