#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dhj s SER 2 N 0.00 -0.40 0.35 1.61 1.04 -1.26 -5.15 113.70 109.89 2dhj s SER 2 Ca 0.00 -0.14 -0.27 0.00 0.48 0.00 0.00 55.95 56.02 2dhj s SER 2 Cb 0.00 0.53 -0.09 0.00 0.10 0.00 0.00 66.02 66.56 2dhj s SER 2 CO 0.00 -0.89 1.14 -0.55 0.98 0.00 0.00 173.24 173.92 2dhj s SER 3 N -2.71 6.85 -0.07 7.02 0.15 -1.26 -4.96 113.70 118.72 2dhj s SER 3 Ca 0.05 2.30 0.00 0.00 0.70 0.00 0.00 55.95 59.01 2dhj s SER 3 Cb -0.02 -2.62 -0.04 0.00 -1.71 0.00 0.00 66.02 61.63 2dhj s SER 3 CO -0.07 -0.44 -0.06 0.61 1.20 0.00 0.00 173.24 174.48 2dhj n GLY 4 N 0.80 -0.10 3.95 9.45 0.00 -1.26 -5.06 105.19 112.98 2dhj n GLY 4 Ca 0.02 -0.04 -0.24 0.00 0.00 0.00 0.00 46.02 45.76 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 -4.71 4.95 -0.11 1.61 0.01 -1.26 -5.03 113.70 109.16 2dhj s SER 5 Ca -0.09 0.17 -0.30 0.00 1.31 0.00 0.00 55.95 57.05 2dhj s SER 5 Cb 0.02 -0.90 -0.02 0.00 0.21 0.00 0.00 66.02 65.33 2dhj s SER 5 CO 0.16 -1.43 1.28 -0.55 0.41 0.00 0.00 173.24 173.10 2dhj s SER 6 N -4.50 6.95 -0.13 2.44 0.15 -1.26 -5.01 113.70 112.34 2dhj s SER 6 Ca 0.60 1.79 0.01 0.00 0.70 0.00 0.00 55.95 59.05 2dhj s SER 6 Cb -0.10 -2.55 0.02 0.00 -1.71 0.00 0.00 66.02 61.68 2dhj s SER 6 CO 0.42 -0.72 -0.16 -0.83 1.20 0.00 0.00 173.24 173.16 2dhj s GLY 7 N 1.91 1.10 0.56 9.45 0.00 -1.26 -5.12 107.32 113.96 2dhj s GLY 7 Ca 0.57 -0.83 -0.20 0.00 0.00 0.00 0.00 44.72 44.26 2dhj s GLY 7 CO 0.18 0.30 1.19 -0.35 0.00 0.00 0.00 173.10 174.43 2dhj s ASP 8 N 1.14 5.45 -0.30 1.64 -1.08 -1.26 -4.86 116.67 117.39 2dhj s ASP 8 Ca -0.03 2.35 -0.35 0.00 -0.52 0.00 0.00 52.55 54.00 2dhj s ASP 8 Cb -0.14 -2.60 -0.12 0.00 -1.46 0.00 0.00 42.92 38.60 2dhj s ASP 8 CO -0.05 -1.41 2.10 0.00 0.52 0.00 0.00 175.17 176.33 2dhj n ALA 9 N -1.34 0.94 -0.33 3.66 0.00 -1.26 -4.80 120.51 117.38 2dhj n ALA 9 Ca 0.12 0.03 0.10 0.00 0.00 0.00 0.00 53.44 53.69 2dhj n ALA 9 Cb 0.49 -2.52 0.21 0.00 0.00 0.00 0.00 19.45 17.64 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 9.04 0.37 -3.27 0.00 0.00 -0.25 -4.65 120.51 121.75 2dhj n ALA 10 Ca 0.37 1.02 -0.12 0.00 0.00 0.00 0.00 53.44 54.70 2dhj n ALA 10 Cb 0.23 -0.68 -0.04 0.00 0.00 0.00 0.00 19.45 18.96 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 -6.04 1.14 -0.02 0.00 2.20 -1.17 -5.03 119.74 110.82 2dhj s LYS 11 Ca -0.13 -0.44 -0.28 0.00 -0.36 0.00 0.00 55.97 54.76 2dhj s LYS 11 Cb 0.27 0.52 0.06 0.00 -1.51 0.00 0.00 37.83 37.17 2dhj s LYS 11 CO 0.73 -0.46 0.61 -1.83 -0.36 0.00 0.00 175.35 174.05 2dhj s GLU 12 N -3.29 1.02 0.00 4.03 -1.05 -1.26 -0.20 118.70 117.96 2dhj s GLU 12 Ca -0.01 0.10 0.00 0.00 -0.15 0.00 0.00 54.97 54.91 2dhj s GLU 12 Cb -0.00 0.48 0.00 0.00 -0.44 0.00 0.00 34.13 34.17 2dhj s GLU 12 CO -0.09 -0.33 0.00 0.41 0.95 0.00 0.00 175.26 176.20 2dhj n GLY 13 N 0.81 2.27 3.65 -3.83 0.00 -0.96 -5.03 105.19 102.09 2dhj n GLY 13 Ca -0.19 -0.91 -0.43 0.00 0.00 0.00 0.00 46.02 44.50 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 2.32 0.03 1.61 0.52 -1.26 -1.84 118.94 118.31 2dhj s TRP 14 Ca 0.00 0.58 0.01 0.00 0.02 0.00 0.00 56.10 56.71 2dhj s TRP 14 Cb 0.00 -3.81 -0.02 0.00 -1.15 0.00 0.00 33.47 28.49 2dhj s TRP 14 CO 0.00 -2.81 -0.06 -0.51 0.02 0.00 0.00 176.95 173.59 2dhj s LEU 15 N 4.23 2.22 -0.56 2.99 1.43 -1.25 -4.83 118.68 122.91 2dhj s LEU 15 Ca 0.66 -0.47 -0.25 0.00 -1.03 0.00 0.00 54.13 53.05 2dhj s LEU 15 Cb -0.26 -0.09 0.04 0.00 0.03 0.00 0.00 46.19 45.91 2dhj s LEU 15 CO 0.24 -0.20 0.97 -1.00 0.23 0.00 0.00 176.35 176.60 2dhj s HIS 16 N -1.23 2.77 -0.35 0.29 3.76 -1.26 -2.38 115.29 116.89 2dhj s HIS 16 Ca -0.10 0.02 -0.18 0.00 -0.15 0.00 0.00 55.06 54.65 2dhj s HIS 16 Cb -0.09 -4.13 -0.00 0.00 1.11 0.00 0.00 32.58 29.47 2dhj s HIS 16 CO -0.00 -1.39 0.50 0.12 -0.85 0.00 0.00 174.74 173.12 2dhj s PHE 17 N 4.07 3.18 -0.32 1.40 5.36 -0.99 -3.05 117.98 127.63 2dhj s PHE 17 Ca 0.32 0.13 0.00 0.00 -0.96 0.00 0.00 56.93 56.42 2dhj s PHE 17 Cb -0.12 -2.92 0.10 0.00 -0.34 0.00 0.00 43.02 39.74 2dhj s