#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 6.72 -0.08 1.61 1.04 -1.26 -5.00 113.70 116.74 2dhj s SER 2 Ca 0.00 1.31 -0.25 0.00 0.48 0.00 0.00 55.95 57.49 2dhj s SER 2 Cb 0.00 -2.54 -0.03 0.00 0.10 0.00 0.00 66.02 63.55 2dhj s SER 2 CO 0.00 -1.02 0.78 -0.94 0.98 0.00 0.00 173.24 173.04 2dhj s SER 3 N 2.67 7.05 0.00 7.02 1.04 -1.26 -5.00 113.70 125.22 2dhj s SER 3 Ca 0.56 1.27 0.00 0.00 0.48 0.00 0.00 55.95 58.26 2dhj s SER 3 Cb -0.18 -2.45 0.00 0.00 0.10 0.00 0.00 66.02 63.49 2dhj s SER 3 CO 0.21 -0.20 0.00 0.61 0.98 0.00 0.00 173.24 174.84 2dhj n GLY 4 N 3.15 4.75 3.38 7.32 0.00 -1.26 -4.98 105.19 117.55 2dhj n GLY 4 Ca 0.01 -0.79 -0.20 0.00 0.00 0.00 0.00 46.02 45.05 2dhj n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dhj n SER 5 N 0.00 -4.61 -4.53 1.61 7.64 -1.26 -4.97 113.62 107.51 2dhj n SER 5 Ca 0.00 -0.53 -0.41 0.00 1.01 0.00 0.00 58.87 58.94 2dhj n SER 5 Cb 0.00 -4.76 -0.09 0.00 -1.01 0.00 0.00 64.21 58.35 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 -3.65 6.18 0.00 6.43 0.15 -1.26 -4.95 113.70 116.59 2dhj s SER 6 Ca 0.35 -0.37 0.00 0.00 0.70 0.00 0.00 55.95 56.63 2dhj s SER 6 Cb -0.15 -2.20 0.00 0.00 -1.71 0.00 0.00 66.02 61.96 2dhj s SER 6 CO 0.68 -0.40 0.00 0.61 1.20 0.00 0.00 173.24 175.33 2dhj n GLY 7 N 5.00 2.98 3.61 9.45 0.00 -1.26 -5.05 105.19 119.93 2dhj n GLY 7 Ca -0.09 -2.04 -0.29 0.00 0.00 0.00 0.00 46.02 43.60 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 0.00 1.71 -0.22 1.61 1.01 -1.26 -4.86 116.67 114.66 2dhj s ASP 8 Ca 0.00 1.02 -0.32 0.00 0.71 0.00 0.00 52.55 53.96 2dhj s ASP 8 Cb 0.00 -1.56 -0.09 0.00 1.01 0.00 0.00 42.92 42.27 2dhj s ASP 8 CO 0.00 -3.68 2.10 0.00 0.21 0.00 0.00 175.17 173.80 2dhj n ALA 9 N -4.52 1.27 -0.28 5.23 0.00 -1.26 -4.76 120.51 116.19 2dhj n ALA 9 Ca 0.07 -0.01 0.11 0.00 0.00 0.00 0.00 53.44 53.61 2dhj n ALA 9 Cb 0.58 -2.66 0.22 0.00 0.00 0.00 0.00 19.45 17.58 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 9.45 0.38 -3.47 0.00 0.00 0.56 -4.63 120.51 122.80 2dhj n ALA 10 Ca 0.31 0.85 -0.09 0.00 0.00 0.00 0.00 53.44 54.51 2dhj n ALA 10 Cb 0.33 -0.61 -0.03 0.00 0.00 0.00 0.00 19.45 19.14 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 -5.76 1.47 -0.12 0.00 2.20 -1.15 -5.02 119.74 111.37 2dhj s LYS 11 Ca -0.10 -0.82 -0.30 0.00 -0.36 0.00 0.00 55.97 54.39 2dhj s LYS 11 Cb 0.23 0.56 0.08 0.00 -1.51 0.00 0.00 37.83 37.19 2dhj s LYS 11 CO 0.62 -0.64 0.77 -1.83 -0.36 0.00 0.00 175.35 173.91 2dhj s GLU 12 N -3.86 0.90 0.00 4.03 -1.05 -1.26 -0.53 118.70 116.93 2dhj s GLU 12 Ca 0.08 0.36 0.00 0.00 -0.15 0.00 0.00 54.97 55.26 2dhj s GLU 12 Cb -0.02 0.43 0.00 0.00 -0.44 0.00 0.00 34.13 34.10 2dhj s GLU 12 CO -0.02 -0.25 0.00 0.41 0.95 0.00 0.00 175.26 176.34 2dhj n GLY 13 N 1.20 2.95 3.66 -3.83 0.00 -0.92 -5.03 105.19 103.23 2dhj n GLY 13 Ca -0.16 -0.77 -0.42 0.00 0.00 0.00 0.00 46.02 44.66 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 2.14 0.02 1.61 0.52 -1.26 -2.07 118.94 117.89 2dhj s TRP 14 Ca 0.00 0.31 -0.03 0.00 0.02 0.00 0.00 56.10 56.40 2dhj s TRP 14 Cb 0.00 -3.87 -0.01 0.00 -1.15 0.00 0.00 33.47 28.44 2dhj s TRP 14 CO 0.00 -3.59 0.04 -0.51 0.02 0.00 0.00 176.95 172.91 2dhj s LEU 15 N 3.78 1.98 -0.58 2.99 1.43 -1.23 -4.66 118.68 122.39 2dhj s LEU 15 Ca 0.71 -0.41 -0.24 0.00 -1.03 0.00 0.00 54.13 53.17 2dhj s LEU 15 Cb -0.33 0.33 0.05 0.00 0.03 0.00 0.00 46.19 46.27 2dhj s LEU 15 CO 0.28 -0.34 0.95 -1.00 0.23 0.00 0.00 176.35 176.48 2dhj s HIS 16 N -1.53 2.75 -0.41 0.29 3.76 -1.04 -2.81 115.29 116.31 2dhj s HIS 16 Ca -0.15 -0.12 -0.19 0.00 -0.15 0.00 0.00 55.06 54.45 2dhj s HIS 16 Cb -0.08 -4.13 0.01 0.00 1.11 0.00 0.00 32.58 29.49 2dhj s HIS 16 CO -0.00 -1.43 0.53 0.12 -0.85 0.00 0.00 174.74 173.10 2dhj s PHE 17 N 4.02 3.14 -0.38 1.40 5.36 0.31 -2.63 117.98 129.19 2dhj s PHE 17 Ca 0.29 -0.11 0.03 0.00 -0.96 0.00 0.00 56.93 56.18 2dhj s PHE 17 Cb -0.13 -3.06 0.11 0.00 -0.34 0.00 0.00 43.02 39.60 2dhj s PHE 17 CO 0.17 -0.71 0.11 0.50 -1.46 0.00 0.00 175.22 