#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 -1.09 -1.81 1.61 7.64 -1.26 -4.74 113.62 113.98 2dhj n SER 2 Ca 0.00 -1.15 -0.10 0.00 1.01 0.00 0.00 58.87 58.63 2dhj n SER 2 Cb 0.00 -1.46 -0.02 0.00 -1.01 0.00 0.00 64.21 61.72 2dhj n SER 2 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2dhj n SER 3 N -2.28 5.80 -4.76 6.43 7.64 -1.26 -4.88 113.62 120.31 2dhj n SER 3 Ca 0.02 -2.71 -0.23 0.00 1.01 0.00 0.00 58.87 56.96 2dhj n SER 3 Cb 0.46 -1.17 -0.06 0.00 -1.01 0.00 0.00 64.21 62.44 2dhj n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2dhj s GLY 4 N 1.26 1.84 -1.68 0.23 0.00 -1.26 -4.61 107.32 103.10 2dhj s GLY 4 Ca 0.27 -1.74 -0.16 0.00 0.00 0.00 0.00 44.72 43.09 2dhj s GLY 4 CO -0.02 -1.69 0.69 1.44 0.00 0.00 0.00 173.10 173.52 2dhj n SER 5 N -1.17 -2.63 -4.36 1.64 7.64 -1.26 -4.92 113.62 108.56 2dhj n SER 5 Ca -0.03 -1.04 -0.37 0.00 1.01 0.00 0.00 58.87 58.43 2dhj n SER 5 Cb 0.60 -2.65 -0.13 0.00 -1.01 0.00 0.00 64.21 61.02 2dhj n SER 5 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2dhj s SER 6 N -3.47 5.12 0.00 6.43 0.15 -1.26 -4.07 113.70 116.60 2dhj s SER 6 Ca 0.62 -0.61 0.00 0.00 0.70 0.00 0.00 55.95 56.67 2dhj s SER 6 Cb -0.34 -1.89 0.00 0.00 -1.71 0.00 0.00 66.02 62.08 2dhj s SER 6 CO 0.93 -0.16 0.00 0.61 1.20 0.00 0.00 173.24 175.82 2dhj n GLY 7 N 4.88 -0.02 3.88 9.45 0.00 -1.26 -5.11 105.19 117.01 2dhj n GLY 7 Ca -0.15 0.05 -0.35 0.00 0.00 0.00 0.00 46.02 45.58 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 -4.00 6.50 -0.30 1.61 1.11 -1.26 -5.01 116.67 115.32 2dhj s ASP 8 Ca 0.00 0.57 -0.43 0.00 0.18 0.00 0.00 52.55 52.86 2dhj s ASP 8 Cb 0.00 -2.09 -0.19 0.00 1.07 0.00 0.00 42.92 41.71 2dhj s ASP 8 CO 0.00 0.26 1.47 0.00 1.18 0.00 0.00 175.17 178.08 2dhj n ALA 9 N 1.16 -1.70 -0.16 5.23 0.00 -1.26 -4.82 120.51 118.96 2dhj n ALA 9 Ca -0.12 0.51 -0.06 0.00 0.00 0.00 0.00 53.44 53.77 2dhj n ALA 9 Cb 0.53 -1.94 0.03 0.00 0.00 0.00 0.00 19.45 18.07 2dhj n ALA 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dhj h ALA 10 N 4.85 0.63 -2.80 0.00 0.00 -1.30 -3.46 119.26 117.17 2dhj h ALA 10 Ca -0.46 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.40 2dhj h ALA 10 Cb 1.37 -0.13 -0.11 0.00 0.00 0.00 0.00 17.79 18.92 2dhj h ALA 10 CO 0.88 -0.02 -0.06 0.21 0.00 0.00 0.00 179.25 180.26 2dhj s LYS 11 N -6.14 1.27 0.01 0.00 2.20 -1.10 -5.02 119.74 110.95 2dhj s LYS 11 Ca -0.13 -0.89 -0.28 0.00 -0.36 0.00 0.00 55.97 54.32 2dhj s LYS 11 Cb 0.13 0.48 0.09 0.00 -1.51 0.00 0.00 37.83 37.02 2dhj s LYS 11 CO 0.74 -0.52 0.81 -1.83 -0.36 0.00 0.00 175.35 174.19 2dhj s GLU 12 N -3.87 0.93 0.00 4.03 -1.05 -1.26 -0.97 118.70 116.50 2dhj s GLU 12 Ca 0.09 -0.21 0.00 0.00 -0.15 0.00 0.00 54.97 54.70 2dhj s GLU 12 Cb 0.00 0.43 0.00 0.00 -0.44 0.00 0.00 34.13 34.12 2dhj s GLU 12 CO -0.04 -0.38 0.00 0.41 0.95 0.00 0.00 175.26 176.20 2dhj n GLY 13 N -0.00 3.26 3.69 -3.83 0.00 -1.02 -5.03 105.19 102.25 2dhj n GLY 13 Ca -0.12 -1.21 -0.42 0.00 0.00 0.00 0.00 46.02 44.26 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 2.85 -0.00 1.61 0.52 -1.26 -2.25 118.94 118.40 2dhj s TRP 14 Ca 0.00 0.82 -0.08 0.00 0.02 0.00 0.00 56.10 56.87 2dhj s TRP 14 Cb 0.00 -3.66 0.00 0.00 -1.15 0.00 0.00 33.47 28.67 2dhj s TRP 14 CO 0.00 -2.43 0.15 -0.51 0.02 0.00 0.00 176.95 174.18 2dhj s LEU 15 N 2.44 1.51 -0.59 2.99 1.43 -1.25 -4.85 118.68 120.36 2dhj s LEU 15 Ca 0.64 -0.16 -0.25 0.00 -1.03 0.00 0.00 54.13 53.32 2dhj s LEU 15 Cb -0.31 0.70 0.04 0.00 0.03 0.00 0.00 46.19 46.65 2dhj s LEU 15 CO 0.26 -0.36 1.03 -1.00 0.23 0.00 0.00 176.35 176.51 2dhj s HIS 16 N -1.30 2.69 -0.38 0.29 3.76 -1.25 -2.65 115.29 116.45 2dhj s HIS 16 Ca -0.14 -0.02 -0.18 0.00 -0.15 0.00 0.00 55.06 54.57 2dhj s HIS 16 Cb -0.07 -4.25 0.01 0.00 1.11 0.00 0.00 32.58 29.38 2dhj s HIS 16 CO 0.02 -1.52 0.52 0.12 -0.85 0.00 0.00 174.74 173.03 2dhj s PHE 17 N 4.34 3.16 -0.33 1.40 5.36 0.26 -3.45 117.98 128.71 2dhj s PHE 17 Ca 0.32 0.01 0.03 0.00 -0.96 0.00 0.00 56.93 56.33 2dhj s PHE 17 Cb -0.12 -2.99 0.10 0.00 -0.34 0.00 0.00 43.02 39.67 2dhj s PHE 17 CO 0.19 -0.63 0.07 0.50 -1.46 0.00 0.00 175.22 173.88 2dhj s ARG 18 N 2.41 1.26 0.30 10.12 3.52 -1.16 -2.29 118.95 133.11 2dhj s ARG 18 Ca 0.18 -1.66 -0.29 0.00 -0.13 0.00 0.00 55.73 53.83 2dhj s ARG 18 Cb -0.16 -2.85 -0.10 0.00 -1.56 0.00 0.00 34.95 30.28 2dhj s ARG 18 CO 0.14 -0.96 1.23 -1.25 -0.81 0.00 0.00 175.30 173.66 2dhj s PRO 19 N 1.09 4.46 -0.06 5.12 0.04 -1.26 -0.80 135.00 143.59 2dhj s PRO 19 Ca 0.11 2.05 -0.23 0.00 0.04 0.00 0.00 61.00 62.97 2dhj s PRO 19 Cb -0.19 -3.12 -0.30 0.00 0.04 0.00 0.00 34.50 30.93 2dhj s PRO 19 CO -0.13 -0.05 0.87 -0.07 0.04 0.00 0.00 177.00 177.67 2dhj h LEU 20 N 3.68 0.39 -7.00 -3.56 3.38 -1.53 -3.47 115.31 107.20 2dhj h LEU 20 Ca -0.48 -0.96 -0.03 0.00 0.09 0.00 0.00 57.88 56.50 2dhj h LEU 20 Cb 1.22 -0.13 -0.17 0.00 0.09 0.00 0.00 40.66 41.68 2dhj h LEU 20 CO 0.67 1.32 0.23 0.54 0.09 0.00 0.00 178.44 181.30 2dhj s VAL 21 N -2.39 0.00 0.00 1.22 0.11 -1.26 -5.03 120.40 113.05 2dhj s VAL 21 Ca -0.15 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 58.90 2dhj s VAL 21 Cb 0.00 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.85 2dhj s VAL 21 CO 0.81 0.00 0.00 0.35 -3.33 0.00 0.00 175.10 172.93 2dhj n THR 22 N 0.43 0.00 -3.63 5.04 -2.24 -1.26 -4.06 114.28 108.55 2dhj n THR 22 Ca -0.17 0.00 -0.16 0.00 -2.27 0.00 0.00 64.05 61.45 2dhj n THR 22 Cb 0.60 -0.61 -0.07 0.00 -2.10 0.00 0.00 70.33 68.14 2dhj n THR 22 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2dhj s ASP 23 N -2.30 -0.52 -1.00 3.42 1.01 -1.26 -5.05 116.67 110.98 2dhj s ASP 23 Ca 0.00 0.66 -0.23 0.00 0.71 0.00 0.00 52.55 53.69 2dhj s ASP 23 Cb 0.00 0.65 0.00 0.00 1.01 0.00 0.00 42.92 44.58 2dhj s ASP 23 CO 0.00 -0.46 1.69 -0.54 0.21 0.00 0.00 175.17 176.07 2dhj s LYS 24 N -0.83 3.14 -1.26 8.23 1.02 -1.26 -4.12 119.74 124.66 2dhj s LYS 24 Ca -0.09 -0.83 -0.09 0.00 0.02 0.00 0.00 55.97 54.98 2dhj s LYS 24 Cb -0.03 -5.24 -0.01 0.00 -0.52 0.00 0.00 37.83 32.04 2dhj s LYS 24 CO 0.06 -2.78 0.66 0.41 -0.92 0.00 0.00 175.35 172.78 2dhj n GLY 25 N 6.74 -0.59 3.17 -3.33 0.00 -1.26 -4.95 105.19 104.97 2dhj n GLY 25 Ca 0.37 0.29 -0.38 0.00 0.00 0.00 0.00 46.02 46.31 2dhj n GLY 25 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2dhj s LYS 26 N -6.11 2.26 -1.51 1.61 2.47 -1.26 -4.68 119.74 112.52 2dhj s LYS 26 Ca 0.22 -1.66 -0.09 0.00 -1.56 0.00 0.00 55.97 52.88 2dhj s LYS 26 Cb -0.07 -3.63 0.07 0.00 -1.46 0.00 0.00 37.83 32.74 2dhj s LYS 26 CO 0.85 -1.01 0.71 0.54 0.16 0.00 0.00 175.35 176.61 2dhj n ARG 27 N 4.72 -4.10 -4.11 4.03 1.74 -1.26 -4.96 116.66 112.72 2dhj n ARG 27 Ca -0.06 0.48 -0.30 0.00 -0.77 0.00 0.00 57.85 57.19 2dhj n ARG 27 Cb 0.42 -5.04 -0.08 0.00 -1.02 0.00 0.00 32.46 26.74 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 -3.56 4.18 0.00 1.55 -7.23 -1.26 -5.11 120.40 108.97 2dhj s VAL 28 Ca 0.39 -0.90 0.00 0.00 -1.81 0.00 0.00 61.98 59.66 2dhj s VAL 28 Cb -0.20 -2.99 0.00 0.00 0.56 0.00 0.00 36.38 33.74 2dhj s VAL 28 CO 0.87 0.14 0.00 0.61 -0.31 0.00 0.00 175.10 176.41 2dhj n GLY 29 N 0.59 0.26 0.97 2.32 0.00 -1.26 -5.07 105.19 103.00 2dhj n GLY 29 Ca -0.10 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.87 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 3.75 0.08 3.90 -0.02 0.00 -1.26 -5.10 105.19 106.53 2dhj n GLY 30 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 2dhj n GLY 30 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dhj s SER 31 N -3.80 5.14 -0.09 1.61 1.04 -1.26 -5.08 113.70 111.26 2dhj s SER 31 Ca 0.00 0.89 -0.01 0.00 0.48 0.00 0.00 55.95 57.31 2dhj s SER 31 Cb 0.00 -1.61 -0.03 0.00 0.10 0.00 0.00 66.02 64.48 2dhj s SER 31 CO 0.00 -1.48 -0.05 -0.63 0.98 0.00 0.00 173.24 172.06 2dhj s ILE 32 N -3.35 3.88 0.22 -1.02 1.01 -1.26 -5.08 121.20 115.61 2dhj s ILE 32 Ca 0.59 -0.40 -0.32 0.00 0.00 0.00 0.00 60.65 60.51 2dhj s ILE 32 Cb -0.11 -2.62 -0.13 0.00 0.01 0.00 0.00 42.46 39.61 2dhj s ILE 32 CO 0.49 0.58 1.51 0.54 0.00 0.00 0.00 174.94 