PHE 17 CO 0.20 -0.55 0.09 0.50 -1.46 0.00 0.00 175.22 174.00 2dhj s ARG 18 N 2.37 0.92 0.33 10.12 3.52 -1.03 -2.67 118.95 132.50 2dhj s ARG 18 Ca 0.18 -1.31 -0.28 0.00 -0.13 0.00 0.00 55.73 54.19 2dhj s ARG 18 Cb -0.16 -2.30 -0.10 0.00 -1.56 0.00 0.00 34.95 30.84 2dhj s ARG 18 CO 0.13 -0.98 1.22 -1.25 -0.81 0.00 0.00 175.30 173.61 2dhj s PRO 19 N 1.39 4.38 -0.06 5.12 0.04 -1.26 -0.12 135.00 144.49 2dhj s PRO 19 Ca 0.10 2.03 -0.00 0.00 0.04 0.00 0.00 61.00 63.17 2dhj s PRO 19 Cb -0.18 -3.03 -0.00 0.00 0.04 0.00 0.00 34.50 31.33 2dhj s PRO 19 CO -0.20 -0.10 -0.01 -0.07 0.04 0.00 0.00 177.00 176.67 2dhj h LEU 20 N 3.37 0.00 -8.47 -3.56 3.38 -1.35 -3.47 115.31 105.21 2dhj h LEU 20 Ca -0.48 0.00 -0.68 0.00 0.09 0.00 0.00 57.88 56.81 2dhj h LEU 20 Cb 1.22 0.00 -0.31 0.00 0.09 0.00 0.00 40.66 41.67 2dhj h LEU 20 CO 0.65 0.30 -0.85 0.68 0.09 0.00 0.00 178.44 179.32 2dhj s VAL 21 N -1.35 2.34 0.12 1.22 -7.23 -1.26 -5.00 120.40 109.24 2dhj s VAL 21 Ca -0.00 -0.93 0.00 0.00 -1.81 0.00 0.00 61.98 59.23 2dhj s VAL 21 Cb 0.00 -1.91 0.00 0.00 0.56 0.00 0.00 36.38 35.03 2dhj s VAL 21 CO 0.01 0.56 0.00 0.35 -0.31 0.00 0.00 175.10 175.70 2dhj n THR 22 N 3.31 0.43 -1.45 5.32 -2.24 -1.26 -4.39 114.28 113.99 2dhj n THR 22 Ca -0.18 0.14 -0.41 0.00 -2.27 0.00 0.00 64.05 61.33 2dhj n THR 22 Cb 0.53 -0.89 0.01 0.00 -2.10 0.00 0.00 70.33 67.88 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 -3.14 -0.90 -4.19 3.42 5.75 -1.26 -4.91 116.55 111.32 2dhj n ASP 23 Ca 0.00 0.89 -0.40 0.00 -0.01 0.00 0.00 54.79 55.27 2dhj n ASP 23 Cb 0.00 -1.12 -0.05 0.00 -1.03 0.00 0.00 41.12 38.92 2dhj n ASP 23 CO 0.00 0.00 0.00 -0.75 -0.11 0.00 0.00 177.20 176.34 2dhj s LYS 24 N -1.62 3.42 -0.95 0.11 2.36 -1.26 -4.71 119.74 117.10 2dhj s LYS 24 Ca 0.64 -3.04 -0.02 0.00 -2.55 0.00 0.00 55.97 51.00 2dhj s LYS 24 Cb -0.59 -4.12 -0.02 0.00 -1.05 0.00 0.00 37.83 32.05 2dhj s LYS 24 CO 0.58 -1.25 0.80 0.41 1.55 0.00 0.00 175.35 177.44 2dhj n GLY 25 N 2.82 -0.40 2.96 5.54 0.00 -1.26 -5.03 105.19 109.82 2dhj n GLY 25 Ca 0.19 0.13 -0.22 0.00 0.00 0.00 0.00 46.02 46.12 2dhj n GLY 25 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dhj s LYS 26 N -4.82 1.20 -0.39 1.61 1.02 -1.26 -5.03 119.74 112.07 2dhj s LYS 26 Ca 0.12 -0.25 -0.02 0.00 0.02 0.00 0.00 55.97 55.84 2dhj s LYS 26 Cb -0.02 -1.07 0.20 0.00 -0.52 0.00 0.00 37.83 36.43 2dhj s LYS 26 CO 0.60 -0.02 2.20 0.54 -0.92 0.00 0.00 175.35 177.76 2dhj n ARG 27 N 3.87 2.03 -3.24 1.68 1.74 -1.26 -4.94 116.66 116.54 2dhj n ARG 27 Ca -0.24 -1.93 -0.23 0.00 -0.77 0.00 0.00 57.85 54.69 2dhj n ARG 27 Cb 0.51 -1.81 -0.00 0.00 -1.02 0.00 0.00 32.46 30.15 2dhj n ARG 27 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 2dhj s VAL 28 N -2.55 4.58 0.04 1.55 -7.23 -1.26 -4.98 120.40 110.56 2dhj s VAL 28 Ca 0.41 -0.53 0.00 0.00 -1.81 0.00 0.00 61.98 60.05 2dhj s VAL 28 Cb 0.30 -3.67 0.00 0.00 0.56 0.00 0.00 36.38 33.57 2dhj s VAL 28 CO -0.06 -0.43 0.00 0.61 -0.31 0.00 0.00 175.10 174.91 2dhj n GLY 29 N -1.88 -0.97 0.00 2.32 0.00 -1.26 -4.99 105.19 98.40 2dhj n GLY 29 Ca -0.02 -0.93 0.00 0.00 0.00 0.00 0.00 46.02 45.07 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 -0.57 1.56 3.72 -0.02 0.00 -1.26 -5.10 105.19 103.53 2dhj n GLY 30 Ca 0.00 -0.19 -0.40 0.00 0.00 0.00 0.00 46.02 45.43 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 1.00 7.15 0.22 1.61 0.01 -1.26 -5.01 113.70 117.42 2dhj s SER 31 Ca 0.00 1.38 -0.32 0.00 1.31 0.00 0.00 55.95 58.33 2dhj s SER 31 Cb 0.00 -2.47 -0.12 0.00 0.21 0.00 0.00 66.02 63.65 2dhj s SER 31 CO 0.00 -0.11 1.69 -0.63 0.41 0.00 0.00 173.24 174.60 2dhj s ILE 32 N 0.58 2.07 0.92 1.44 1.01 -1.26 -4.95 121.20 121.01 2dhj s ILE 32 Ca 0.41 0.05 -0.12 0.00 0.00 0.00 0.00 60.65 61.00 2dhj s ILE 32 Cb -0.19 -3.03 0.07 0.00 0.01 0.00 0.00 42.46 39.31 2dhj s ILE 32 CO 0.22 0.01 0.70 0.54 0.00 0.00 0.00 174.94 176.41 2dhj n ARG 33 N 3.62 -0.28 -1.06 2.79 3.00 -1.26 -4.99 116.66 118.47 2dhj n ARG 33 Ca 0.14 -0.03 -0.30 0.00 -0.01 0.00 0.00 57.85 57.65 2dhj