173.83 2dhj s ARG 18 N 2.44 1.47 0.24 10.12 3.52 -1.11 -2.71 118.95 132.92 2dhj s ARG 18 Ca 0.17 -1.94 -0.30 0.00 -0.13 0.00 0.00 55.73 53.54 2dhj s ARG 18 Cb -0.16 -3.02 -0.09 0.00 -1.56 0.00 0.00 34.95 30.12 2dhj s ARG 18 CO 0.15 -1.00 1.27 -1.25 -0.81 0.00 0.00 175.30 173.67 2dhj s PRO 19 N 0.71 4.42 -0.17 5.12 0.04 -1.26 -0.87 135.00 142.99 2dhj s PRO 19 Ca 0.13 2.05 -0.26 0.00 0.04 0.00 0.00 61.00 62.96 2dhj s PRO 19 Cb -0.21 -3.17 -0.23 0.00 0.04 0.00 0.00 34.50 30.94 2dhj s PRO 19 CO -0.08 -0.16 0.53 -0.07 0.04 0.00 0.00 177.00 177.26 2dhj h LEU 20 N 4.67 0.00 -7.13 -3.56 3.38 -1.71 -3.48 115.31 107.48 2dhj h LEU 20 Ca -0.46 -0.79 -0.07 0.00 0.09 0.00 0.00 57.88 56.66 2dhj h LEU 20 Cb 1.22 0.00 -0.23 0.00 0.09 0.00 0.00 40.66 41.74 2dhj h LEU 20 CO 0.73 1.19 -0.08 0.54 0.09 0.00 0.00 178.44 180.91 2dhj s VAL 21 N -2.27 -0.00 -0.10 1.22 0.11 -1.26 -5.05 120.40 113.05 2dhj s VAL 21 Ca -0.23 0.02 0.01 0.00 -2.93 0.00 0.00 61.98 58.84 2dhj s VAL 21 Cb 0.01 -0.80 -0.06 0.00 -1.53 0.00 0.00 36.38 33.99 2dhj s VAL 21 CO 0.64 0.01 -0.09 0.35 -3.33 0.00 0.00 175.10 172.68 2dhj n THR 22 N 3.32 0.56 -4.42 5.04 -2.24 -1.26 -3.66 114.28 111.62 2dhj n THR 22 Ca -0.16 -0.21 -0.21 0.00 -2.27 0.00 0.00 64.05 61.20 2dhj n THR 22 Cb 0.56 -0.87 -0.10 0.00 -2.10 0.00 0.00 70.33 67.82 2dhj n THR 22 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2dhj s ASP 23 N -4.97 2.44 -0.02 3.42 2.15 -1.26 -4.95 116.67 113.48 2dhj s ASP 23 Ca -0.13 -1.27 -0.03 0.00 0.43 0.00 0.00 52.55 51.55 2dhj s ASP 23 Cb 0.03 -0.10 -0.01 0.00 -0.30 0.00 0.00 42.92 42.54 2dhj s ASP 23 CO 0.22 -0.48 0.27 0.11 -0.17 0.00 0.00 175.17 175.12 2dhj h LYS 24 N 2.25 -0.09 0.00 4.34 6.56 -2.03 -3.47 116.57 124.13 2dhj h LYS 24 Ca -0.40 0.01 -0.16 0.00 -1.06 0.00 0.00 60.65 59.04 2dhj h LYS 24 Cb 1.24 0.02 -0.13 0.00 -0.57 0.00 0.00 32.23 32.78 2dhj h LYS 24 CO 0.68 -0.06 -0.25 0.41 -2.06 0.00 0.00 179.45 178.17 2dhj n GLY 25 N 1.22 -0.69 0.01 3.86 0.00 -1.26 -5.04 105.19 103.29 2dhj n GLY 25 Ca -0.01 0.52 0.00 0.00 0.00 0.00 0.00 46.02 46.52 2dhj n GLY 25 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2dhj n LYS 26 N 1.20 0.00 -2.86 1.61 5.02 -1.26 -4.87 118.16 117.00 2dhj n LYS 26 Ca 0.04 0.00 -0.23 0.00 -2.02 0.00 0.00 58.31 56.10 2dhj n LYS 26 Cb 0.69 -0.31 -0.02 0.00 -0.02 0.00 0.00 35.03 35.37 2dhj n LYS 26 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 2dhj n ARG 27 N -2.13 2.53 -4.37 1.97 0.63 -1.26 -5.07 116.66 108.96 2dhj n ARG 27 Ca 0.00 -4.27 -0.29 0.00 -0.92 0.00 0.00 57.85 52.37 2dhj n ARG 27 Cb 0.00 -2.01 -0.13 0.00 0.45 0.00 0.00 32.46 30.78 2dhj n ARG 27 CO 0.00 0.00 0.00 0.14 -2.51 0.00 0.00 177.63 175.26 2dhj s VAL 28 N -4.09 2.42 0.00 5.15 -7.23 -1.26 -5.12 120.40 110.27 2dhj s VAL 28 Ca 0.44 -1.69 0.00 0.00 -1.81 0.00 0.00 61.98 58.93 2dhj s VAL 28 Cb 0.34 -2.08 0.00 0.00 0.56 0.00 0.00 36.38 35.20 2dhj s VAL 28 CO -0.12 0.10 0.00 0.61 -0.31 0.00 0.00 175.10 175.38 2dhj n GLY 29 N 0.89 0.65 2.02 2.32 0.00 -1.26 -5.09 105.19 104.71 2dhj n GLY 29 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.85 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 4.60 -0.64 1.64 -0.02 0.00 -1.26 -5.14 105.19 104.37 2dhj n GLY 30 Ca 0.00 0.10 -0.14 0.00 0.00 0.00 0.00 46.02 45.98 2dhj n GLY 30 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dhj n SER 31 N -2.88 -1.85 -3.61 1.61 7.64 -1.26 -5.09 113.62 108.18 2dhj n SER 31 Ca 0.00 -0.73 -0.11 0.00 1.01 0.00 0.00 58.87 59.04 2dhj n SER 31 Cb 0.00 -0.48 -0.06 0.00 -1.01 0.00 0.00 64.21 62.66 2dhj n SER 31 CO 0.00 0.00 0.00 0.27 -3.01 0.00 0.00 175.04 172.30 2dhj s ILE 32 N -1.86 0.00 0.63 0.44 -4.36 -1.26 -5.16 121.20 109.62 2dhj s ILE 32 Ca 0.34 0.00 -0.17 0.00 -0.26 0.00 0.00 60.65 60.56 2dhj s ILE 32 Cb -0.04 -1.00 -0.02 0.00 1.25 0.00 0.00 42.46 42.65 2dhj s ILE 32 CO 0.26 0.00 1.14 -0.13 0.24 0.00 0.00 174.94 176.45 2dhj s ARG 33 N -0.28 2.91 1.17 0.37 0.52 -1.26 -5.03 118.95 117.35 2dhj s ARG 33 Ca 0.00 1.55 -0.20 0.00 -0.52 0.00 0.00 55.73 56.57 2dhj s ARG 33 Cb -0.03 -1.95 0.29 0.00 0.52 0.00 0.00 34.95 33.78 2dhj s ARG 33 CO -0.02 -1.19 1.04 -0.35 0.02 0.00 0.00 175.30 174.80 2dhj n PRO 34 N -2.02 -3.05 -1.01 3.54 -0.04 -1.26 -4.90 135.00 126.25 2dhj n PRO 34 Ca 0.11 -1.67 -0.34 0.00 -0.04 0.00 0.00 63.50 61.57 2dhj n PRO 34 Cb 0.51 -1.56 -0.01 0.00 -0.04 0.00 0.00 33.50 32.40 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 -4.75 -0.97 -3.89 0.54 7.02 -1.26 -4.92 117.44 109.20 2dhj n TRP 35 Ca 0.14 0.60 -0.35 0.00 -1.02 0.00 0.00 57.50 56.87 2dhj n TRP 35 Cb 0.56 -1.40 -0.14 0.00 -2.42 0.00 0.00 31.31 27.91 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 -0.75 2.91 -0.52 -0.99 1.02 -1.10 -4.96 119.74 115.35 2dhj s LYS 36 Ca 0.46 -0.94 -0.27 0.00 0.02 0.00 0.00 55.97 55.24 2dhj s LYS 36 Cb -0.59 -3.11 0.03 0.00 -0.52 0.00 0.00 37.83 33.64 2dhj s LYS 36 CO 0.45 -0.42 1.09 -1.14 -0.92 0.00 0.00 175.35 174.40 2dhj s GLN 37 N 1.38 3.57 -0.14 1.68 0.74 -1.26 -0.53 119.66 125.09 2dhj s GLN 37 Ca 0.01 0.27 -0.12 0.00 0.05 0.00 0.00 55.36 55.57 2dhj s GLN 37 Cb -0.17 -3.96 0.04 0.00 1.10 0.00 0.00 33.01 30.02 2dhj s GLN 37 CO -0.02 -1.46 0.36 0.00 -0.55 0.00 0.00 175.29 173.62 2dhj s MET 38 N 4.40 0.41 -0.25 1.67 0.23 -1.12 -4.83 119.30 119.80 2dhj s MET 38 Ca 0.42 0.53 -0.33 0.00 -1.03 0.00 0.00 55.69 55.29 2dhj s MET 38 Cb -0.08 0.16 -0.09 0.00 -1.53 0.00 0.00 34.83 33.29 2dhj s MET 38 CO 0.27 -0.07 2.14 0.98 -2.03 0.00 0.00 175.02 176.31 2dhj n TYR 39 N 3.11 1.87 -3.49 3.16 9.36 0.60 -3.53 117.16 128.23 2dhj n TYR 39 Ca -0.15 0.09 -0.38 0.00 3.32 0.00 0.00 57.90 60.78 2dhj n TYR 39 Cb 0.57 -2.62 -0.09 0.00 -0.63 0.00 0.00 39.34 36.57 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 6.98 5.25 -0.11 2.97 1.01 -0.88 0.73 120.40 136.35 2dhj s VAL 40 Ca 1.03 0.44 0.03 0.00 0.00 0.00 0.00 61.98 63.48 2dhj s VAL 40 Cb -0.65 -3.63 0.00 0.00 0.00 0.00 0.00 36.38 32.10 2dhj s VAL 40 CO 0.45 0.24 -0.23 -0.69 0.00 0.00 0.00 175.10 174.87 2dhj s VAL 41 N 1.60 2.14 -0.41 2.92 1.01 -0.07 -2.15 120.40 125.43 2dhj s VAL 41 Ca 0.13 -0.98 -0.16 0.00 0.00 0.00 0.00 61.98 60.96 2dhj s VAL 41 Cb -0.15 -1.83 0.02 0.00 0.00 0.00 0.00 36.38 34.42 2dhj s VAL 41 CO 0.08 0.55 0.35 -0.22 0.00 0.00 0.00 175.10 175.87 2dhj s LEU 42 N 0.44 5.03 -0.20 3.92 2.96 0.30 0.21 118.68 131.34 2dhj s LEU 42 Ca -0.16 -0.82 0.01 0.00 -0.22 0.00 0.00 54.13 52.94 2dhj s LEU 42 Cb -0.17 -2.24 0.03 0.00 0.50 0.00 0.00 46.19 44.31 2dhj s LEU 42 CO 0.07 -0.50 -0.17 -0.13 -1.32 0.00 0.00 176.35 174.30 2dhj s ARG 43 N 1.84 2.84 5.28 1.98 0.52 -0.49 -0.33 118.95 130.58 2dhj s ARG 43 Ca 0.07 -0.94 0.00 0.00 -0.52 0.00 0.00 55.73 54.35 2dhj s ARG 43 Cb -0.18 -2.66 0.00 0.00 0.52 0.00 0.00 34.95 32.62 2dhj s ARG 43 CO 0.11 -0.29 0.00 0.41 0.02 0.00 0.00 175.30 175.55 2dhj n GLY 44 N 4.59 1.00 0.06 -3.53 0.00 -1.26 -1.19 105.19 104.86 2dhj n GLY 44 Ca -0.19 0.44 0.03 0.00 0.00 0.00 0.00 46.02 46.30 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 -4.49 1.61 1.44 -1.26 -4.95 115.22 107.58 2dhj n HIS 45 Ca 0.00 -0.56 -0.24 0.00 -2.01 0.00 0.00 57.72 54.91 2dhj n HIS 45 Cb 0.00 -0.08 -0.14 0.00 0.12 0.00 0.00 29.99 29.90 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 -1.48 2.24 -0.33 4.39 0.01 -0.33 -0.96 113.70 117.23 2dhj s SER 46 Ca 0.10 -0.53 -0.11 0.00 1.31 0.00 0.00 55.95 56.72 2dhj s SER 46 Cb 0.09 -0.16 -0.01 0.00 0.21 0.00 0.00 66.02 66.15 2dhj s SER 46 CO 0.01 0.10 0.19 -0.76 0.41 0.00 0.00 173.24 173.19 2dhj s LEU 47 N -1.31 4.33 -0.43 2.44 1.43 -1.14 -1.40 118.68 122.60 2dhj s LEU 47 Ca 0.05 -0.54 -0.10 0.00 -1.03 0.00 0.00 54.13 52.51 2dhj s LEU 47 Cb -0.09 -2.05 0.08 0.00 0.03 0.00 0.00 46.19 44.16 2dhj s LEU 47 CO 0.02 -0.23 0.28 -0.31 0.23 0.00 0.00 176.35 176.34 2dhj s TYR 48 N 1.65 3.32 0.56 0.29 2.02 0.13 -3.02 117.35 122.30 2dhj s TYR 48 Ca 0.05 -1.43 -0.01 0.00 -0.37 0.00 0.00 57.07 55.30 2dhj s TYR 48 Cb -0.17 -3.00 0.03 0.00 -0.40 0.00 0.00 41.96 38.41 2dhj s TYR 48 CO 0.08 -0.84 0.81 -0.51 -1.57 0.00 0.00 175.55 173.52 2dhj s LEU 49 N 1.46 3.27 -0.24 -1.29 1.02 -1.26 -0.90 118.68 120.73 2dhj s LEU 49 Ca 0.03 0.24 -0.17 0.00 0.02 0.00 0.00 54.13 54.25 2dhj s LEU 49 Cb -0.23 -3.07 0.07 0.00 0.02 0.00 0.00 46.19 42.98 2dhj s LEU 49 CO 0.03 -1.12 0.62 -0.31 0.02 0.00 0.00 176.35 175.59 2dhj s TYR 50 N -2.84 -0.85 0.22 0.29 2.02 0.22 -4.48 117.35 111.95 2dhj s TYR 50 Ca 0.55 1.82 -0.08 0.00 -0.37 0.00 0.00 57.07 59.00 2dhj s TYR 50 Cb -0.10 0.42 0.36 0.00 -0.40 0.00 0.00 41.96 42.24 2dhj s TYR 50 CO 0.40 -0.42 1.71 0.87 -1.57 0.00 0.00 175.55 176.54 2dhj h LYS 51 N 6.32 0.31 -4.74 -0.62 1.79 -1.88 1.75 116.57 119.50 2dhj h LYS 51 Ca -0.31 -0.02 -0.27 0.00 -2.18 0.00 0.00 60.65 57.87 2dhj h LYS 51 Cb 1.20 -0.07 -0.18 0.00 -1.58 0.00 0.00 32.23 31.60 2dhj h LYS 51 CO 0.16 0.20 -0.72 0.34 -1.08 0.00 0.00 179.45 178.35 2dhj s ASP 52 N -5.31 1.16 -0.13 0.86 2.15 -1.26 -4.23 116.67 109.90 2dhj s ASP 52 Ca -0.13 -0.78 0.01 0.00 0.43 0.00 0.00 52.55 52.08 2dhj s ASP 52 Cb 0.19 0.04 0.18 0.00 -0.30 0.00 0.00 42.92 43.04 2dhj s ASP 52 CO 0.75 -0.31 1.31 1.17 -0.17 0.00 0.00 175.17 177.92 2dhj n LYS 53 N 0.68 1.35 -0.11 4.34 4.81 -1.26 -4.28 118.16 123.68 2dhj n LYS 53 Ca -0.17 -0.84 -0.11 0.00 -0.87 0.00 0.00 58.31 56.32 2dhj n LYS 53 Cb 0.58 -1.33 -0.03 0.00 0.02 0.00 0.00 35.03 34.27 2dhj n LYS 53 CO 0.00 0.00 0.00 -0.09 1.17 0.00 0.00 177.40 178.48 2dhj h ARG 54 N 0.34 0.58 -2.93 1.64 9.65 -1.97 -3.45 114.38 118.25 2dhj h ARG 54 Ca 0.18 -0.20 -0.12 0.00 -1.10 0.00 0.00 59.98 58.74 2dhj h ARG 54 Cb 1.48 -0.05 -0.21 0.00 -1.39 0.00 0.00 29.97 29.80 2dhj h ARG 54 CO 0.32 0.73 -0.25 -1.83 2.80 0.00 0.00 179.97 181.73 2dhj s GLU 55 N -4.92 0.62 -0.14 0.20 -1.05 -1.26 -5.08 118.70 107.07 2dhj s GLU 55 Ca -0.13 0.02 -0.08 0.00 -0.15 0.00 0.00 54.97 54.63 2dhj s GLU 55 Cb 0.09 0.28 -0.06 0.00 -0.44 0.00 0.00 34.13 34.00 2dhj s GLU 55 CO 0.77 -0.15 -0.20 1.04 0.95 0.00 0.00 175.26 177.67 2dhj n GLN 56 N 1.69 0.33 -0.30 -4.83 6.02 -1.26 -4.70 117.38 114.33 2dhj n GLN 56 Ca -0.19 0.14 -0.04 0.00 -0.01 0.00 0.00 57.00 56.90 2dhj n GLN 56 Cb 0.56 -1.05 -0.01 0.00 1.02 0.00 0.00 30.24 30.76 2dhj n GLN 56 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 2dhj n THR 57 N -3.75 -0.44 -1.27 5.09 -1.04 -1.26 -4.45 114.28 107.16 2dhj n THR 57 Ca -0.27 1.79 -0.36 0.00 -2.04 0.00 0.00 64.05 63.17 2dhj n THR 57 Cb 0.66 -2.30 0.08 0.00 -1.82 0.00 0.00 70.33 66.94 2dhj n THR 57 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 2dhj n THR 58 N -5.04 1.97 -1.62 12.58 -2.24 -1.26 -4.95 114.28 113.71 2dhj n THR 58 Ca 0.05 -0.38 -0.32 0.00 -2.27 0.00 0.00 64.05 61.12 2dhj n THR 58 Cb 0.26 -0.82 0.06 0.00 -2.10 0.00 0.00 70.33 67.72 2dhj n THR 58 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 2dhj s PRO 59 N -2.93 2.65 0.98 -0.78 0.04 -1.26 -5.01 135.00 128.69 2dhj s PRO 59 Ca 0.67 1.33 -0.12 0.00 0.04 0.00 0.00 61.00 62.92 2dhj s PRO 59 Cb -0.35 -1.94 0.17 0.00 0.04 0.00 0.00 34.50 32.43 2dhj s PRO 59 CO 0.56 -1.36 0.36 0.43 0.04 0.00 0.00 177.00 177.04 2dhj n SER 60 N -2.72 -3.02 -4.26 6.66 7.64 -1.26 -4.90 113.62 111.76 2dhj n SER 60 Ca 0.10 -0.40 -0.43 0.00 1.01 0.00 0.00 58.87 59.15 2dhj n SER 60 Cb 0.52 -0.75 -0.06 0.00 -1.01 0.00 0.00 64.21 62.92 2dhj n SER 60 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2dhj s GLU 61 N -3.44 2.95 -0.12 1.43 2.02 -1.26 -4.64 118.70 115.64 2dhj s GLU 61 Ca 0.33 -2.04 0.00 0.00 0.02 0.00 0.00 54.97 53.28 2dhj s GLU 61 Cb -0.06 -4.15 0.00 0.00 0.10 0.00 0.00 34.13 30.02 2dhj s GLU 61 CO 0.29 -1.26 0.00 0.39 0.02 0.00 0.00 175.26 174.71 2dhj n GLU 62 N 4.57 -2.01 -3.99 1.61 1.02 -1.26 -4.84 120.64 115.74 2dhj n GLU 62 Ca -0.02 0.07 -0.31 0.00 -0.02 0.00 0.00 57.16 56.88 2dhj n GLU 62 Cb 0.42 -4.34 -0.15 0.00 -0.02 0.00 0.00 31.44 27.34 2dhj n GLU 62 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2dhj s GLU 63 N -3.61 1.73 0.68 3.49 0.41 -1.26 -5.11 118.70 115.03 2dhj s GLU 63 Ca 0.00 -1.31 -0.16 0.00 -0.41 0.00 0.00 54.97 53.09 2dhj s GLU 63 Cb 0.00 -2.78 0.01 0.00 -1.78 0.00 0.00 34.13 29.58 2dhj s GLU 63 CO 0.00 -0.69 1.21 1.14 -0.49 0.00 0.00 175.26 176.43 2dhj s GLN 64 N 1.21 2.45 0.73 1.61 0.00 -1.26 -4.75 119.66 119.64 2dhj s GLN 64 Ca -0.02 1.77 -0.12 0.00 -0.00 0.00 0.00 55.36 56.99 2dhj s GLN 64 Cb -0.19 -1.87 0.04 0.00 0.00 0.00 0.00 33.01 30.99 2dhj s GLN 64 CO -0.08 -1.60 1.10 -1.25 0.00 0.00 0.00 175.29 173.46 2dhj s PRO 65 N -3.73 2.44 -0.40 9.60 0.04 -1.26 -4.95 135.00 136.74 2dhj s PRO 65 Ca 0.75 1.24 0.01 0.00 0.04 0.00 0.00 61.00 63.05 2dhj s PRO 65 Cb -0.29 -1.92 0.11 0.00 0.04 0.00 0.00 34.50 32.44 2dhj s PRO 65 CO 0.41 -1.51 0.15 0.42 0.04 0.00 0.00 177.00 176.52 2dhj s ILE 66 N -2.71 2.76 -0.14 0.56 1.01 -1.17 -4.88 121.20 116.64 2dhj s ILE 66 Ca 0.63 -2.38 -0.36 0.00 0.00 0.00 0.00 60.65 58.54 2dhj s ILE 66 Cb -0.18 -2.95 -0.13 0.00 0.01 0.00 0.00 42.46 39.21 2dhj s ILE 66 CO 0.51 -0.67 1.84 -1.20 0.00 0.00 0.00 174.94 175.42 2dhj n SER 67 N 4.21 3.18 -0.00 3.58 7.64 -1.26 -2.90 113.62 128.07 2dhj n SER 67 Ca 0.02 1.00 0.08 0.00 1.01 0.00 0.00 58.87 60.98 2dhj n SER 67 Cb 0.41 -1.31 -0.10 0.00 -1.01 0.00 0.00 64.21 62.19 2dhj n SER 67 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 2dhj n VAL 68 N 4.99 0.00 -0.23 0.44 0.24 -0.14 -4.56 118.33 119.08 2dhj n VAL 68 Ca 0.24 -0.13 0.23 0.00 -2.04 0.00 0.00 64.34 62.63 2dhj n VAL 68 Cb 0.25 0.91 0.42 0.00 -1.47 0.00 0.00 33.84 33.95 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 -1.47 0.24 -3.12 -1.34 5.15 -1.21 -0.57 115.26 112.94 2dhj n ASN 69 Ca 0.03 1.21 -0.23 0.00 -0.60 0.00 0.00 54.58 54.98 2dhj n ASN 69 Cb 0.28 -0.58 -0.05 0.00 -0.53 0.00 0.00 39.78 38.90 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 -2.50 3.36 -2.43 5.20 0.00 -1.26 -4.19 120.51 118.68 2dhj n ALA 70 Ca 0.27 -4.08 -0.26 0.00 0.00 0.00 0.00 53.44 49.37 2dhj n ALA 70 Cb 0.92 -0.83 -0.03 0.00 0.00 0.00 0.00 19.45 19.50 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 -4.12 0.31 0.27 0.00 1.02 0.15 -4.95 118.68 111.37 2dhj s LEU 72 Ca 0.34 -0.54 -0.14 0.00 0.02 0.00 0.00 54.13 53.81 2dhj s LEU 72 Cb -0.00 -0.22 -0.08 0.00 0.02 0.00 0.00 46.19 45.91 2dhj s LEU 72 CO 0.20 -0.34 0.67 -0.63 0.02 0.00 0.00 176.35 176.27 2dhj s ILE 73 N 2.15 4.75 -0.30 -0.59 1.01 -1.26 -1.43 121.20 125.53 2dhj s ILE 73 Ca 0.02 0.84 -0.13 0.00 0.00 0.00 0.00 60.65 61.39 2dhj s ILE 73 Cb -0.16 -3.65 0.13 0.00 0.01 0.00 0.00 42.46 38.80 2dhj s ILE 73 CO -0.08 -0.08 0.77 -1.81 0.00 0.00 0.00 174.94 173.73 2dhj s ASP 74 N -2.19 -0.92 -0.83 3.58 1.01 0.29 -4.97 116.67 112.64 2dhj s ASP 74 Ca 0.50 1.31 -0.34 0.00 0.71 0.00 0.00 52.55 54.73 2dhj s ASP 74 Cb -0.12 1.91 -0.20 0.00 1.01 0.00 0.00 42.92 45.53 2dhj s ASP 74 CO 0.19 -0.19 2.53 -0.38 0.21 0.00 0.00 175.17 177.53 2dhj n ILE 75 N 5.01 0.00 -0.76 0.77 5.41 -1.26 0.52 119.36 129.06 2dhj n ILE 75 Ca -0.13 -0.04 -0.25 0.00 1.00 0.00 0.00 62.75 63.33 2dhj n ILE 75 Cb 0.52 -0.62 -0.01 0.00 -0.71 0.00 0.00 39.64 38.82 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 9.90 -1.29 -4.64 4.38 3.41 -1.06 -4.60 113.62 119.71 2dhj n SER 76 Ca 0.61 0.53 -0.53 0.00 -0.26 0.00 0.00 58.87 59.22 2dhj n SER 76 Cb 0.04 -0.52 -0.06 0.00 -0.26 0.00 0.00 64.21 63.41 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 -0.36 1.78 -0.05 7.33 0.18 -1.26 -4.75 117.16 120.02 2dhj n TYR 77 Ca 0.08 0.55 0.24 0.00 1.88 0.00 0.00 57.90 60.65 2dhj n TYR 77 Cb 0.20 -2.40 0.56 0.00 -0.38 0.00 0.00 39.34 37.32 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 5.76 0.00 -1.00 9.48 0.87 -1.99 -1.71 113.55 124.96 2dhj h SER 78 Ca -0.47 0.00 0.16 0.00 -1.23 0.00 0.00 61.79 60.25 2dhj h SER 78 Cb 1.32 0.00 -0.16 0.00 -0.44 0.00 0.00 62.40 63.12 2dhj h SER 78 CO 0.85 0.00 -0.38 -0.62 -0.53 0.00 0.00 176.83 176.15 2dhj n GLU 79 N -3.38 -0.22 -1.49 2.24 -0.58 -1.26 -4.47 120.64 111.47 2dhj n GLU 79 Ca 0.15 1.54 -0.36 0.00 -0.42 0.00 0.00 57.16 58.07 2dhj n GLU 79 Cb 1.11 -2.28 0.08 0.00 -0.57 