178.06 2dhj n ARG 33 N 2.42 2.20 -0.94 2.79 1.74 -1.26 -4.98 116.66 118.63 2dhj n ARG 33 Ca -0.18 0.79 -0.27 0.00 -0.77 0.00 0.00 57.85 57.42 2dhj n ARG 33 Cb 0.53 -2.51 0.23 0.00 -1.02 0.00 0.00 32.46 29.69 2dhj n ARG 33 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 2dhj n PRO 34 N 2.61 -2.95 -1.50 5.56 -0.04 -1.26 -4.88 135.00 132.54 2dhj n PRO 34 Ca 0.13 -1.58 -0.55 0.00 -0.04 0.00 0.00 63.50 61.46 2dhj n PRO 34 Cb 0.31 -1.48 -0.06 0.00 -0.04 0.00 0.00 33.50 32.23 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 -4.64 0.62 -3.96 0.54 7.02 -1.26 -4.90 117.44 110.86 2dhj n TRP 35 Ca 0.14 0.95 -0.35 0.00 -1.02 0.00 0.00 57.50 57.22 2dhj n TRP 35 Cb 0.53 -2.12 -0.14 0.00 -2.42 0.00 0.00 31.31 27.16 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 -0.16 3.05 -0.52 -0.99 1.02 -0.97 -4.95 119.74 116.21 2dhj s LYS 36 Ca 0.83 -0.83 -0.22 0.00 0.02 0.00 0.00 55.97 55.77 2dhj s LYS 36 Cb -1.13 -2.94 0.04 0.00 -0.52 0.00 0.00 37.83 33.28 2dhj s LYS 36 CO 0.55 -0.30 0.82 -1.14 -0.92 0.00 0.00 175.35 174.36 2dhj s GLN 37 N 1.38 3.27 -0.05 1.68 0.74 -1.26 0.91 119.66 126.33 2dhj s GLN 37 Ca 0.03 -0.44 -0.05 0.00 0.05 0.00 0.00 55.36 54.95 2dhj s GLN 37 Cb -0.15 -4.05 0.01 0.00 1.10 0.00 0.00 33.01 29.92 2dhj s GLN 37 CO -0.05 -1.35 0.14 0.00 -0.55 0.00 0.00 175.29 173.48 2dhj s MET 38 N 3.44 0.16 -0.40 1.67 0.23 -1.08 -4.95 119.30 118.36 2dhj s MET 38 Ca 0.25 0.20 -0.36 0.00 -1.03 0.00 0.00 55.69 54.76 2dhj s MET 38 Cb -0.15 0.07 -0.13 0.00 -1.53 0.00 0.00 34.83 33.09 2dhj s MET 38 CO 0.17 -0.03 2.22 0.98 -2.03 0.00 0.00 175.02 176.33 2dhj n TYR 39 N 3.07 1.49 -3.66 3.16 9.36 0.21 -3.80 117.16 126.98 2dhj n TYR 39 Ca -0.13 0.33 -0.36 0.00 3.32 0.00 0.00 57.90 61.06 2dhj n TYR 39 Cb 0.59 -2.50 -0.09 0.00 -0.63 0.00 0.00 39.34 36.71 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 7.44 5.37 -0.03 2.97 1.01 -0.96 0.11 120.40 136.31 2dhj s VAL 40 Ca 1.12 0.25 0.07 0.00 0.00 0.00 0.00 61.98 63.41 2dhj s VAL 40 Cb -0.92 -3.51 -0.02 0.00 0.00 0.00 0.00 36.38 31.93 2dhj s VAL 40 CO 0.50 0.38 -0.25 -0.69 0.00 0.00 0.00 175.10 175.04 2dhj s VAL 41 N 0.75 1.99 -0.37 2.92 1.01 0.16 -2.42 120.40 124.44 2dhj s VAL 41 Ca 0.09 -1.06 -0.05 0.00 0.00 0.00 0.00 61.98 60.96 2dhj s VAL 41 Cb -0.13 -1.67 0.07 0.00 0.00 0.00 0.00 36.38 34.66 2dhj s VAL 41 CO 0.02 0.56 0.14 -0.22 0.00 0.00 0.00 175.10 175.60 2dhj s LEU 42 N -0.42 4.67 -0.37 3.92 2.96 -0.14 0.55 118.68 129.84 2dhj s LEU 42 Ca 0.05 -1.52 -0.04 0.00 -0.22 0.00 0.00 54.13 52.40 2dhj s LEU 42 Cb -0.11 -1.84 0.08 0.00 0.50 0.00 0.00 46.19 44.81 2dhj s LEU 42 CO 0.01 -0.42 0.13 -0.13 -1.32 0.00 0.00 176.35 174.62 2dhj s ARG 43 N 1.29 2.30 3.77 1.98 0.52 -0.12 -0.82 118.95 127.88 2dhj s ARG 43 Ca 0.01 -1.51 0.00 0.00 -0.52 0.00 0.00 55.73 53.71 2dhj s ARG 43 Cb -0.21 -3.47 0.00 0.00 0.52 0.00 0.00 34.95 31.79 2dhj s ARG 43 CO -0.00 -0.86 0.00 0.41 0.02 0.00 0.00 175.30 174.87 2dhj n GLY 44 N 4.67 1.03 0.06 -3.53 0.00 -1.26 -1.64 105.19 104.53 2dhj n GLY 44 Ca -0.08 0.35 0.02 0.00 0.00 0.00 0.00 46.02 46.31 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 -4.90 1.61 8.25 -1.26 -4.81 115.22 114.10 2dhj n HIS 45 Ca 0.00 -0.44 -0.29 0.00 -0.26 0.00 0.00 57.72 56.74 2dhj n HIS 45 Cb 0.00 -0.06 -0.15 0.00 1.12 0.00 0.00 29.99 30.90 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 -1.15 2.90 -0.34 0.41 0.01 -0.65 0.15 113.70 115.03 2dhj s SER 46 Ca 0.07 -0.54 -0.08 0.00 1.31 0.00 0.00 55.95 56.71 2dhj s SER 46 Cb 0.06 -0.27 0.02 0.00 0.21 0.00 0.00 66.02 66.04 2dhj s SER 46 CO 0.01 0.24 0.14 -0.76 0.41 0.00 0.00 173.24 173.28 2dhj s LEU 47 N -1.07 4.32 -0.35 2.44 1.43 -0.07 -0.94 118.68 124.45 2dhj s LEU 47 Ca 0.10 -0.93 -0.11 0.00 -1.03 0.00 0.00 54.13 52.16 2dhj s LEU 47 Cb -0.09 -1.94 0.01 0.00 0.03 0.00 0.00 46.19 44.20 2dhj s LEU 47 CO 0.01 -0.30 0.20 -0.31 0.23 0.00 0.00 176.35 176.19 2dhj s TYR 48 N 1.50 3.22 0.21 0.29 2.02 0.19 -2.77 117.35 122.01 2dhj s TYR 48 Ca 0.01 -0.64 0.01 0.00 -0.37 