n ARG 33 Cb 0.36 -2.06 0.25 0.00 0.00 0.00 0.00 32.46 31.01 2dhj n ARG 33 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 2dhj s PRO 34 N -3.94 -1.58 0.34 5.56 0.04 -1.26 -4.93 135.00 129.24 2dhj s PRO 34 Ca 0.62 -0.19 -0.25 0.00 0.04 0.00 0.00 61.00 61.22 2dhj s PRO 34 Cb -0.23 -1.57 -0.14 0.00 0.04 0.00 0.00 34.50 32.61 2dhj s PRO 34 CO 0.63 -3.92 0.69 0.91 0.04 0.00 0.00 177.00 175.34 2dhj n TRP 35 N -4.89 0.06 -3.78 0.56 7.02 -1.26 -4.93 117.44 110.22 2dhj n TRP 35 Ca 0.15 0.70 -0.34 0.00 -1.02 0.00 0.00 57.50 56.98 2dhj n TRP 35 Cb 0.60 -2.07 -0.11 0.00 -2.42 0.00 0.00 31.31 27.32 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 -1.48 2.47 -0.05 -0.99 1.02 -1.09 -4.98 119.74 114.64 2dhj s LYS 36 Ca 0.62 -2.68 -0.29 0.00 0.02 0.00 0.00 55.97 53.64 2dhj s LYS 36 Cb -0.69 -3.62 -0.07 0.00 -0.52 0.00 0.00 37.83 32.93 2dhj s LYS 36 CO 0.58 -1.17 1.91 -1.14 -0.92 0.00 0.00 175.35 174.61 2dhj s GLN 37 N -0.33 3.93 -0.22 1.68 0.74 -1.26 -2.33 119.66 121.86 2dhj s GLN 37 Ca 0.18 2.32 -0.15 0.00 0.05 0.00 0.00 55.36 57.76 2dhj s GLN 37 Cb -0.20 -4.15 0.06 0.00 1.10 0.00 0.00 33.01 29.82 2dhj s GLN 37 CO -0.04 -1.17 0.56 0.00 -0.55 0.00 0.00 175.29 174.09 2dhj s MET 38 N 4.73 0.60 -0.38 1.67 0.23 -1.00 -4.91 119.30 120.24 2dhj s MET 38 Ca 0.86 0.92 -0.41 0.00 -1.03 0.00 0.00 55.69 56.03 2dhj s MET 38 Cb -0.37 0.16 -0.16 0.00 -1.53 0.00 0.00 34.83 32.93 2dhj s MET 38 CO 0.37 -0.12 1.89 0.98 -2.03 0.00 0.00 175.02 176.11 2dhj n TYR 39 N 3.69 1.73 -3.83 3.16 9.36 -0.17 -3.76 117.16 127.34 2dhj n TYR 39 Ca -0.18 0.64 -0.36 0.00 3.32 0.00 0.00 57.90 61.31 2dhj n TYR 39 Cb 0.57 -2.40 -0.12 0.00 -0.63 0.00 0.00 39.34 36.75 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 4.33 -0.06 2.97 1.01 -0.77 -0.14 120.40 132.48 2dhj s VAL 40 Ca 1.06 -0.17 0.02 0.00 0.00 0.00 0.00 61.98 62.89 2dhj s VAL 40 Cb -1.19 -3.01 -0.03 0.00 0.00 0.00 0.00 36.38 32.15 2dhj s VAL 40 CO 0.65 0.36 -0.11 -0.69 0.00 0.00 0.00 175.10 175.32 2dhj s VAL 41 N 1.39 3.38 -0.30 2.92 1.01 0.65 -2.27 120.40 127.18 2dhj s VAL 41 Ca 0.05 -0.60 -0.05 0.00 0.00 0.00 0.00 61.98 61.39 2dhj s VAL 41 Cb -0.15 -2.36 0.03 0.00 0.00 0.00 0.00 36.38 33.90 2dhj s VAL 41 CO 0.03 0.59 0.04 -0.22 0.00 0.00 0.00 175.10 175.54 2dhj s LEU 42 N -0.72 3.81 -0.41 3.92 2.96 0.73 -0.63 118.68 128.34 2dhj s LEU 42 Ca 0.11 -0.94 0.03 0.00 -0.22 0.00 0.00 54.13 53.11 2dhj s LEU 42 Cb -0.11 -1.80 0.11 0.00 0.50 0.00 0.00 46.19 44.90 2dhj s LEU 42 CO 0.01 -0.22 0.15 -0.13 -1.32 0.00 0.00 176.35 174.84 2dhj s ARG 43 N 1.39 1.55 4.08 1.98 0.52 -0.52 -1.09 118.95 126.87 2dhj s ARG 43 Ca -0.00 -2.06 0.00 0.00 -0.52 0.00 0.00 55.73 53.15 2dhj s ARG 43 Cb -0.18 -3.02 0.00 0.00 0.52 0.00 0.00 34.95 32.27 2dhj s ARG 43 CO 0.00 -1.03 0.00 0.41 0.02 0.00 0.00 175.30 174.71 2dhj n GLY 44 N 3.85 1.46 0.07 -3.53 0.00 -1.26 -2.22 105.19 103.56 2dhj n GLY 44 Ca 0.04 0.16 0.03 0.00 0.00 0.00 0.00 46.02 46.25 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 -4.99 1.61 1.44 -1.26 -4.71 115.22 107.31 2dhj n HIS 45 Ca 0.00 -0.54 -0.28 0.00 -2.01 0.00 0.00 57.72 54.89 2dhj n HIS 45 Cb 0.00 -0.07 -0.16 0.00 0.12 0.00 0.00 29.99 29.87 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 -1.45 2.51 -0.33 4.39 0.01 -0.94 0.19 113.70 118.08 2dhj s SER 46 Ca 0.10 -0.42 -0.10 0.00 1.31 0.00 0.00 55.95 56.84 2dhj s SER 46 Cb 0.09 -0.79 0.00 0.00 0.21 0.00 0.00 66.02 65.53 2dhj s SER 46 CO 0.01 0.17 0.17 -0.76 0.41 0.00 0.00 173.24 173.24 2dhj s LEU 47 N 0.07 4.34 -0.30 2.44 1.43 -0.77 -1.43 118.68 124.45 2dhj s LEU 47 Ca -0.07 -0.68 -0.10 0.00 -1.03 0.00 0.00 54.13 52.25 2dhj s LEU 47 Cb -0.13 -2.01 -0.01 0.00 0.03 0.00 0.00 46.19 44.06 2dhj s LEU 47 CO 0.04 -0.26 0.16 -0.31 0.23 0.00 0.00 176.35 176.20 2dhj s TYR 48 N 1.60 3.18 0.21 0.29 2.02 0.19 -3.33 117.35 121.51 2dhj s TYR 48 Ca 0.04 -0.46 0.05 0.00 -0.37 0.00 0.00 57.07 56.32 2dhj s TYR 48 Cb -0.18 -2.36 -0.03 0.00 -0.40 0.00 0.00 41.96 38.99 2dhj s TYR 48 CO 0.07 -0.41 0.30 -0.51 -1.57 0.00 0.00 