#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hnb s ALA 2 N 0.00 1.78 0.19 3.04 0.00 -1.26 -4.96 121.76 120.56 2hnb s ALA 2 Ca 0.00 0.26 0.07 0.00 0.00 0.00 0.00 51.96 52.29 2hnb s ALA 2 Cb 0.00 -3.30 0.08 0.00 0.00 0.00 0.00 23.12 19.90 2hnb s ALA 2 CO 0.00 -2.24 1.44 0.22 0.00 0.00 0.00 175.76 175.19 2hnb h ASP 3 N -1.47 0.08 -2.50 0.00 3.58 -1.88 -3.19 116.42 111.03 2hnb h ASP 3 Ca -0.45 -0.06 -0.60 0.00 0.42 0.00 0.00 57.03 56.33 2hnb h ASP 3 Cb 1.26 -0.02 -0.41 0.00 1.72 0.00 0.00 39.33 41.87 2hnb h ASP 3 CO 0.50 0.85 -0.70 -0.38 -2.88 0.00 0.00 179.24 176.63 2hnb n ILE 4 N -3.63 1.30 -2.35 2.25 5.41 -0.55 -3.68 119.36 118.12 2hnb n ILE 4 Ca -0.01 -4.73 -0.43 0.00 1.00 0.00 0.00 62.75 58.57 2hnb n ILE 4 Cb 0.77 -2.06 -0.02 0.00 -0.71 0.00 0.00 39.64 37.61 2hnb n ILE 4 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 176.55 175.66 2hnb s THR 5 N -1.67 4.01 0.60 1.39 2.01 -1.21 -3.28 115.64 117.50 2hnb s THR 5 Ca 0.33 1.12 -0.15 0.00 0.31 0.00 0.00 61.69 63.30 2hnb s THR 5 Cb 0.07 -4.07 -0.03 0.00 0.01 0.00 0.00 72.50 68.48 2hnb s THR 5 CO -0.10 -0.49 1.06 -0.76 -0.69 0.00 0.00 174.62 173.64 2hnb s LEU 6 N 4.74 3.47 -0.56 4.42 1.02 0.79 -3.35 118.68 129.21 2hnb s LEU 6 Ca 0.60 1.80 0.04 0.00 0.02 0.00 0.00 54.13 56.59 2hnb s LEU 6 Cb -0.18 -4.53 0.14 0.00 0.02 0.00 0.00 46.19 41.65 2hnb s LEU 6 CO 0.26 -1.19 0.33 -0.63 0.02 0.00 0.00 176.35 175.15 2hnb s ILE 7 N -2.49 2.40 0.54 -0.59 1.01 0.14 -1.22 121.20 120.99 2hnb s ILE 7 Ca 0.63 -3.47 -0.13 0.00 0.00 0.00 0.00 60.65 57.68 2hnb s ILE 7 Cb -0.16 -2.64 -0.06 0.00 0.01 0.00 0.00 42.46 39.62 2hnb s ILE 7 CO 0.38 -0.90 0.97 -0.44 0.00 0.00 0.00 174.94 174.95 2hnb s SER 8 N -0.54 6.43 0.00 3.58 0.01 0.40 -1.15 113.70 122.42 2hnb s SER 8 Ca 0.20 1.41 0.00 0.00 1.31 0.00 0.00 55.95 58.88 2hnb s SER 8 Cb -0.18 -2.45 0.00 0.00 0.21 0.00 0.00 66.02 63.60 2hnb s SER 8 CO -0.06 -0.68 0.00 0.61 0.41 0.00 0.00 173.24 173.52 2hnb n GLY 9 N -2.07 2.09 3.32 3.44 0.00 -1.23 -1.56 105.19 109.18 2hnb n GLY 9 Ca 0.05 0.09 -0.13 0.00 0.00 0.00 0.00 46.02 46.04 2hnb n GLY 9 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2hnb s SER 10 N 0.00 -0.28 0.04 1.61 1.04 -1.26 -3.69 113.70 111.16 2hnb s SER 10 Ca 0.00 0.00 -0.19 0.00 0.48 0.00 0.00 55.95 56.24 2hnb s SER 10 Cb 0.00 0.42 -0.16 0.00 0.10 0.00 0.00 66.02 66.38 2hnb s SER 10 CO 0.00 -0.65 1.28 0.71 0.98 0.00 0.00 173.24 175.56 2hnb h THR 11 N 3.05 1.37 0.00 2.02 1.35 -1.97 -3.24 112.91 115.48 2hnb h THR 11 Ca -0.31 -1.60 -0.02 0.00 -0.55 0.00 0.00 66.41 63.93 2hnb h THR 11 Cb 1.20 2.04 -0.00 0.00 -1.73 0.00 0.00 68.15 69.66 2hnb