0.00 0.00 57.07 56.08 2dhj s TYR 48 Cb -0.19 -2.43 -0.04 0.00 -0.40 0.00 0.00 41.96 38.90 2dhj s TYR 48 CO 0.04 -0.52 0.38 -0.51 -1.57 0.00 0.00 175.55 173.37 2dhj s LEU 49 N 1.62 4.24 -0.06 -1.29 1.02 -1.26 0.36 118.68 123.31 2dhj s LEU 49 Ca 0.04 0.30 -0.04 0.00 0.02 0.00 0.00 54.13 54.45 2dhj s LEU 49 Cb -0.18 -3.07 0.03 0.00 0.02 0.00 0.00 46.19 42.98 2dhj s LEU 49 CO 0.08 -0.06 0.15 -0.31 0.02 0.00 0.00 176.35 176.23 2dhj s TYR 50 N -1.91 -0.17 0.47 0.29 1.51 0.30 -4.48 117.35 113.35 2dhj s TYR 50 Ca 0.37 0.45 0.32 0.00 -1.01 0.00 0.00 57.07 57.20 2dhj s TYR 50 Cb -0.10 -0.01 1.73 0.00 -0.11 0.00 0.00 41.96 43.46 2dhj s TYR 50 CO 0.30 -0.13 2.16 1.57 -1.11 0.00 0.00 175.55 178.34 2dhj h LYS 51 N 6.60 0.00 -4.85 -0.62 2.10 -1.92 0.59 116.57 118.48 2dhj h LYS 51 Ca -0.34 0.00 -0.46 0.00 -2.00 0.00 0.00 60.65 57.85 2dhj h LYS 51 Cb 1.17 0.00 -0.13 0.00 -0.90 0.00 0.00 32.23 32.37 2dhj h LYS 51 CO 0.42 0.06 -0.46 -0.51 -2.00 0.00 0.00 179.45 176.96 2dhj s ASP 52 N -5.89 1.65 -0.40 7.07 1.01 -1.26 -4.67 116.67 114.18 2dhj s ASP 52 Ca -0.03 -1.75 0.03 0.00 0.71 0.00 0.00 52.55 51.51 2dhj s ASP 52 Cb 0.13 0.57 0.53 0.00 1.01 0.00 0.00 42.92 45.15 2dhj s ASP 52 CO 0.54 -1.09 1.80 1.17 0.21 0.00 0.00 175.17 177.80 2dhj n LYS 53 N -0.63 2.08 -1.29 8.23 4.81 -1.26 -4.61 118.16 125.50 2dhj n LYS 53 Ca 0.07 -2.51 -0.30 0.00 -0.87 0.00 0.00 58.31 54.70 2dhj n LYS 53 Cb 0.62 -1.99 0.12 0.00 0.02 0.00 0.00 35.03 33.80 2dhj n LYS 53 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 2dhj s ARG 54 N -2.78 1.63 -0.45 1.64 0.52 -1.26 -4.83 118.95 113.42 2dhj s ARG 54 Ca 0.48 0.85 -0.41 0.00 -0.52 0.00 0.00 55.73 56.13 2dhj s ARG 54 Cb 0.40 -1.85 -0.18 0.00 0.52 0.00 0.00 34.95 33.84 2dhj s ARG 54 CO 0.08 -1.99 1.57 0.39 0.02 0.00 0.00 175.30 175.36 2dhj n GLU 55 N -3.72 0.00 -0.32 3.54 1.02 -1.26 -4.76 120.64 115.14 2dhj n GLU 55 Ca 0.07 0.00 -0.04 0.00 -0.02 0.00 0.00 57.16 57.17 2dhj n GLU 55 Cb 0.55 -1.34 0.07 0.00 -0.02 0.00 0.00 31.44 30.70 2dhj n GLU 55 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2dhj n GLN 56 N 4.48 1.58 0.00 3.49 3.00 -1.26 -4.14 117.38 124.52 2dhj n GLN 56 Ca 0.34 -0.87 0.09 0.00 -0.01 0.00 0.00 57.00 56.55 2dhj n GLN 56 Cb -0.05 -1.45 0.44 0.00 0.00 0.00 0.00 30.24 29.18 2dhj n GLN 56 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.06 177.31 2dhj n THR 57 N 0.08 0.58 -4.29 5.09 -2.24 -1.26 -4.75 114.28 107.48 2dhj n THR 57 Ca 0.14 0.15 -0.19 0.00 -2.27 0.00 0.00 64.05 61.88 2dhj n THR 57 Cb 0.74 -0.83 -0.11 0.00 -2.10 0.00 0.00 70.33 68.04 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 -2.80 1.58 1.16 4.28 -4.23 -1.26 -5.15 115.64 109.22 2dhj s THR 58 Ca 0.13 -1.90 -0.18 0.00 -1.18 0.00 0.00 61.69 58.56 2dhj s THR 58 Cb 0.12 -1.76 0.27 0.00 1.34 0.00 0.00 72.50 72.48 2dhj s THR 58 CO 0.32 -0.43 1.11 -2.16 -0.54 0.00 0.00 174.62 172.92 2dhj s PRO 59 N -2.95 -0.92 0.01 3.99 0.04 -1.26 -4.87 135.00 129.05 2dhj s PRO 59 Ca 0.14 0.04 -0.33 0.00 0.04 0.00 0.00 61.00 60.89 2dhj s PRO 59 Cb -0.04 -1.62 -0.17 0.00 0.04 0.00 0.00 34.50 32.71 2dhj s PRO 59 CO 0.05 -3.53 0.87 -1.13 0.04 0.00 0.00 177.00 173.30 2dhj n SER 60 N -4.65 -0.10 0.12 6.66 3.41 -1.26 -4.88 113.62 112.92 2dhj n SER 60 Ca 0.12 0.98 -0.05 0.00 -0.26 0.00 0.00 58.87 59.66 2dhj n SER 60 Cb 0.59 -0.78 -0.02 0.00 -0.26 0.00 0.00 64.21 63.74 2dhj n SER 60 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2dhj h GLU 61 N 2.40 -0.29 0.00 4.33 5.08 -1.90 -3.43 114.58 120.77 2dhj h GLU 61 Ca -0.42 0.02 -0.21 0.00 -1.00 0.00 0.00 59.36 57.75 2dhj h GLU 61 Cb 1.21 0.07 -0.03 0.00 0.50 0.00 0.00 28.75 30.50 2dhj h GLU 61 CO 0.55 -0.19 -1.61 -0.85 -1.00 0.00 0.00 179.01 175.90 2dhj n GLU 62 N -2.87 0.34 -0.51 2.33 0.28 -1.26 -5.03 120.64 113.92 2dhj n GLU 62 Ca -0.04 0.15 -0.29 0.00 -0.16 0.00 0.00 57.16 56.82 2dhj n GLU 62 Cb 0.12 -1.07 0.24 0.00 1.43 0.00 0.00 31.44 32.16 2dhj n GLU 62 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 2dhj n GLU 63 N -3.81 -2.17 -4.13 3.44 4.71 -1.26 -5.03 120.64 112.38 2dhj n GLU 63 Ca -0.27 -0.60 -0.28 0.00 -0.01 0.00 0.00 57.16 56.00 2dhj n GLU 63 Cb 0.63 -2.18 -0.07 0.00 -1.01 0.00 0.00 31.44 28.81 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 -4.39 2.60 0.43 3.49 0.00 -1.26 -4.62 119.66 115.91 2dhj s GLN 64 Ca 0.68 -0.91 -0.24 0.00 -0.00 0.00 0.00 55.36 54.89 2dhj s GLN 64 Cb -0.25 -2.52 -0.08 0.00 0.00 0.00 0.00 33.01 30.16 2dhj s GLN 64 CO 0.64 0.51 1.18 -1.25 0.00 0.00 0.00 175.29 176.37 2dhj s PRO 65 N -2.66 3.92 -0.28 9.60 0.04 -1.26 -4.91 135.00 139.45 2dhj s PRO 65 Ca 0.28 1.84 -0.05 0.00 0.04 0.00 0.00 61.00 63.10 2dhj s PRO 65 Cb -0.11 -2.56 0.02 0.00 0.04 0.00 0.00 34.50 31.89 2dhj s PRO 65 CO 0.20 -0.44 0.04 0.42 0.04 0.00 0.00 177.00 177.26 2dhj s ILE 66 N -1.46 3.58 -0.58 0.56 1.01 -1.11 -4.90 121.20 118.30 2dhj s ILE 66 Ca 0.60 -0.86 -0.27 0.00 0.00 0.00 0.00 60.65 60.11 2dhj s ILE 66 Cb -0.30 -2.86 0.00 0.00 0.01 0.00 0.00 42.46 39.30 2dhj s ILE 66 CO 0.38 0.08 1.59 -0.55 0.00 0.00 0.00 174.94 176.44 2dhj s SER 67 N 1.43 5.82 0.05 3.58 0.15 -1.26 -0.89 113.70 122.58 2dhj s SER 67 Ca 0.01 0.32 0.16 0.00 0.70 0.00 0.00 55.95 57.14 2dhj s SER 67 Cb -0.17 -2.54 0.69 0.00 -1.71 0.00 0.00 66.02 62.29 2dhj s SER 67 CO 0.00 -1.95 1.51 1.33 1.20 0.00 0.00 173.24 175.33 2dhj n VAL 68 N 6.98 0.97 -1.41 4.45 0.24 0.39 -4.55 118.33 125.40 2dhj n VAL 68 Ca 0.15 0.25 -0.49 0.00 -2.04 0.00 0.00 64.34 62.21 2dhj n VAL 68 Cb 0.50 -1.04 -0.11 0.00 -1.47 0.00 0.00 33.84 31.72 2dhj n VAL 68 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 2dhj n ASN 69 N -1.65 1.00 -1.74 -1.34 5.15 -1.16 0.05 115.26 115.58 2dhj n ASN 69 Ca 0.03 0.33 -0.06 0.00 -0.60 0.00 0.00 54.58 54.29 2dhj n ASN 69 Cb 0.18 -1.04 0.03 0.00 -0.53 0.00 0.00 39.78 38.41 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 9.87 -0.62 -2.00 5.20 0.00 -1.26 -4.84 120.51 126.87 2dhj n ALA 70 Ca 0.55 -0.01 -0.19 0.00 0.00 0.00 0.00 53.44 53.79 2dhj n ALA 70 Cb 0.09 -1.19 0.02 0.00 0.00 0.00 0.00 19.45 18.38 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 -4.52 1.99 0.04 0.00 0.20 -0.84 -4.96 118.68 110.59 2dhj s LEU 72 Ca 0.56 -0.76 0.01 0.00 0.69 0.00 0.00 54.13 54.63 2dhj s LEU 72 Cb -0.10 -1.12 -0.04 0.00 -0.43 0.00 0.00 46.19 44.50 2dhj s LEU 72 CO 0.35 -0.15 0.08 -0.63 -0.29 0.00 0.00 176.35 175.72 2dhj s ILE 73 N 1.48 4.65 -0.29 6.68 1.01 -1.26 -1.06 121.20 132.42 2dhj s ILE 73 Ca 0.00 -0.57 -0.14 0.00 0.00 0.00 0.00 60.65 59.94 2dhj s ILE 73 Cb -0.15 -3.18 0.12 0.00 0.01 0.00 0.00 42.46 39.25 2dhj s ILE 73 CO -0.08 0.24 0.77 -1.81 0.00 0.00 0.00 174.94 174.06 2dhj s ASP 74 N -2.06 -0.89 -0.89 3.58 1.01 0.14 -4.97 116.67 112.58 2dhj s ASP 74 Ca 0.26 1.31 -0.23 0.00 0.71 0.00 0.00 52.55 54.61 2dhj s ASP 74 Cb -0.12 1.72 -0.22 0.00 1.01 0.00 0.00 42.92 45.31 2dhj s ASP 74 CO 0.18 -0.19 2.45 -0.38 0.21 0.00 0.00 175.17 177.43 2dhj n ILE 75 N 4.71 -0.01 -0.93 0.77 5.41 -1.26 0.09 119.36 128.14 2dhj n ILE 75 Ca -0.15 -0.35 -0.29 0.00 1.00 0.00 0.00 62.75 62.96 2dhj n ILE 75 Cb 0.54 -0.90 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 10.85 -2.83 -3.89 4.38 2.88 -0.89 -4.77 113.62 119.35 2dhj n SER 76 Ca 0.60 0.48 -0.25 0.00 -1.33 0.00 0.00 58.87 58.37 2dhj n SER 76 Cb 0.20 -0.63 0.13 0.00 -0.75 0.00 0.00 64.21 63.16 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 -1.16 -1.84 -0.05 0.66 4.11 -1.26 -4.90 117.16 112.71 2dhj n TYR 77 Ca 0.06 0.17 -0.07 0.00 -0.00 0.00 0.00 57.90 58.05 2dhj n TYR 77 Cb 0.36 -1.44 -0.14 0.00 -0.00 0.00 0.00 39.34 38.11 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 -0.54 0.42 -0.31 9.48 3.41 -1.26 -4.36 113.62 120.46 2dhj n SER 78 Ca 0.03 0.20 0.14 0.00 -0.26 0.00 0.00 58.87 58.97 2dhj n SER 78 Cb 0.48 0.57 0.27 0.00 -0.26 0.00 0.00 64.21 65.27 2dhj n SER 78 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 2dhj n GLU 79 N -2.85 -0.07 -1.67 4.33 4.07 -1.26 -4.42 120.64 118.77 2dhj n GLU 79 Ca -0.23 1.33 -0.44 0.00 -0.06 0.00 0.00 57.16 57.77 2dhj