175.55 173.43 2dhj s LEU 49 N 1.64 4.23 -0.12 -1.29 1.02 -1.26 -0.25 118.68 122.64 2dhj s LEU 49 Ca 0.05 0.04 -0.06 0.00 0.02 0.00 0.00 54.13 54.19 2dhj s LEU 49 Cb -0.17 -2.78 0.05 0.00 0.02 0.00 0.00 46.19 43.32 2dhj s LEU 49 CO 0.07 -0.03 0.27 -0.31 0.02 0.00 0.00 176.35 176.37 2dhj s TYR 50 N -1.92 -0.40 0.45 0.29 2.02 0.81 -4.15 117.35 114.44 2dhj s TYR 50 Ca 0.34 0.91 0.31 0.00 -0.37 0.00 0.00 57.07 58.26 2dhj s TYR 50 Cb -0.09 0.05 1.43 0.00 -0.40 0.00 0.00 41.96 42.94 2dhj s TYR 50 CO 0.28 -0.29 1.63 1.57 -1.57 0.00 0.00 175.55 177.18 2dhj h LYS 51 N 7.55 0.09 0.00 -0.62 5.09 -1.91 -0.42 116.57 126.35 2dhj h LYS 51 Ca -0.32 -0.01 -0.35 0.00 0.09 0.00 0.00 60.65 60.07 2dhj h LYS 51 Cb 1.14 -0.02 -0.09 0.00 0.10 0.00 0.00 32.23 33.36 2dhj h LYS 51 CO 0.29 0.06 -0.27 -0.40 -2.09 0.00 0.00 179.45 177.04 2dhj n ASP 52 N -4.63 -1.05 -1.84 7.07 5.68 -1.26 -4.52 116.55 116.00 2dhj n ASP 52 Ca 0.36 -2.95 -0.11 0.00 -0.50 0.00 0.00 54.79 51.59 2dhj n ASP 52 Cb 1.42 2.10 0.19 0.00 -1.14 0.00 0.00 41.12 43.70 2dhj n ASP 52 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.20 177.04 2dhj n LYS 53 N -0.58 2.58 -3.97 0.11 4.81 -1.26 -4.64 118.16 115.21 2dhj n LYS 53 Ca 0.04 -2.36 -0.36 0.00 -0.87 0.00 0.00 58.31 54.75 2dhj n LYS 53 Cb 0.57 -1.97 -0.07 0.00 0.02 0.00 0.00 35.03 33.58 2dhj n LYS 53 CO 0.00 0.00 0.00 0.50 1.17 0.00 0.00 177.40 179.07 2dhj s ARG 54 N -2.49 3.49 -1.27 1.64 3.52 -1.26 -4.52 118.95 118.05 2dhj s ARG 54 Ca 0.44 -0.21 -0.11 0.00 -0.13 0.00 0.00 55.73 55.71 2dhj s ARG 54 Cb 0.36 -3.14 -0.00 0.00 -1.56 0.00 0.00 34.95 30.60 2dhj s ARG 54 CO 0.10 0.67 0.62 -1.91 -0.81 0.00 0.00 175.30 173.96 2dhj n GLU 55 N 2.32 -2.32 -0.50 5.12 4.07 -1.26 -4.81 120.64 123.27 2dhj n GLU 55 Ca -0.19 0.43 -0.03 0.00 -0.06 0.00 0.00 57.16 57.31 2dhj n GLU 55 Cb 0.54 -4.30 0.01 0.00 -0.06 0.00 0.00 31.44 27.63 2dhj n GLU 55 CO 0.00 0.00 0.00 0.94 -0.06 0.00 0.00 177.13 178.01 2dhj n GLN 56 N -4.32 1.14 -0.01 5.31 7.27 -1.26 -3.96 117.38 121.54 2dhj n GLN 56 Ca -0.20 -0.28 -0.21 0.00 0.07 0.00 0.00 57.00 56.37 2dhj n GLN 56 Cb 0.64 -1.11 -0.14 0.00 2.41 0.00 0.00 30.24 32.04 2dhj n GLN 56 CO 0.00 0.00 0.00 0.25 0.07 0.00 0.00 177.06 177.38 2dhj n THR 57 N 1.14 1.75 -3.44 1.69 -2.24 -1.26 -4.94 114.28 106.98 2dhj n THR 57 Ca 0.05 -0.64 -0.28 0.00 -2.27 0.00 0.00 64.05 60.92 2dhj n THR 57 Cb 0.53 -1.70 -0.03 0.00 -2.10 0.00 0.00 70.33 67.03 2dhj n THR 57 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2dhj s THR 58 N -2.55 5.08 1.20 4.28 -4.23 -1.25 -5.10 115.64 113.06 2dhj s THR 58 Ca -0.24 -0.11 -0.19 0.00 -1.18 0.00 0.00 61.69 59.97 2dhj s THR 58 Cb 0.07 -3.75 0.28 0.00 1.34 0.00 0.00 72.50 70.45 2dhj s THR 58 CO 0.75 -0.31 1.11 -2.16 -0.54 0.00 0.00 174.62 173.46 2dhj s PRO 59 N -3.58 -1.19 -0.27 3.99 0.04 -1.26 -4.81 135.00 127.92 2dhj s PRO 59 Ca 0.42 -0.05 -0.28 0.00 0.04 0.00 0.00 61.00 61.13 2dhj s PRO 59 Cb -0.11 -1.60 -0.12 0.00 0.04 0.00 0.00 34.50 32.72 2dhj s PRO 59 CO 0.30 -3.69 0.93 -1.13 0.04 0.00 0.00 177.00 173.45 2dhj n SER 60 N -4.75 0.66 -0.08 6.66 3.41 -1.26 -4.86 113.62 113.40 2dhj n SER 60 Ca 0.13 0.71 -0.07 0.00 -0.26 0.00 0.00 58.87 59.37 2dhj n SER 60 Cb 0.59 -0.53 -0.03 0.00 -0.26 0.00 0.00 64.21 63.99 2dhj n SER 60 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2dhj n GLU 61 N 2.27 0.49 -0.04 4.33 1.02 -1.26 -4.69 120.64 122.75 2dhj n GLU 61 Ca 0.18 0.39 -0.14 0.00 -0.02 0.00 0.00 57.16 57.56 2dhj n GLU 61 Cb -0.03 -1.58 -0.12 0.00 -0.02 0.00 0.00 31.44 29.69 2dhj n GLU 61 CO 0.00 0.00 0.00 1.05 1.18 0.00 0.00 177.13 179.36 2dhj h GLU 62 N -1.00 0.06 -7.04 3.49 4.11 -1.89 -3.46 114.58 108.85 2dhj h GLU 62 Ca -0.02 -0.08 -0.47 0.00 0.07 0.00 0.00 59.36 58.86 2dhj h GLU 62 Cb 0.77 0.02 0.07 0.00 0.50 0.00 0.00 28.75 30.11 2dhj h GLU 62 CO -0.02 0.88 0.07 -1.21 0.07 0.00 0.00 179.01 178.81 2dhj s GLU 63 N -2.90 1.77 0.15 1.06 0.41 -1.26 -5.12 118.70 112.81 2dhj s GLU 63 Ca -0.17 -1.19 0.06 0.00 -0.41 0.00 0.00 54.97 53.26 2dhj s GLU 63 