h THR 11 CO 0.43 0.48 -0.11 0.17 -0.25 0.00 0.00 175.52 176.24 2hnb h LEU 12 N 0.07 0.00 -0.95 3.87 -0.00 -1.99 -3.47 115.31 112.84 2hnb h LEU 12 Ca -0.00 0.00 -0.17 0.00 -0.00 0.00 0.00 57.88 57.71 2hnb h LEU 12 Cb 0.92 0.00 0.06 0.00 -0.00 0.00 0.00 40.66 41.64 2hnb h LEU 12 CO 0.07 0.11 -0.29 0.61 -0.00 0.00 0.00 178.44 178.94 2hnb n GLY 13 N -0.80 0.32 0.00 0.17 0.00 -1.23 -4.94 105.19 98.71 2hnb n GLY 13 Ca -0.02 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.72 2hnb n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hnb n GLY 14 N -1.14 0.04 0.30 -0.02 0.00 -1.26 -4.69 105.19 98.43 2hnb n GLY 14 Ca 0.00 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.21 2hnb n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hnb h ALA 15 N 0.00 1.08 -0.56 4.61 0.00 -1.92 -2.23 119.26 120.23 2hnb h ALA 15 Ca 0.00 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 2hnb h ALA 15 Cb 0.00 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 2hnb h ALA 15 CO 0.00 0.03 0.34 0.93 0.00 0.00 0.00 179.25 180.55 2hnb h GLU 16 N 0.00 0.76 -0.25 0.00 5.08 -1.91 0.12 114.58 118.38 2hnb h GLU 16 Ca -0.00 -0.06 -0.19 0.00 -1.00 0.00 0.00 59.36 58.11 2hnb h GLU 16 Cb 0.22 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.31 2hnb h GLU 16 CO 0.00 0.53 -0.59 1.88 -1.00 0.00 0.00 179.01 179.83 2hnb h TYR 17 N 0.77 1.09 -0.41 4.33 0.05 -1.74 -0.36 116.97 120.71 2hnb h TYR 17 Ca 0.20 -0.41 -0.14 0.00 0.05 0.00 0.00 58.73 58.43 2hnb h TYR 17 Cb -0.03 -0.20 -0.01 0.00 1.01 0.00 0.00 36.73 37.51 2hnb h TYR 17 CO 0.00 1.24 -0.31 0.28 -1.05 0.00 0.00 178.16 178.32 2hnb h VAL 18 N 0.62 1.27 -0.61 -2.88 2.07 -1.52 -0.98 116.25 114.22 2hnb h VAL 18 Ca -0.00 -1.47 -0.02 0.00 0.82 0.00 0.00 66.70 66.02 2hnb h VAL 18 Cb 1.21 1.28 -0.03 0.00 -1.52 0.00 0.00 31.29 32.23 2hnb h VAL 18 CO 0.13 0.50 0.31 0.00 0.02 0.00 0.00 177.57 178.52 2hnb h ALA 19 N 0.87 0.79 -0.69 1.67 0.00 -0.70 -0.05 119.26 121.15 2hnb h ALA 19 Ca 0.08 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 2hnb h ALA 19 Cb 0.88 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 2hnb h ALA 19 CO 0.08 0.34 0.34 1.49 0.00 0.00 0.00 179.25 181.50 2hnb h GLU 20 N 0.84 0.98 -0.16 0.00 4.81 -0.84 0.70 114.58 120.91 2hnb h GLU 20 Ca 0.21 -0.14 -0.00 0.00 -0.13 0.00 0.00 59.36 59.30 2hnb h GLU 20 Cb 0.10 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.29 2hnb h GLU 20 CO -0.03 0.77 0.09 1.25 -0.73 0.00 0.00 179.01 180.36 2hnb h HIS 21 N 0.95 0.22 -0.38 0.92 2.76 -0.80 -0.02 115.15 118.80 2hnb h HIS 21 Ca 0.24 -0.00 0.01 0.00 -2.20 0.00 0.00 60.37 58.41 2hnb h HIS 21 Cb 0.10 -0.07 -0.02 0.00 1.55 0.00 0.00 27.41 28.97 2hnb h HIS 21 CO 0.00 0.21 0.24 -0.07 -1.30 0.00 0.00 177.93 177.02 2hnb h LEU 22 N 0.16 0.41 -1.06 0.26 3.38 -0.77 -0.92 115.31 116.77 2hnb h LEU 22 Ca 0.06 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 2hnb h LEU 22 Cb 0.07 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.68 2hnb h LEU 22 CO -0.01 0.30 0.40 0.00 0.09 0.00 0.00 178.44 179.22 2hnb h ALA 23 N 1.15 1.28 -0.20 1.53 0.00 -0.67 -0.88 119.26 121.47 2hnb h ALA 23 Ca 0.14 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 2hnb h ALA 23 Cb -0.04 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.44 2hnb h ALA 23 CO -0.04 0.58 -0.13 1.49 0.00 0.00 0.00 179.25 181.14 2hnb h GLU 24 N 1.06 0.44 -0.77 0.00 4.57 -0.58 -0.75 114.58 118.55 2hnb h GLU 24 Ca 0.27 -0.21 -0.02 0.00 -1.18 0.00 0.00 59.36 58.22 2hnb h GLU 24 Cb 0.05 -0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 28.60 2hnb h GLU 24 CO -0.04 0.76 0.40 0.87 -1.18 0.00 0.00 179.01 179.81 2hnb h LYS 25 N 0.12 1.09 -0.64 1.92 1.79 -0.92 -0.27 116.57 119.66 2hnb h LYS 25 Ca 0.04 -0.14 -0.04 0.00 -2.18 0.00 0.00 60.65 58.33 2hnb h LYS 25 Cb 0.65 -0.21 -0.03 0.00 -1.58 0.00 0.00 32.23 31.06 2hnb h LYS 25 CO 0.04 0.83 0.25 -0.07 -1.08 0.00 0.00 179.45 179.42 2hnb h LEU 26 N 1.07 0.85 -0.65 2.94 3.38 -1.12 -0.99 115.31 120.79 2hnb h LEU 26 Ca 0.27 -0.11 -0.11 0.00 0.09 0.00 0.00 57.88 58.01 2hnb h LEU 26 Cb 0.07 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 2hnb h LEU 26 CO -0.04 0.76 -0.14 -0.08 0.09 0.00 0.00 178.44 179.04 2hnb h GLU 27 N 0.91 0.91 -0.37 1.13 4.81 -0.13 -0.65 114.58 121.20 2hnb h GLU 27 Ca 0.22 -0.34 -0.07 0.00 -0.13 0.00 0.00 59.36 59.04 2hnb h GLU 27 Cb 0.18 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.48 2hnb h GLU 27 CO -0.02 0.99 -0.08 0.93 -0.73 0.00 0.00 179.01 180.09 2hnb h GLU 28 N 0.81 0.62 0.00 1.92 5.08 -0.83 -1.88 114.58 120.30 2hnb h GLU 28 Ca 0.13 -0.18 -0.05 0.00 -1.00 0.00 0.00 59.36 58.26 2hnb h GLU 28 Cb 0.67 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.85 2hnb h GLU 28 CO 0.05 0.70 -0.24 0.00 -1.00 0.00 0.00 179.01 178.52 2hnb h ALA 29 N 1.34 1.41 0.00 3.43 0.00 -0.71 -3.47 119.26 121.26 2hnb h ALA 29 Ca 0.11 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2hnb h ALA 29 Cb 0.49 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2hnb h ALA 29 CO 0.03 0.29 0.00 0.41 0.00 0.00 0.00 179.25 179.98 2hnb n GLY 30 N -0.64 0.91 3.78 0.00 0.00 -0.35 -5.09 105.19 103.80 2hnb n GLY 30 Ca -0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.63 2hnb n GLY 30 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2hnb