n GLU 79 Cb 1.05 -2.13 -0.02 0.00 -0.06 0.00 0.00 31.44 30.29 2dhj n GLU 79 CO 0.00 0.00 0.00 -2.37 -0.06 0.00 0.00 177.13 174.70 2dhj n THR 80 N -5.29 1.57 -0.73 6.31 5.66 -1.26 -4.82 114.28 115.72 2dhj n THR 80 Ca 0.21 -0.39 -0.07 0.00 -3.05 0.00 0.00 64.05 60.75 2dhj n THR 80 Cb 0.70 -1.42 -0.10 0.00 -1.55 0.00 0.00 70.33 67.96 2dhj n THR 80 CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 175.07 173.19 2dhj n LYS 81 N 1.17 1.46 -3.74 1.09 4.81 -1.26 -4.73 118.16 116.95 2dhj n LYS 81 Ca 0.08 -0.59 -0.13 0.00 -0.87 0.00 0.00 58.31 56.80 2dhj n LYS 81 Cb 0.33 -1.65 -0.14 0.00 0.02 0.00 0.00 35.03 33.59 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 0.94 0.12 -0.01 1.64 0.52 -1.26 -5.15 118.95 115.74 2dhj s ARG 82 Ca 0.39 0.42 -0.04 0.00 -0.52 0.00 0.00 55.73 55.98 2dhj s ARG 82 Cb 0.19 -0.17 -0.04 0.00 0.52 0.00 0.00 34.95 35.45 2dhj s ARG 82 CO 0.00 -0.17 0.21 0.15 0.02 0.00 0.00 175.30 175.51 2dhj s LYS 83 N 1.24 3.48 -0.57 3.54 1.02 -1.26 -4.42 119.74 122.78 2dhj s LYS 83 Ca -0.09 -0.23 -0.03 0.00 0.02 0.00 0.00 55.97 55.64 2dhj s LYS 83 Cb -0.11 -3.10 0.00 0.00 -0.52 0.00 0.00 37.83 34.10 2dhj s LYS 83 CO -0.07 0.67 0.50 0.09 -0.92 0.00 0.00 175.35 175.62 2dhj n ASN 84 N 1.07 -3.68 -4.37 2.83 3.02 -1.26 -4.67 115.26 108.19 2dhj n ASN 84 Ca -0.12 -0.23 -0.33 0.00 -0.03 0.00 0.00 54.58 53.87 2dhj n ASN 84 Cb 0.53 -2.43 -0.14 0.00 -0.61 0.00 0.00 39.78 37.13 2dhj n ASN 84 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2dhj s VAL 85 N -3.14 3.15 0.01 2.41 0.11 -1.26 -2.03 120.40 119.66 2dhj s VAL 85 Ca 0.23 -0.62 0.04 0.00 -2.93 0.00 0.00 61.98 58.69 2dhj s VAL 85 Cb -0.10 -2.34 -0.03 0.00 -1.53 0.00 0.00 36.38 32.37 2dhj s VAL 85 CO 0.31 0.51 -0.07 0.72 -3.33 0.00 0.00 175.10 173.24 2dhj s PHE 86 N 0.50 2.87 -0.20 1.54 -0.71 0.10 -2.09 117.98 119.99 2dhj s PHE 86 Ca -0.08 -0.05 -0.09 0.00 -1.04 0.00 0.00 56.93 55.67 2dhj s PHE 86 Cb -0.15 -1.60 -0.04 0.00 -1.21 0.00 0.00 43.02 40.01 2dhj s PHE 86 CO 0.04 0.37 0.10 0.50 -1.34 0.00 0.00 175.22 174.89 2dhj s ARG 87 N -1.45 4.05 -0.04 1.99 3.52 0.11 -1.02 118.95 126.11 2dhj s ARG 87 Ca 0.17 -0.29 0.06 0.00 -0.13 0.00 0.00 55.73 55.53 2dhj s ARG 87 Cb -0.11 -3.35 -0.01 0.00 -1.56 0.00 0.00 34.95 29.93 2dhj s ARG 87 CO 0.08 0.23 -0.21 -1.17 -0.81 0.00 0.00 175.30 173.41 2dhj s LEU 88 N 0.54 2.00 -0.18 -0.88 0.20 -0.79 0.26 118.68 119.83 2dhj s LEU 88 Ca 0.06 -0.43 0.01 0.00 0.69 0.00 0.00 54.13 54.45 2dhj s LEU 88 Cb -0.12 -1.17 0.04 0.00 -0.43 0.00 0.00 46.19 44.51 2dhj s LEU 88 CO 0.00 0.22 -0.10 -0.89 -0.29 0.00 0.00 176.35 175.29 2dhj s THR 89 N -0.16 1.53 0.14 3.68 2.01 -0.22 -1.95 115.64 120.66 2dhj s THR 89 Ca -0.01 -0.88 0.03 0.00 0.31 0.00 0.00 61.69 61.15 2dhj s THR 89 Cb -0.12 -1.60 -0.04 0.00 0.01 0.00 0.00 72.50 70.76 2dhj s THR 89 CO 0.02 0.20 0.17 0.42 -0.69 0.00 0.00 174.62 174.75 2dhj s THR 90 N 1.46 4.81 0.49 -0.82 -4.23 -0.57 -1.98 115.64 114.80 2dhj s THR 90 Ca 0.00 -0.85 0.26 0.00 -1.18 0.00 0.00 61.69 59.92 2dhj s THR 90 Cb -0.15 -3.43 0.44 0.00 1.34 0.00 0.00 72.50 70.70 2dhj s THR 90 CO -0.08 -0.04 1.88 -1.28 -0.54 0.00 0.00 174.62 174.56 2dhj h SER 91 N 2.55 0.15 0.29 3.99 0.87 -1.84 -2.49 113.55 117.07 2dhj h SER 91 Ca -0.47 0.02 -0.01 0.00 -1.23 0.00 0.00 61.79 60.09 2dhj h SER 91 Cb 1.19 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.14 2dhj h SER 91 CO 0.66 0.06 -0.14 0.44 -0.53 0.00 0.00 176.83 177.32 2dhj h ASP 92 N 0.15 -0.32 -5.24 6.23 5.19 -1.94 -3.49 116.42 117.00 2dhj h ASP 92 Ca 0.43 0.01 -0.09 0.00 -0.62 0.00 0.00 57.03 56.76 2dhj h ASP 92 Cb 1.46 0.08 -0.06 0.00 0.18 0.00 0.00 39.33 41.00 2dhj h ASP 92 CO -0.07 -0.00 -0.02 0.00 -3.12 0.00 0.00 179.24 176.03 2dhj s GLU 94 N -3.39 3.16 -0.04 0.00 8.01 -1.26 -1.51 118.70 123.67 2dhj s GLU 94 Ca 0.22 -0.71 -0.29 0.00 0.01 0.00 0.00 54.97 54.19 2dhj s GLU 94 Cb -0.02 -2.81 0.11 0.00 -4.31 0.00 0.00 34.13 27.09 2dhj s GLU 94 CO 0.12 0.51 0.92 0.00 0.01 0.00 0.00 175.26 176.83 2dhj s LEU 96 N -2.25 