Cb -0.01 -2.38 -0.04 0.00 -1.78 0.00 0.00 34.13 29.92 2dhj s GLU 63 CO 0.71 -1.36 0.00 1.14 -0.49 0.00 0.00 175.26 175.27 2dhj s GLN 64 N -5.07 2.46 0.34 1.61 0.00 -1.26 -4.66 119.66 113.08 2dhj s GLN 64 Ca 0.66 -1.02 -0.28 0.00 -0.00 0.00 0.00 55.36 54.72 2dhj s GLN 64 Cb -0.05 -2.42 -0.10 0.00 0.00 0.00 0.00 33.01 30.44 2dhj s GLN 64 CO 0.43 0.48 1.21 -1.25 0.00 0.00 0.00 175.29 176.17 2dhj s PRO 65 N -2.75 4.33 -0.17 9.60 0.04 -1.26 -4.90 135.00 139.89 2dhj s PRO 65 Ca 0.27 2.00 -0.04 0.00 0.04 0.00 0.00 61.00 63.27 2dhj s PRO 65 Cb -0.10 -2.98 -0.02 0.00 0.04 0.00 0.00 34.50 31.44 2dhj s PRO 65 CO 0.19 -0.13 -0.04 0.42 0.04 0.00 0.00 177.00 177.47 2dhj s ILE 66 N -1.23 3.79 -0.98 0.56 1.01 -1.21 -4.92 121.20 118.22 2dhj s ILE 66 Ca 0.50 -0.39 -0.23 0.00 0.00 0.00 0.00 60.65 60.53 2dhj s ILE 66 Cb -0.35 -2.67 0.03 0.00 0.01 0.00 0.00 42.46 39.48 2dhj s ILE 66 CO 0.46 0.48 1.53 -0.94 0.00 0.00 0.00 174.94 176.46 2dhj s SER 67 N 0.60 6.24 -0.09 3.58 1.04 -1.26 -1.84 113.70 121.97 2dhj s SER 67 Ca -0.03 -1.25 0.01 0.00 0.48 0.00 0.00 55.95 55.16 2dhj s SER 67 Cb -0.14 -2.57 0.14 0.00 0.10 0.00 0.00 66.02 63.55 2dhj s SER 67 CO 0.02 -1.74 1.11 1.33 0.98 0.00 0.00 173.24 174.94 2dhj n VAL 68 N 7.04 1.30 -0.23 5.02 0.24 0.51 -4.28 118.33 127.92 2dhj n VAL 68 Ca 0.33 -0.38 -0.06 0.00 -2.04 0.00 0.00 64.34 62.19 2dhj n VAL 68 Cb 0.50 -0.81 0.04 0.00 -1.47 0.00 0.00 33.84 32.10 2dhj n VAL 68 CO 0.00 0.00 0.00 -1.13 -2.14 0.00 0.00 176.83 173.56 2dhj h ASN 69 N 0.32 0.79 -1.55 -1.34 -1.24 -1.86 -3.30 115.58 107.41 2dhj h ASN 69 Ca 0.11 -0.07 -0.47 0.00 0.71 0.00 0.00 56.30 56.57 2dhj h ASN 69 Cb 1.28 -0.20 -0.41 0.00 0.73 0.00 0.00 38.32 39.72 2dhj h ASN 69 CO 0.21 0.64 -1.03 0.00 -1.29 0.00 0.00 177.43 175.96 2dhj n ALA 70 N -2.31 3.56 -2.37 1.57 0.00 -1.26 -4.14 120.51 115.56 2dhj n ALA 70 Ca 0.05 -3.67 -0.36 0.00 0.00 0.00 0.00 53.44 49.46 2dhj n ALA 70 Cb 0.07 -0.83 -0.06 0.00 0.00 0.00 0.00 19.45 18.63 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 -1.80 5.33 0.25 0.00 2.96 -0.72 -4.89 118.68 119.81 2dhj s LEU 72 Ca 0.36 -1.39 -0.13 0.00 -0.22 0.00 0.00 54.13 52.75 2dhj s LEU 72 Cb -0.16 -2.07 -0.08 0.00 0.50 0.00 0.00 46.19 44.38 2dhj s LEU 72 CO 0.19 -0.57 0.63 -0.63 -1.32 0.00 0.00 176.35 174.64 2dhj s ILE 73 N 1.53 4.80 -0.28 6.68 1.01 -1.26 -2.49 121.20 131.18 2dhj s ILE 73 Ca 0.03 0.75 -0.15 0.00 0.00 0.00 0.00 60.65 61.28 2dhj s ILE 73 Cb -0.23 -3.64 0.09 0.00 0.01 0.00 0.00 42.46 38.68 2dhj s ILE 73 CO 0.04 -0.06 0.71 -1.81 0.00 0.00 0.00 174.94 173.83 2dhj s ASP 74 N -2.20 -0.93 -0.89 3.58 1.01 -0.94 -4.99 116.67 111.31 2dhj s ASP 74 Ca 0.48 1.46 -0.19 0.00 0.71 0.00 0.00 52.55 55.02 2dhj s ASP 74 Cb -0.12 1.47 -0.24 0.00 1.01 0.00 0.00 42.92 45.04 2dhj s ASP 74 CO 0.19 -0.23 2.33 -0.38 0.21 0.00 0.00 175.17 177.29 2dhj n ILE 75 N 4.38 -0.01 -0.99 0.77 5.41 -1.26 -0.72 119.36 126.95 2dhj n ILE 75 Ca -0.19 -0.46 -0.31 0.00 1.00 0.00 0.00 62.75 62.78 2dhj n ILE 75 Cb 0.58 -0.94 0.01 0.00 -0.71 0.00 0.00 39.64 38.58 2dhj n ILE 75 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 2dhj n SER 76 N 11.29 -3.11 -4.05 4.38 2.88 -1.25 -4.77 113.62 118.98 2dhj n SER 76 Ca 0.58 0.50 -0.36 0.00 -1.33 0.00 0.00 58.87 58.26 2dhj n SER 76 Cb 0.25 -0.68 0.05 0.00 -0.75 0.00 0.00 64.21 63.09 2dhj n SER 76 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dhj n TYR 77 N -1.28 -4.68 -0.00 0.66 4.11 -1.26 -4.90 117.16 109.81 2dhj n TYR 77 Ca 0.06 0.01 -0.01 0.00 -0.00 0.00 0.00 57.90 57.95 2dhj n TYR 77 Cb 0.38 -1.47 -0.11 0.00 -0.00 0.00 0.00 39.34 38.14 2dhj n TYR 77 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.86 175.73 2dhj n SER 78 N 2.87 0.60 -0.25 9.48 3.41 -1.26 -4.34 113.62 124.13 2dhj n SER 78 Ca -0.01 0.27 0.10 0.00 -0.26 0.00 0.00 58.87 58.97 2dhj n SER 78 Cb 0.56 0.51 0.20 0.00 -0.26 0.00 0.00 64.21 65.22 2dhj n SER 78 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2dhj n GLU 79 N -2.80 -0.06 -1.79 4.33 -0.58 -1.26 -4.04 120.64 114.44 2dhj n