0.00 0.00 31.44 29.78 2dhj n GLU 79 CO 0.00 0.00 0.00 -2.37 -0.48 0.00 0.00 177.13 174.28 2dhj n THR 80 N -5.48 3.63 0.07 2.62 5.66 -0.65 -4.95 114.28 115.18 2dhj n THR 80 Ca 0.11 -0.41 -0.18 0.00 -3.05 0.00 0.00 64.05 60.51 2dhj n THR 80 Cb 0.41 -1.26 -0.14 0.00 -1.55 0.00 0.00 70.33 67.78 2dhj n THR 80 CO 0.00 0.00 0.00 0.07 -3.05 0.00 0.00 175.07 172.09 2dhj h LYS 81 N 0.04 0.29 -6.13 1.09 2.10 -1.90 -3.47 116.57 108.59 2dhj h LYS 81 Ca -0.49 -0.49 -0.75 0.00 -2.00 0.00 0.00 60.65 56.92 2dhj h LYS 81 Cb 1.34 0.18 0.04 0.00 -0.90 0.00 0.00 32.23 32.89 2dhj h LYS 81 CO 0.49 1.16 0.46 0.54 -2.00 0.00 0.00 179.45 180.10 2dhj n ARG 82 N -3.49 0.65 -3.52 0.07 1.74 -1.26 -4.93 116.66 105.92 2dhj n ARG 82 Ca -0.19 0.23 -0.31 0.00 -0.77 0.00 0.00 57.85 56.81 2dhj n ARG 82 Cb 1.05 -1.82 -0.05 0.00 -1.02 0.00 0.00 32.46 30.62 2dhj n ARG 82 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2dhj s LYS 83 N 1.28 3.71 -1.12 5.56 1.02 -1.26 -4.32 119.74 124.61 2dhj s LYS 83 Ca 0.92 0.10 -0.04 0.00 0.02 0.00 0.00 55.97 56.98 2dhj s LYS 83 Cb -1.15 -2.73 0.00 0.00 -0.52 0.00 0.00 37.83 33.44 2dhj s LYS 83 CO 0.58 0.37 0.96 0.09 -0.92 0.00 0.00 175.35 176.43 2dhj n ASN 84 N -0.10 -3.88 -4.45 2.83 3.02 -1.26 -4.57 115.26 106.86 2dhj n ASN 84 Ca -0.01 -0.51 -0.33 0.00 -0.03 0.00 0.00 54.58 53.70 2dhj n ASN 84 Cb 0.52 -4.52 -0.13 0.00 -0.61 0.00 0.00 39.78 35.03 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 -3.30 3.11 -0.06 2.41 0.11 -1.26 -1.42 120.40 119.99 2dhj s VAL 85 Ca 0.25 -0.68 0.04 0.00 -2.93 0.00 0.00 61.98 58.66 2dhj s VAL 85 Cb -0.11 -2.25 -0.00 0.00 -1.53 0.00 0.00 36.38 32.49 2dhj s VAL 85 CO 0.64 0.57 -0.20 0.72 -3.33 0.00 0.00 175.10 173.51 2dhj s PHE 86 N -0.39 2.03 -0.24 1.54 -0.71 0.92 -2.58 117.98 118.54 2dhj s PHE 86 Ca 0.04 -0.69 -0.19 0.00 -1.04 0.00 0.00 56.93 55.05 2dhj s PHE 86 Cb -0.12 -1.37 -0.02 0.00 -1.21 0.00 0.00 43.02 40.29 2dhj s PHE 86 CO 0.02 -0.26 0.58 0.50 -1.34 0.00 0.00 175.22 174.72 2dhj s ARG 87 N 0.20 4.12 -0.10 1.99 3.52 0.19 -1.53 118.95 127.33 2dhj s ARG 87 Ca -0.10 0.48 0.00 0.00 -0.13 0.00 0.00 55.73 55.98 2dhj s ARG 87 Cb -0.14 -3.63 -0.02 0.00 -1.56 0.00 0.00 34.95 29.59 2dhj s ARG 87 CO 0.05 -0.34 -0.09 -1.17 -0.81 0.00 0.00 175.30 172.93 2dhj s LEU 88 N 2.27 2.97 -0.14 -0.88 0.20 -0.71 0.10 118.68 122.50 2dhj s LEU 88 Ca 0.25 -0.17 0.00 0.00 0.69 0.00 0.00 54.13 54.90 2dhj s LEU 88 Cb -0.16 -1.66 0.02 0.00 -0.43 0.00 0.00 46.19 43.96 2dhj s LEU 88 CO 0.09 0.26 -0.13 -0.89 -0.29 0.00 0.00 176.35 175.39 2dhj s THR 89 N -0.20 1.43 -0.07 3.68 2.01 -0.52 -1.77 115.64 120.21 2dhj s THR 89 Ca 0.02 -0.55 -0.01 0.00 0.31 0.00 0.00 61.69 61.46 2dhj s THR 89 Cb -0.13 -1.35 -0.03 0.00 0.01 0.00 0.00 72.50 70.99 2dhj s THR 89 CO 0.03 0.43 -0.01 0.42 -0.69 0.00 0.00 174.62 174.80 2dhj s THR 90 N 1.49 4.17 0.54 -0.82 -4.23 0.78 0.34 115.64 117.91 2dhj s THR 90 Ca 0.04 -0.36 0.43 0.00 -1.18 0.00 0.00 61.69 60.62 2dhj s THR 90 Cb -0.13 -2.76 0.65 0.00 1.34 0.00 0.00 72.50 71.60 2dhj s THR 90 CO -0.09 0.56 1.66 -1.28 -0.54 0.00 0.00 174.62 174.93 2dhj h SER 91 N 5.01 0.03 0.16 3.99 0.87 -1.79 0.16 113.55 121.98 2dhj h SER 91 Ca -0.50 0.02 -0.01 0.00 -1.23 0.00 0.00 61.79 60.07 2dhj h SER 91 Cb 1.19 0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.16 2dhj h SER 91 CO 0.54 -0.02 -0.07 0.44 -0.53 0.00 0.00 176.83 177.19 2dhj h ASP 92 N 0.02 -0.18 -5.24 6.23 5.19 -1.90 -3.49 116.42 117.05 2dhj h ASP 92 Ca 0.80 -0.31 -0.12 0.00 -0.62 0.00 0.00 57.03 56.79 2dhj h ASP 92 Cb 3.13 0.05 -0.05 0.00 0.18 0.00 0.00 39.33 42.64 2dhj h ASP 92 CO -0.06 0.40 0.03 0.00 -3.12 0.00 0.00 179.24 176.49 2dhj s GLU 94 N -2.96 2.07 -0.07 0.00 -6.30 -1.24 -0.16 118.70 110.04 2dhj s GLU 94 Ca 0.22 -1.12 -0.30 0.00 -2.50 0.00 0.00 54.97 51.27 2dhj s GLU 94 Cb -0.03 -2.24 0.11 0.00 0.00 0.00 0.00 34.13 31.98 2dhj s GLU 94 CO 0.14 0.48 0.93 0.00 0.02 0.00 0.00 175.26 176.83 2dhj s LEU 96 N -1.88 3.57 -0.21 0.00 1.43 -0.05 -1.73 118.68 119.81 2dhj s LEU 