3.39 -0.16 0.00 1.43 0.02 -1.88 118.68 119.24 2dhj s LEU 96 Ca 0.04 -0.68 -0.07 0.00 -1.03 0.00 0.00 54.13 52.39 2dhj s LEU 96 Cb -0.01 -1.94 0.07 0.00 0.03 0.00 0.00 46.19 44.34 2dhj s LEU 96 CO -0.07 -0.38 0.35 -0.36 0.23 0.00 0.00 176.35 176.13 2dhj s PHE 97 N -2.40 -0.58 0.17 0.29 0.08 -0.19 -3.00 117.98 112.36 2dhj s PHE 97 Ca 0.40 1.21 0.09 0.00 0.12 0.00 0.00 56.93 58.75 2dhj s PHE 97 Cb -0.03 0.17 -0.04 0.00 -0.57 0.00 0.00 43.02 42.55 2dhj s PHE 97 CO 0.25 -0.37 -0.12 -1.14 -0.10 0.00 0.00 175.22 173.74 2dhj s GLN 98 N 1.99 1.98 0.42 0.44 0.74 -1.22 0.03 119.66 124.04 2dhj s GLN 98 Ca -0.05 -1.27 0.04 0.00 0.05 0.00 0.00 55.36 54.14 2dhj s GLN 98 Cb -0.11 -2.13 -0.05 0.00 1.10 0.00 0.00 33.01 31.82 2dhj s GLN 98 CO -0.11 0.44 0.04 0.00 -0.55 0.00 0.00 175.29 175.11 2dhj s ALA 99 N -1.61 3.25 -0.08 1.58 0.00 -0.86 -3.75 121.76 120.29 2dhj s ALA 99 Ca 0.23 -1.51 -0.04 0.00 0.00 0.00 0.00 51.96 50.64 2dhj s ALA 99 Cb -0.09 0.32 -0.02 0.00 0.00 0.00 0.00 23.12 23.33 2dhj s ALA 99 CO 0.14 -0.16 0.16 0.93 0.00 0.00 0.00 175.76 176.83 2dhj h GLU 100 N 1.72 -0.14 -6.02 0.00 5.08 -1.88 -3.46 114.58 109.88 2dhj h GLU 100 Ca -0.42 0.01 -0.56 0.00 -1.00 0.00 0.00 59.36 57.39 2dhj h GLU 100 Cb 1.27 0.03 -0.14 0.00 0.50 0.00 0.00 28.75 30.40 2dhj h GLU 100 CO 0.73 -0.09 -0.76 0.34 -1.00 0.00 0.00 179.01 178.24 2dhj s ASP 101 N -5.39 3.24 0.08 1.42 -1.08 -1.26 -5.00 116.67 108.68 2dhj s ASP 101 Ca -0.02 -1.01 -0.17 0.00 -0.52 0.00 0.00 52.55 50.83 2dhj s ASP 101 Cb 0.00 -0.24 -0.04 0.00 -1.46 0.00 0.00 42.92 41.18 2dhj s ASP 101 CO 0.06 -0.02 1.29 -0.09 0.52 0.00 0.00 175.17 176.93 2dhj h ARG 102 N 2.44 -0.04 -0.93 4.34 2.43 -1.94 0.80 114.38 121.47 2dhj h ARG 102 Ca -0.40 0.00 0.15 0.00 -0.81 0.00 0.00 59.98 58.93 2dhj h ARG 102 Cb 1.24 0.01 -0.16 0.00 -0.42 0.00 0.00 29.97 30.65 2dhj h ARG 102 CO 0.60 -0.02 -0.34 -0.25 -1.51 0.00 0.00 179.97 178.45 2dhj n ASP 103 N -4.17 -0.55 -0.36 -3.80 9.92 -1.26 0.15 116.55 116.47 2dhj n ASP 103 Ca 0.01 1.63 0.00 0.00 -0.53 0.00 0.00 54.79 55.89 2dhj n ASP 103 Cb 0.15 -0.40 0.15 0.00 -0.64 0.00 0.00 41.12 40.37 2dhj n ASP 103 CO 0.00 0.00 0.00 0.44 0.13 0.00 0.00 177.20 177.77 2dhj h ASP 104 N 0.00 1.09 0.35 -2.24 5.19 -1.35 0.15 116.42 119.60 2dhj h ASP 104 Ca 0.35 -0.01 -0.02 0.00 -0.62 0.00 0.00 57.03 56.73 2dhj h ASP 104 Cb 0.59 -0.25 0.00 0.00 0.18 0.00 0.00 39.33 39.84 2dhj h ASP 104 CO -0.94 0.75 -0.17 -0.03 -3.12 0.00 0.00 179.24 175.74 2dhj h MET 105 N 1.27 -0.45 0.23 3.56 4.05 0.33 -2.79 114.93 121.13 2dhj h MET 105 Ca 0.39 0.03 -0.01 0.00 -0.28 0.00 0.00 59.70 59.83 2dhj h MET 105 Cb -0.03 0.10 0.00 0.00 -0.80 0.00 0.00 31.60 30.88 2dhj h MET 105 CO -0.11 -0.20 -0.11 -0.07 0.23 0.00 0.00 176.91 176.64 2dhj h LEU 106 N -0.63 -0.26 -0.92 3.39 4.07 -0.57 -2.82 115.31 117.57 2dhj h LEU 106 Ca -0.05 -0.02 0.17 0.00 0.08 0.00 0.00 57.88 58.07 2dhj h LEU 106 Cb 0.45 0.07 -0.17 0.00 1.08 0.00 0.00 40.66 42.09 2dhj h LEU 106 CO 0.08 -0.15 -0.28 0.00 -1.08 0.00 0.00 178.44 177.00 2dhj h ALA 107 N 0.43 0.44 0.60 1.53 0.00 -0.74 -0.93 119.26 120.59 2dhj h ALA 107 Ca -0.03 0.32 -0.02 0.00 0.00 0.00 0.00 54.91 55.18 2dhj h ALA 107 Cb 0.26 0.80 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 2dhj h ALA 107 CO 0.05 -0.47 -0.42 -1.49 0.00 0.00 0.00 179.25 176.92 2dhj h TRP 108 N -0.01 -1.13 -0.96 0.00 4.06 -1.33 -1.95 115.95 114.63 2dhj h TRP 108 Ca 0.40 -0.01 0.15 0.00 2.06 0.00 0.00 58.89 61.50 2dhj h TRP 108 Cb 0.65 0.41 -0.16 0.00 -1.00 0.00 0.00 29.16 29.06 2dhj h TRP 108 CO -0.76 -0.60 -0.38 0.82 -3.56 0.00 0.00 178.44 173.96 2dhj h ILE 109 N -0.97 0.02 0.13 1.49 2.04 -0.97 -0.65 117.51 118.60 2dhj h ILE 109 Ca -0.08 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.78 2dhj h ILE 109 Cb 0.79 0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 36.88 2dhj h ILE 109 CO 0.05 0.00 -0.20 0.50 0.00 0.00 0.00 178.15 178.50 2dhj h LYS 110 N -0.02 -0.33 -0.71 2.37 3.64 -1.09 0.34 116.57 120.77 2dhj h LYS 110 Ca 0.34 