GLU 79 Ca -0.14 1.07 -0.43 0.00 -0.42 0.00 0.00 57.16 57.25 2dhj n GLU 79 Cb 0.89 -1.70 -0.03 0.00 -0.57 0.00 0.00 31.44 30.03 2dhj n GLU 79 CO 0.00 0.00 0.00 -0.08 -0.48 0.00 0.00 177.13 176.57 2dhj s THR 80 N -5.64 3.23 0.31 2.62 -1.32 -1.26 -4.85 115.64 108.72 2dhj s THR 80 Ca -0.09 0.24 0.02 0.00 -1.21 0.00 0.00 61.69 60.65 2dhj s THR 80 Cb 0.21 -3.26 0.42 0.00 -1.51 0.00 0.00 72.50 68.35 2dhj s THR 80 CO 0.56 -0.14 1.57 0.11 -2.21 0.00 0.00 174.62 174.51 2dhj h LYS 81 N 13.18 0.01 -5.61 7.08 1.57 -1.96 -3.41 116.57 127.42 2dhj h LYS 81 Ca -0.40 -0.00 -0.59 0.00 -1.87 0.00 0.00 60.65 57.79 2dhj h LYS 81 Cb 1.21 -0.00 0.14 0.00 0.08 0.00 0.00 32.23 33.66 2dhj h LYS 81 CO 0.98 0.00 -0.82 0.54 -0.57 0.00 0.00 179.45 179.58 2dhj n ARG 82 N -5.49 0.00 -4.40 3.15 3.00 -1.26 -4.97 116.66 106.68 2dhj n ARG 82 Ca 0.23 0.00 -0.27 0.00 -0.01 0.00 0.00 57.85 57.80 2dhj n ARG 82 Cb 0.76 -0.94 -0.12 0.00 0.00 0.00 0.00 32.46 32.17 2dhj n ARG 82 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.63 176.04 2dhj s LYS 83 N -0.94 1.45 -0.48 5.56 -2.85 -1.26 -4.73 119.74 116.50 2dhj s LYS 83 Ca 0.56 -1.46 -0.02 0.00 -1.00 0.00 0.00 55.97 54.05 2dhj s LYS 83 Cb -0.64 -1.79 0.00 0.00 -2.06 0.00 0.00 37.83 33.33 2dhj s LYS 83 CO 0.58 0.40 0.30 0.09 0.10 0.00 0.00 175.35 176.81 2dhj n ASN 84 N 0.46 -3.25 -4.66 0.03 5.03 -1.26 -4.49 115.26 107.11 2dhj n ASN 84 Ca -0.14 -0.14 -0.32 0.00 0.87 0.00 0.00 54.58 54.86 2dhj n ASN 84 Cb 0.55 -1.97 -0.09 0.00 -1.02 0.00 0.00 39.78 37.25 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 -2.93 3.97 -0.04 2.41 1.01 -1.26 0.40 120.40 123.96 2dhj s VAL 85 Ca 0.15 -0.79 -0.05 0.00 0.00 0.00 0.00 61.98 61.29 2dhj s VAL 85 Cb -0.07 -2.81 0.01 0.00 0.00 0.00 0.00 36.38 33.52 2dhj s VAL 85 CO 0.18 0.28 0.13 0.72 0.00 0.00 0.00 175.10 176.41 2dhj s PHE 86 N -1.15 -0.12 0.48 5.22 -0.71 0.95 -3.78 117.98 118.88 2dhj s PHE 86 Ca 0.21 0.31 -0.04 0.00 -1.04 0.00 0.00 56.93 56.37 2dhj s PHE 86 Cb -0.11 0.04 -0.02 0.00 -1.21 0.00 0.00 43.02 41.71 2dhj s PHE 86 CO 0.12 -0.08 0.77 1.03 -1.34 0.00 0.00 175.22 175.72 2dhj s ARG 87 N -0.03 3.38 -0.23 1.99 0.52 0.10 -1.03 118.95 123.64 2dhj s ARG 87 Ca -0.01 0.03 -0.12 0.00 -0.52 0.00 0.00 55.73 55.11 2dhj s ARG 87 Cb -0.01 -2.41 0.08 0.00 0.52 0.00 0.00 34.95 33.12 2dhj s ARG 87 CO 0.00 -0.26 0.55 -1.17 0.02 0.00 0.00 175.30 174.45 2dhj s LEU 88 N -4.72 -0.60 -0.17 2.53 0.20 -1.01 -2.22 118.68 112.69 2dhj s LEU 88 Ca 0.48 1.23 -0.01 0.00 0.69 0.00 0.00 54.13 56.52 2dhj s LEU 88 Cb -0.10 1.88 -0.00 0.00 -0.43 0.00 0.00 46.19 47.54 2dhj s LEU 88 CO 0.43 -0.22 -0.13 -0.89 -0.29 0.00 0.00 176.35 175.25 2dhj s THR 89 N 1.73 2.77 0.05 3.68 2.01 -1.04 -2.45 115.64 122.40 2dhj s THR 89 Ca -0.09 -0.72 0.09 0.00 0.31 0.00 0.00 61.69 61.28 2dhj s THR 89 Cb -0.08 -2.19 -0.03 0.00 0.01 0.00 0.00 72.50 70.21 2dhj s THR 89 CO -0.16 0.50 -0.24 0.42 -0.69 0.00 0.00 174.62 174.45 2dhj s THR 90 N 0.95 2.34 0.58 -0.82 -4.23 -0.66 -1.76 115.64 112.03 2dhj s THR 90 Ca -0.02 -1.36 0.36 0.00 -1.18 0.00 0.00 61.69 59.48 2dhj s THR 90 Cb -0.15 -1.94 0.52 0.00 1.34 0.00 0.00 72.50 72.27 2dhj s THR 90 CO -0.02 0.34 1.60 0.77 -0.54 0.00 0.00 174.62 176.77 2dhj h SER 91 N 4.65 0.00 0.03 3.99 4.64 -1.84 -1.58 113.55 123.44 2dhj h SER 91 Ca -0.47 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 60.85 2dhj h SER 91 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 2dhj h SER 91 CO 0.44 0.00 -0.01 0.44 -0.87 0.00 0.00 176.83 176.83 2dhj h ASP 92 N 0.00 -0.03 -5.31 4.97 3.32 -1.94 -3.50 116.42 113.92 2dhj h ASP 92 Ca 0.57 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 57.46 2dhj h ASP 92 Cb 2.68 0.01 -0.05 0.00 0.22 0.00 0.00 39.33 42.18 2dhj h ASP 92 CO -0.01 0.12 -0.02 0.00 -1.72 0.00 0.00 179.24 177.61 2dhj s GLU 94 N -2.92 2.53 0.15 0.00 2.02 -1.26 -1.65 118.70 117.56 2dhj s GLU 94 Ca 0.24 -1.10 -0.25 0.00 0.02 0.00 0.00 54.97 53.88 2dhj s GLU 94 Cb -0.02 -2.40 0.07 0.00 0.10 0.00 0.00 34.13 31.87 2dhj s GLU 94 CO 0.16 0.44 0.99 