96 Ca 0.02 -0.53 -0.10 0.00 -1.03 0.00 0.00 54.13 52.50 2dhj s LEU 96 Cb -0.01 -2.46 0.08 0.00 0.03 0.00 0.00 46.19 43.83 2dhj s LEU 96 CO -0.04 -0.74 0.49 -0.36 0.23 0.00 0.00 176.35 175.92 2dhj s PHE 97 N -2.39 -0.83 -0.04 0.29 0.08 -0.58 -2.74 117.98 111.77 2dhj s PHE 97 Ca 0.53 1.63 0.04 0.00 0.12 0.00 0.00 56.93 59.25 2dhj s PHE 97 Cb -0.08 0.40 -0.03 0.00 -0.57 0.00 0.00 43.02 42.75 2dhj s PHE 97 CO 0.32 -0.46 -0.14 -1.14 -0.10 0.00 0.00 175.22 173.70 2dhj s GLN 98 N 2.03 2.47 0.44 0.44 0.74 -1.08 -0.06 119.66 124.65 2dhj s GLN 98 Ca -0.06 -0.72 0.05 0.00 0.05 0.00 0.00 55.36 54.67 2dhj s GLN 98 Cb -0.10 -2.37 0.05 0.00 1.10 0.00 0.00 33.01 31.69 2dhj s GLN 98 CO -0.15 0.62 0.38 0.00 -0.55 0.00 0.00 175.29 175.59 2dhj n ALA 99 N 2.19 0.73 -0.07 1.58 0.00 -0.51 -2.50 120.51 121.94 2dhj n ALA 99 Ca -0.17 -1.76 -0.06 0.00 0.00 0.00 0.00 53.44 51.45 2dhj n ALA 99 Cb 0.52 0.69 -0.02 0.00 0.00 0.00 0.00 19.45 20.64 2dhj n ALA 99 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2dhj n GLU 100 N -1.61 0.40 -4.09 0.00 2.13 -1.26 -4.85 120.64 111.36 2dhj n GLU 100 Ca 0.01 0.22 -0.36 0.00 0.66 0.00 0.00 57.16 57.68 2dhj n GLU 100 Cb 0.50 -1.26 -0.08 0.00 0.27 0.00 0.00 31.44 30.87 2dhj n GLU 100 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 2dhj s ASP 101 N -5.43 5.88 0.18 4.31 1.01 -1.26 -4.97 116.67 116.39 2dhj s ASP 101 Ca -0.20 0.31 -0.26 0.00 0.71 0.00 0.00 52.55 53.11 2dhj s ASP 101 Cb 0.03 -1.82 0.04 0.00 1.01 0.00 0.00 42.92 42.17 2dhj s ASP 101 CO 0.30 0.38 1.56 -0.09 0.21 0.00 0.00 175.17 177.53 2dhj h ARG 102 N 5.17 -0.13 -0.73 8.23 2.43 -1.94 0.25 114.38 127.66 2dhj h ARG 102 Ca -0.52 0.01 0.16 0.00 -0.81 0.00 0.00 59.98 58.82 2dhj h ARG 102 Cb 1.21 0.03 -0.12 0.00 -0.42 0.00 0.00 29.97 30.67 2dhj h ARG 102 CO 0.57 -0.09 0.11 -0.44 -1.51 0.00 0.00 179.97 178.62 2dhj h ASP 103 N -0.14 -0.12 -0.56 -3.80 5.19 -2.00 0.65 116.42 115.63 2dhj h ASP 103 Ca 0.20 0.16 0.02 0.00 -0.62 0.00 0.00 57.03 56.80 2dhj h ASP 103 Cb 0.53 0.25 -0.04 0.00 0.18 0.00 0.00 39.33 40.26 2dhj h ASP 103 CO -0.81 -0.09 0.34 0.44 -3.12 0.00 0.00 179.24 176.00 2dhj h ASP 104 N 0.20 0.56 0.27 6.45 3.32 -0.97 -2.06 116.42 124.20 2dhj h ASP 104 Ca 0.41 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.47 2dhj h ASP 104 Cb 0.72 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.13 2dhj h ASP 104 CO -0.56 0.39 -0.27 -0.03 -1.72 0.00 0.00 179.24 177.05 2dhj h MET 105 N 0.68 -0.56 -1.00 3.56 4.05 0.53 -2.02 114.93 120.17 2dhj h MET 105 Ca 0.23 0.04 0.16 0.00 -0.28 0.00 0.00 59.70 59.84 2dhj h MET 105 Cb 0.01 0.13 -0.10 0.00 -0.80 0.00 0.00 31.60 30.84 2dhj h MET 105 CO -0.09 -0.37 0.62 -0.07 0.23 0.00 0.00 176.91 177.23 2dhj h LEU 106 N -0.58 0.84 0.48 3.39 -0.00 -1.11 -2.03 115.31 116.30 2dhj h LEU 106 Ca -0.01 0.08 -0.02 0.00 -0.00 0.00 0.00 57.88 57.93 2dhj h LEU 106 Cb 0.53 -0.08 -0.01 0.00 -0.00 0.00 0.00 40.66 41.11 2dhj h LEU 106 CO -0.06 0.36 -0.29 0.00 -0.00 0.00 0.00 178.44 178.45 2dhj h ALA 107 N 1.60 -0.73 -0.49 1.53 0.00 -0.79 -2.63 119.26 117.75 2dhj h ALA 107 Ca 0.55 -0.14 0.10 0.00 0.00 0.00 0.00 54.91 55.41 2dhj h ALA 107 Cb 0.74 0.36 -0.10 0.00 0.00 0.00 0.00 17.79 18.79 2dhj h ALA 107 CO -0.33 -0.93 -0.18 -1.49 0.00 0.00 0.00 179.25 176.32 2dhj h TRP 108 N -0.73 -0.43 -0.40 0.00 4.06 -0.69 0.20 115.95 117.95 2dhj h TRP 108 Ca -0.05 0.05 0.08 0.00 2.06 0.00 0.00 58.89 61.03 2dhj h TRP 108 Cb 0.60 0.27 -0.09 0.00 -1.00 0.00 0.00 29.16 28.93 2dhj h TRP 108 CO -0.10 -0.27 -0.32 0.82 -3.56 0.00 0.00 178.44 175.02 2dhj h ILE 109 N -0.07 0.24 0.86 1.49 2.04 -1.28 -0.35 117.51 120.43 2dhj h ILE 109 Ca 0.23 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 66.05 2dhj h ILE 109 Cb 0.43 0.24 0.01 0.00 -0.74 0.00 0.00 36.82 36.76 2dhj h ILE 109 CO -0.54 0.00 -0.41 0.50 0.00 0.00 0.00 178.15 177.70 2dhj h LYS 110 N -0.25 -1.11 -0.66 2.37 3.64 -0.94 0.10 116.57 119.72 2dhj h LYS 110 Ca 0.17 0.08 0.06 0.00 -1.27 0.00 0.00 60.65 59.69 2dhj h LYS 110 Cb 0.53 