0.02 0.07 0.00 -1.27 0.00 0.00 60.65 59.81 2dhj h LYS 110 Cb 0.60 0.08 -0.09 0.00 -0.41 0.00 0.00 32.23 32.40 2dhj h LYS 110 CO -0.96 -0.22 -0.45 1.15 -2.27 0.00 0.00 179.45 176.69 2dhj h THR 111 N -0.35 0.00 0.27 1.00 2.02 -0.50 0.32 112.91 115.67 2dhj h THR 111 Ca -0.02 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.16 2dhj h THR 111 Cb 0.32 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 66.71 2dhj h THR 111 CO -0.06 0.00 -0.34 0.40 0.37 0.00 0.00 175.52 175.89 2dhj h ILE 112 N -0.04 0.00 -1.03 3.11 2.04 -1.08 -1.05 117.51 119.46 2dhj h ILE 112 Ca 0.11 0.00 0.37 0.00 1.00 0.00 0.00 64.86 66.35 2dhj h ILE 112 Cb 0.34 0.00 -0.16 0.00 -0.74 0.00 0.00 36.82 36.26 2dhj h ILE 112 CO -0.69 0.00 0.59 1.56 0.00 0.00 0.00 178.15 179.61 2dhj h GLN 113 N -0.63 0.16 -0.34 2.37 4.20 0.32 0.71 115.11 121.89 2dhj h GLN 113 Ca -0.03 -0.01 -0.06 0.00 0.06 0.00 0.00 58.65 58.61 2dhj h GLN 113 Cb 0.57 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.30 2dhj h GLN 113 CO -0.08 0.10 -0.02 0.93 -0.67 0.00 0.00 178.83 179.10 2dhj h GLU 114 N 0.16 0.61 -0.80 1.46 4.39 0.36 0.29 114.58 121.06 2dhj h GLU 114 Ca 0.79 -0.20 0.01 0.00 0.34 0.00 0.00 59.36 60.30 2dhj h GLU 114 Cb 2.01 -0.05 -0.04 0.00 -0.10 0.00 0.00 28.75 30.57 2dhj h GLU 114 CO -0.65 0.75 0.53 0.77 -1.16 0.00 0.00 179.01 179.24 2dhj h SER 115 N 0.41 0.90 0.22 1.42 0.02 0.16 -2.75 113.55 113.94 2dhj h SER 115 Ca 0.09 -0.02 -0.32 0.00 -0.84 0.00 0.00 61.79 60.70 2dhj h SER 115 Cb 0.48 -0.22 0.04 0.00 0.14 0.00 0.00 62.40 62.83 2dhj h SER 115 CO 0.02 0.65 -1.38 0.77 -1.14 0.00 0.00 176.83 175.75 2dhj h SER 116 N 1.07 0.83 -1.25 3.07 4.64 -1.08 -3.45 113.55 117.38 2dhj h SER 116 Ca 0.29 -0.91 -0.66 0.00 -0.47 0.00 0.00 61.79 60.05 2dhj h SER 116 Cb -0.10 -0.27 0.12 0.00 -0.31 0.00 0.00 62.40 61.84 2dhj h SER 116 CO -0.07 1.67 -0.57 -3.20 -0.87 0.00 0.00 176.83 173.79 2dhj n ASN 117 N -3.77 -1.43 -2.08 4.97 5.15 0.10 -4.03 115.26 114.17 2dhj n ASN 117 Ca -0.16 1.06 -0.17 0.00 -0.60 0.00 0.00 54.58 54.71 2dhj n ASN 117 Cb 1.06 -0.96 -0.06 0.00 -0.53 0.00 0.00 39.78 39.30 2dhj n ASN 117 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2dhj n LEU 118 N 2.01 5.99 -4.51 1.20 -0.00 -1.26 -4.97 117.00 115.46 2dhj n LEU 118 Ca 0.16 -3.42 -0.51 0.00 -0.00 0.00 0.00 56.01 52.25 2dhj n LEU 118 Cb 0.29 -1.23 -0.04 0.00 -0.00 0.00 0.00 43.42 42.44 2dhj n LEU 118 CO 0.56 1.50 0.47 0.59 -0.00 0.00 0.00 177.39 180.51 2dhj n ASN 119 N 1.26 0.31 -3.90 1.45 3.02 -1.26 -4.71 115.26 111.43 2dhj n ASN 119 Ca 0.36 1.15 -0.48 0.00 -0.03 0.00 0.00 54.58 55.57 2dhj n ASN 119 Cb 0.65 -1.08 -0.05 0.00 -0.61 0.00 0.00 39.78 38.68 2dhj n ASN 119 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 2dhj n SER 120 N 1.84 -0.38 -4.77 6.41 2.88 -1.26 -4.85 113.62 113.49 2dhj n SER 120 Ca 0.17 1.00 -0.37 0.00 -1.33 0.00 0.00 58.87 58.34 2dhj n SER 120 Cb 0.21 -0.81 -0.01 0.00 -0.75 0.00 0.00 64.21 62.85 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 -0.30 2.77 0.17 0.46 0.00 -1.26 -4.98 107.32 104.18 2dhj s GLY 121 Ca 0.71 0.91 -0.30 0.00 0.00 0.00 0.00 44.72 46.04 2dhj s GLY 121 CO 0.49 1.36 1.32 2.56 0.00 0.00 0.00 173.10 178.84 2dhj s PRO 122 N -2.70 4.38 0.86 2.90 0.04 -1.26 -5.03 135.00 134.18 2dhj s PRO 122 Ca 0.63 2.04 -0.10 0.00 0.04 0.00 0.00 61.00 63.62 2dhj s PRO 122 Cb -0.28 -3.21 0.16 0.00 0.04 0.00 0.00 34.50 31.21 2dhj s PRO 122 CO 0.34 -0.29 1.19 -1.12 0.04 0.00 0.00 177.00 177.16 2dhj s SER 123 N 0.53 3.69 0.78 6.66 0.01 -1.26 -5.06 113.70 119.05 2dhj s SER 123 Ca 0.58 0.09 -0.12 0.00 1.31 0.00 0.00 55.95 57.82 2dhj s SER 123 Cb -0.36 -0.30 0.06 0.00 0.21 0.00 0.00 66.02 65.62 2dhj s SER 123 CO 0.36 -2.34 1.15 -0.44 0.41 0.00 0.00 173.24 172.39 2dhj s SER 124 N -4.80 4.80 0.00 2.44 0.01 -1.26 -5.25 113.70 109.63 2dhj s SER 124 Ca 0.70 0.90 0.00 0.00 1.31 0.00 0.00 55.95 58.86 2dhj s SER 124 Cb -0.05 -1.49 0.00 0.00 0.21 0.00 0.00 66.02 64.69 2dhj s SER 124 CO 0.49 -1.73 0.00 0.61 0.41 0.00 0.00 173.24 173.02