0.00 0.02 0.00 0.00 175.26 176.88 2dhj s LEU 96 N -3.00 3.08 -0.06 0.00 1.43 0.82 -2.41 118.68 118.54 2dhj s LEU 96 Ca 0.13 -0.74 -0.03 0.00 -1.03 0.00 0.00 54.13 52.47 2dhj s LEU 96 Cb -0.01 -1.59 0.04 0.00 0.03 0.00 0.00 46.19 44.66 2dhj s LEU 96 CO 0.02 -0.02 0.13 -0.36 0.23 0.00 0.00 176.35 176.35 2dhj s PHE 97 N -2.37 -0.11 0.41 0.29 0.08 -0.20 -2.47 117.98 113.60 2dhj s PHE 97 Ca 0.32 0.47 0.08 0.00 0.12 0.00 0.00 56.93 57.91 2dhj s PHE 97 Cb -0.06 -0.25 0.01 0.00 -0.57 0.00 0.00 43.02 42.15 2dhj s PHE 97 CO 0.19 -0.21 0.54 -1.14 -0.10 0.00 0.00 175.22 174.50 2dhj s GLN 98 N 1.84 2.84 0.18 0.44 0.74 -1.17 -0.03 119.66 124.49 2dhj s GLN 98 Ca -0.01 -1.23 -0.05 0.00 0.05 0.00 0.00 55.36 54.11 2dhj s GLN 98 Cb -0.12 -2.74 -0.02 0.00 1.10 0.00 0.00 33.01 31.23 2dhj s GLN 98 CO -0.05 -0.22 0.21 0.00 -0.55 0.00 0.00 175.29 174.68 2dhj s ALA 99 N -2.34 0.50 -0.01 1.58 0.00 0.16 -4.14 121.76 117.51 2dhj s ALA 99 Ca 0.53 -1.25 -0.04 0.00 0.00 0.00 0.00 51.96 51.20 2dhj s ALA 99 Cb -0.09 1.04 -0.02 0.00 0.00 0.00 0.00 23.12 24.04 2dhj s ALA 99 CO 0.32 -0.62 0.48 1.49 0.00 0.00 0.00 175.76 177.43 2dhj h GLU 100 N 2.60 -0.15 -6.33 0.00 4.81 -1.88 -3.43 114.58 110.20 2dhj h GLU 100 Ca -0.33 0.01 -0.59 0.00 -0.13 0.00 0.00 59.36 58.32 2dhj h GLU 100 Cb 1.23 0.03 -0.20 0.00 0.63 0.00 0.00 28.75 30.45 2dhj h GLU 100 CO 0.50 -0.10 -0.82 0.34 -0.73 0.00 0.00 179.01 178.20 2dhj s ASP 101 N -3.24 2.95 0.20 1.04 2.15 -1.26 -4.88 116.67 113.63 2dhj s ASP 101 Ca -0.02 -0.80 -0.12 0.00 0.43 0.00 0.00 52.55 52.03 2dhj s ASP 101 Cb 0.00 -0.19 0.24 0.00 -0.30 0.00 0.00 42.92 42.67 2dhj s ASP 101 CO 0.07 0.06 1.26 -1.14 -0.17 0.00 0.00 175.17 175.25 2dhj n ARG 102 N 0.57 -0.16 -0.13 4.34 0.63 -1.26 0.10 116.66 120.75 2dhj n ARG 102 Ca -0.15 1.25 -0.04 0.00 -0.92 0.00 0.00 57.85 57.99 2dhj n ARG 102 Cb 0.55 -1.86 0.02 0.00 0.45 0.00 0.00 32.46 31.62 2dhj n ARG 102 CO 0.00 0.00 0.00 0.22 -2.51 0.00 0.00 177.63 175.34 2dhj h ASP 103 N 0.00 -0.42 -0.76 6.15 3.58 -2.00 -0.62 116.42 122.35 2dhj h ASP 103 Ca 0.31 0.13 0.10 0.00 0.42 0.00 0.00 57.03 57.99 2dhj h ASP 103 Cb 0.51 0.28 -0.07 0.00 1.72 0.00 0.00 39.33 41.76 2dhj h ASP 103 CO -0.81 -0.15 0.40 -0.78 -2.88 0.00 0.00 179.24 175.02 2dhj h ASP 104 N -0.01 0.53 0.84 2.28 3.58 0.27 -1.26 116.42 122.65 2dhj h ASP 104 Ca 0.21 0.06 -0.04 0.00 0.42 0.00 0.00 57.03 57.68 2dhj h ASP 104 Cb 0.33 -0.03 0.01 0.00 1.72 0.00 0.00 39.33 41.35 2dhj h ASP 104 CO -0.45 0.29 -0.40 -0.03 -2.88 0.00 0.00 179.24 175.77 2dhj h MET 105 N 0.66 -1.08 -0.87 0.28 4.05 -0.24 -2.69 114.93 115.03 2dhj h MET 105 Ca 0.38 0.07 0.19 0.00 -0.28 0.00 0.00 59.70 60.07 2dhj h MET 105 Cb 0.41 0.25 -0.11 0.00 -0.80 0.00 0.00 31.60 31.34 2dhj h MET 105 CO -0.28 -0.72 0.38 -0.07 0.23 0.00 0.00 176.91 176.46 2dhj h LEU 106 N -1.15 0.36 -0.38 3.39 -0.00 -0.93 -0.19 115.31 116.40 2dhj h LEU 106 Ca -0.11 0.14 0.07 0.00 -0.00 0.00 0.00 57.88 57.97 2dhj h LEU 106 Cb 0.87 0.10 -0.06 0.00 -0.00 0.00 0.00 40.66 41.57 2dhj h LEU 106 CO 0.19 0.06 -0.02 0.00 -0.00 0.00 0.00 178.44 178.67 2dhj h ALA 107 N 1.66 0.33 0.70 1.53 0.00 -1.04 -1.49 119.26 120.95 2dhj h ALA 107 Ca 0.52 0.12 -0.03 0.00 0.00 0.00 0.00 54.91 55.51 2dhj h ALA 107 Cb 0.91 0.21 0.01 0.00 0.00 0.00 0.00 17.79 18.91 2dhj h ALA 107 CO -0.48 -0.41 -0.34 -1.49 0.00 0.00 0.00 179.25 176.54 2dhj h TRP 108 N 0.08 -0.88 -0.75 0.00 4.06 -0.74 -1.23 115.95 116.50 2dhj h TRP 108 Ca 0.19 -0.02 0.12 0.00 2.06 0.00 0.00 58.89 61.24 2dhj h TRP 108 Cb 0.27 0.29 -0.13 0.00 -1.00 0.00 0.00 29.16 28.59 2dhj h TRP 108 CO -0.27 -0.53 -0.36 0.82 -3.56 0.00 0.00 178.44 174.54 2dhj h ILE 109 N -1.02 0.10 0.64 1.49 2.04 -1.12 0.16 117.51 119.79 2dhj h ILE 109 Ca -0.10 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.73 2dhj h ILE 109 Cb 0.74 0.10 -0.00 0.00 -0.74 0.00 0.00 36.82 36.92 2dhj h ILE 109 CO 0.16 0.00 -0.37 0.50 0.00 0.00 0.00 178.15 178.44 2dhj h LYS 110 N -0.10 -0.90 -0.67 2.37 3.64 -1.23 0.33 116.57 120.01 2dhj h LYS 110 Ca 0.27 0.06 