0.25 -0.08 0.00 -0.41 0.00 0.00 32.23 32.52 2dhj h LYS 110 CO -0.53 -0.74 -0.40 1.15 -2.27 0.00 0.00 179.45 176.65 2dhj h THR 111 N -1.16 0.00 0.68 1.00 2.02 -0.71 0.30 112.91 115.04 2dhj h THR 111 Ca -0.12 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.04 2dhj h THR 111 Cb 0.88 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.28 2dhj h THR 111 CO 0.19 0.00 -0.50 0.40 0.37 0.00 0.00 175.52 175.98 2dhj h ILE 112 N -0.02 0.01 -1.20 3.11 2.04 -1.09 -1.62 117.51 118.75 2dhj h ILE 112 Ca 0.11 0.00 0.41 0.00 1.00 0.00 0.00 64.86 66.37 2dhj h ILE 112 Cb 0.29 0.01 -0.14 0.00 -0.74 0.00 0.00 36.82 36.24 2dhj h ILE 112 CO -0.63 0.00 0.74 1.56 0.00 0.00 0.00 178.15 179.82 2dhj h GLN 113 N -1.14 0.12 0.01 2.37 4.20 -0.06 0.37 115.11 121.00 2dhj h GLN 113 Ca -0.09 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.61 2dhj h GLN 113 Cb 0.94 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.69 2dhj h GLN 113 CO 0.04 0.08 -0.01 0.93 -0.67 0.00 0.00 178.83 179.20 2dhj h GLU 114 N 0.13 -0.02 -0.84 1.46 4.39 0.21 -0.63 114.58 119.28 2dhj h GLU 114 Ca 0.80 0.00 0.13 0.00 0.34 0.00 0.00 59.36 60.64 2dhj h GLU 114 Cb 2.31 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 30.91 2dhj h GLU 114 CO -0.51 0.46 0.55 0.66 -1.16 0.00 0.00 179.01 179.00 2dhj h SER 115 N -0.50 0.59 0.91 1.42 4.64 0.61 -0.18 113.55 121.04 2dhj h SER 115 Ca -0.00 0.03 -0.21 0.00 -0.47 0.00 0.00 61.79 61.14 2dhj h SER 115 Cb 0.48 -0.09 -0.02 0.00 -0.31 0.00 0.00 62.40 62.46 2dhj h SER 115 CO 0.00 0.31 -1.00 0.77 -0.87 0.00 0.00 176.83 176.05 2dhj h SER 116 N 0.63 0.06 -4.18 4.97 4.64 -1.13 -3.44 113.55 115.10 2dhj h SER 116 Ca 0.41 -0.06 -0.52 0.00 -0.47 0.00 0.00 61.79 61.15 2dhj h SER 116 Cb 0.70 -0.02 0.13 0.00 -0.31 0.00 0.00 62.40 62.90 2dhj h SER 116 CO -0.17 1.02 0.39 0.21 -0.87 0.00 0.00 176.83 177.40 2dhj s ASN 117 N -6.78 4.66 -0.43 4.97 3.84 -0.08 -4.54 114.94 116.58 2dhj s ASN 117 Ca 0.00 2.20 -0.01 0.00 0.21 0.00 0.00 52.86 55.26 2dhj s ASN 117 Cb 0.10 -2.57 0.27 0.00 -0.55 0.00 0.00 41.25 38.50 2dhj s ASN 117 CO 0.82 -1.94 2.07 0.00 -2.79 0.00 0.00 177.10 175.27 2dhj n LEU 118 N -2.51 6.84 -4.55 3.21 -0.00 -1.26 -4.93 117.00 113.80 2dhj n LEU 118 Ca 0.12 -3.65 -0.37 0.00 -0.00 0.00 0.00 56.01 52.11 2dhj n LEU 118 Cb 0.51 -1.05 -0.03 0.00 -0.00 0.00 0.00 43.42 42.85 2dhj n LEU 118 CO 0.47 1.34 1.91 0.54 -0.00 0.00 0.00 177.39 181.65 2dhj s ASN 119 N -0.39 4.70 -0.02 1.45 4.22 -1.26 -4.92 114.94 118.72 2dhj s ASN 119 Ca 0.42 0.95 0.01 0.00 -2.14 0.00 0.00 52.86 52.10 2dhj s ASN 119 Cb 0.33 -2.51 0.01 0.00 1.28 0.00 0.00 41.25 40.36 2dhj s ASN 119 CO -0.03 -2.71 -0.04 -0.55 -2.04 0.00 0.00 177.10 171.74 2dhj s SER 120 N 10.97 0.62 0.00 3.54 0.15 -1.26 -5.11 113.70 122.60 2dhj s SER 120 Ca 0.90 -0.09 0.00 0.00 0.70 0.00 0.00 55.95 57.47 2dhj s SER 120 Cb -0.17 -0.17 0.00 0.00 -1.71 0.00 0.00 66.02 63.97 2dhj s SER 120 CO 0.25 0.01 0.00 0.61 1.20 0.00 0.00 173.24 175.31 2dhj n GLY 121 N 3.41 1.08 3.62 9.45 0.00 -1.26 -4.89 105.19 116.60 2dhj n GLY 121 Ca -0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.41 2dhj n GLY 121 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dhj s PRO 122 N 0.22 3.66 -0.12 1.61 0.04 -1.26 -4.90 135.00 134.25 2dhj s PRO 122 Ca 0.00 1.53 -0.08 0.00 0.04 0.00 0.00 61.00 62.50 2dhj s PRO 122 Cb 0.00 -4.07 -0.03 0.00 0.04 0.00 0.00 34.50 30.44 2dhj s PRO 122 CO 0.00 -1.45 -0.15 0.43 0.04 0.00 0.00 177.00 175.87 2dhj n SER 123 N 8.92 1.51 -4.75 6.66 7.64 -1.26 -4.91 113.62 127.42 2dhj n SER 123 Ca 0.20 0.57 -0.37 0.00 1.01 0.00 0.00 58.87 60.28 2dhj n SER 123 Cb 0.46 -0.81 -0.07 0.00 -1.01 0.00 0.00 64.21 62.78 2dhj n SER 123 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2dhj s SER 124 N -5.37 6.51 0.00 6.43 0.15 -1.26 -5.28 113.70 114.89 2dhj s SER 124 Ca -0.12 0.60 0.00 0.00 0.70 0.00 0.00 55.95 57.12 2dhj s SER 124 Cb 0.02 -2.20 0.00 0.00 -1.71 0.00 0.00 66.02 62.13 2dhj s SER 124 CO 0.18 0.13 0.00 0.61 1.20 0.00 0.00 173.24 175.37