0.07 0.00 -1.27 0.00 0.00 60.65 59.79 2dhj h LYS 110 Cb 0.57 0.20 -0.10 0.00 -0.41 0.00 0.00 32.23 32.49 2dhj h LYS 110 CO -0.80 -0.60 -0.56 1.15 -2.27 0.00 0.00 179.45 176.37 2dhj h THR 111 N -0.94 0.01 0.51 1.00 2.02 -0.55 0.34 112.91 115.30 2dhj h THR 111 Ca -0.09 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.07 2dhj h THR 111 Cb 0.74 0.01 0.00 0.00 -1.74 0.00 0.00 68.15 67.16 2dhj h THR 111 CO 0.10 0.00 -0.28 0.40 0.37 0.00 0.00 175.52 176.11 2dhj h ILE 112 N -0.22 0.00 -1.04 3.11 2.04 -0.69 -2.07 117.51 118.64 2dhj h ILE 112 Ca 0.12 0.00 0.40 0.00 1.00 0.00 0.00 64.86 66.39 2dhj h ILE 112 Cb 0.52 0.00 -0.17 0.00 -0.74 0.00 0.00 36.82 36.43 2dhj h ILE 112 CO -0.75 0.00 0.58 1.56 0.00 0.00 0.00 178.15 179.54 2dhj h GLN 113 N -0.73 0.07 -0.26 2.37 4.20 0.02 0.81 115.11 121.58 2dhj h GLN 113 Ca -0.07 -0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.61 2dhj h GLN 113 Cb 0.57 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.33 2dhj h GLN 113 CO 0.09 0.05 0.07 0.93 -0.67 0.00 0.00 178.83 179.30 2dhj h GLU 114 N 0.07 0.41 -0.19 1.46 4.39 -0.00 0.21 114.58 120.92 2dhj h GLU 114 Ca 0.83 -0.09 -0.02 0.00 0.34 0.00 0.00 59.36 60.42 2dhj h GLU 114 Cb 2.18 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 30.76 2dhj h GLU 114 CO -0.70 0.49 0.05 0.77 -1.16 0.00 0.00 179.01 178.46 2dhj h SER 115 N 0.25 0.29 -0.10 1.42 0.02 0.12 -2.92 113.55 112.63 2dhj h SER 115 Ca 0.08 -0.22 -0.07 0.00 -0.84 0.00 0.00 61.79 60.74 2dhj h SER 115 Cb 0.26 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 62.71 2dhj h SER 115 CO -0.00 0.44 -0.15 0.77 -1.14 0.00 0.00 176.83 176.74 2dhj h SER 116 N 0.13 0.45 -2.63 3.07 4.64 -0.89 -3.43 113.55 114.89 2dhj h SER 116 Ca 0.06 -0.12 -0.54 0.00 -0.47 0.00 0.00 61.79 60.72 2dhj h SER 116 Cb 0.26 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.23 2dhj h SER 116 CO -0.00 0.62 1.06 0.21 -0.87 0.00 0.00 176.83 177.86 2dhj s ASN 117 N -6.79 6.65 -0.02 4.97 2.47 0.72 -4.32 114.94 118.61 2dhj s ASN 117 Ca -0.07 2.32 -0.35 0.00 0.42 0.00 0.00 52.86 55.18 2dhj s ASN 117 Cb 0.15 -2.54 -0.13 0.00 -1.45 0.00 0.00 41.25 37.27 2dhj s ASN 117 CO 0.77 -0.91 1.73 0.18 -3.72 0.00 0.00 177.10 175.15 2dhj n LEU 118 N 6.71 3.08 -4.16 3.21 4.77 -1.26 -4.91 117.00 124.45 2dhj n LEU 118 Ca 0.17 1.03 -0.36 0.00 -0.03 0.00 0.00 56.01 56.82 2dhj n LEU 118 Cb 0.42 -1.35 -0.12 0.00 -2.33 0.00 0.00 43.42 40.04 2dhj n LEU 118 CO 0.63 -0.24 -0.24 0.21 -1.33 0.00 0.00 177.39 176.41 2dhj s ASN 119 N 2.79 5.14 -0.28 -1.43 2.47 -1.26 -5.08 114.94 117.30 2dhj s ASN 119 Ca 0.89 -1.65 -0.23 0.00 0.42 0.00 0.00 52.86 52.29 2dhj s ASN 119 Cb -0.75 -1.80 -0.00 0.00 -1.45 0.00 0.00 41.25 37.25 2dhj s ASN 119 CO 0.49 -0.42 0.76 -0.94 -3.72 0.00 0.00 177.10 173.27 2dhj s SER 120 N 1.57 6.69 0.00 -4.21 1.04 -1.26 -4.95 113.70 112.58 2dhj s SER 120 Ca 0.02 0.76 0.00 0.00 0.48 0.00 0.00 55.95 57.21 2dhj s SER 120 Cb -0.21 -2.40 0.00 0.00 0.10 0.00 0.00 66.02 63.51 2dhj s SER 120 CO -0.02 -0.54 0.00 0.61 0.98 0.00 0.00 173.24 174.27 2dhj n GLY 121 N 4.08 4.43 0.00 7.32 0.00 -1.26 -4.94 105.19 114.82 2dhj n GLY 121 Ca 0.03 -0.71 0.07 0.00 0.00 0.00 0.00 46.02 45.40 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 -1.55 0.49 -1.03 1.61 -0.04 -1.26 -4.24 135.00 128.99 2dhj n PRO 122 Ca 0.00 0.00 -0.28 0.00 -0.04 0.00 0.00 63.50 63.18 2dhj n PRO 122 Cb 0.00 -1.42 -0.05 0.00 -0.04 0.00 0.00 33.50 31.99 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 -0.92 6.67 -4.65 3.54 3.41 -1.26 -4.93 113.62 115.48 2dhj n SER 123 Ca 0.10 -2.44 -0.47 0.00 -0.26 0.00 0.00 58.87 55.80 2dhj n SER 123 Cb 0.05 -1.33 -0.04 0.00 -0.26 0.00 0.00 64.21 62.62 2dhj n SER 123 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2dhj n SER 124 N 3.61 2.70 0.00 4.04 2.88 -1.26 -5.15 113.62 120.44 2dhj n SER 124 Ca 0.59 1.10 0.00 0.00 -1.33 0.00 0.00 58.87 59.23 2dhj n SER 124 Cb 0.29 -1.37 0.00 0.00 -0.75 0.00 0.00 64.21 62.38 2dhj n SER 124 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42