s PHE 31 N -1.06 3.73 0.33 1.61 0.08 -0.60 -4.94 117.98 117.13 2hnb s PHE 31 Ca 0.00 1.80 -0.28 0.00 0.12 0.00 0.00 56.93 58.57 2hnb s PHE 31 Cb 0.00 -2.93 -0.10 0.00 -0.57 0.00 0.00 43.02 39.42 2hnb s PHE 31 CO 0.00 0.25 1.18 0.95 -0.10 0.00 0.00 175.22 177.50 2hnb s THR 32 N -1.56 3.15 0.11 0.64 -4.23 -1.26 -3.73 115.64 108.75 2hnb s THR 32 Ca 0.49 1.11 0.02 0.00 -1.18 0.00 0.00 61.69 62.13 2hnb s THR 32 Cb -0.20 -3.69 -0.04 0.00 1.34 0.00 0.00 72.50 69.92 2hnb s THR 32 CO 0.25 0.23 -0.07 0.42 -0.54 0.00 0.00 174.62 174.90 2hnb s THR 33 N -1.22 0.79 0.16 3.99 -4.23 -1.26 -1.48 115.64 112.38 2hnb s THR 33 Ca 0.49 -1.92 -0.14 0.00 -1.18 0.00 0.00 61.69 58.94 2hnb s THR 33 Cb -0.34 -1.66 0.02 0.00 1.34 0.00 0.00 72.50 71.86 2hnb s THR 33 CO 0.44 -0.82 0.39 -0.70 -0.54 0.00 0.00 174.62 173.40 2hnb s GLU 34 N -3.69 1.18 -0.47 3.99 2.56 -1.20 -4.81 118.70 116.25 2hnb s GLU 34 Ca 0.12 -0.91 0.04 0.00 0.00 0.00 0.00 54.97 54.23 2hnb s GLU 34 Cb 0.04 0.45 0.18 0.00 2.00 0.00 0.00 34.13 36.80 2hnb s GLU 34 CO -0.03 -0.46 0.39 0.25 -0.56 0.00 0.00 175.26 174.84 2hnb n THR 35 N -0.25 -0.57 -2.41 -1.70 -2.24 -1.26 -0.15 114.28 105.71 2hnb n THR 35 Ca -0.12 -3.77 -0.43 0.00 -2.27 0.00 0.00 64.05 57.46 2hnb n THR 35 Cb 0.63 -1.78 -0.02 0.00 -2.10 0.00 0.00 70.33 67.06 2hnb n THR 35 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2hnb s LEU 36 N -0.36 3.80 -0.46 3.22 1.43 -0.36 -4.80 118.68 121.16 2hnb s LEU 36 Ca 0.32 1.09 -0.27 0.00 -1.03 0.00 0.00 54.13 54.23 2hnb s LEU 36 Cb 0.03 -3.54 0.03 0.00 0.03 0.00 0.00 46.19 42.74 2hnb s LEU 36 CO -0.19 -1.18 1.02 -2.28 0.23 0.00 0.00 176.35 173.95 2hnb s HIS 37 N 4.66 2.90 -1.18 0.29 5.65 -1.26 -0.46 115.29 125.89 2hnb s HIS 37 Ca 0.57 0.58 -0.01 0.00 0.25 0.00 0.00 55.06 56.45 2hnb s HIS 37 Cb -0.16 -4.13 -0.01 0.00 -1.18 0.00 0.00 32.58 27.10 2hnb s HIS 37 CO 0.26 -1.14 0.95 0.41 -0.65 0.00 0.00 174.74 174.57 2hnb n GLY 38 N 4.82 -0.51 3.51 1.59 0.00 -0.60 -4.97 105.19 109.04 2hnb n GLY 38 Ca 0.09 0.20 -0.30 0.00 0.00 0.00 0.00 46.02 46.00 2hnb n GLY 38 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2hnb s PRO 39 N -5.25 -1.70 0.20 1.61 0.04 -1.26 -4.83 135.00 123.80 2hnb s PRO 39 Ca 0.09 -0.01 0.04 0.00 0.04 0.00 0.00 61.00 61.16 2hnb s PRO 39 Cb -0.01 -1.53 -0.05 0.00 0.04 0.00 0.00 34.50 32.94 2hnb s PRO 39 CO 0.74 -4.04 -0.04 -0.51 0.04 0.00 0.00 177.00 173.19 2hnb s LEU 40 N -7.19 2.31 0.35 -3.56 1.43 -1.26 -4.51 118.68 106.26 2hnb s LEU 40 Ca 0.70 -1.15 0.03 0.00 -1.03 0.00 0.00 54.13 52.68 2hnb s LEU 40 Cb -0.11 -0.31 0.65 0.00 0.03 0.00 0.00 46.19 46.45 2hnb s LEU 40 CO 0.57 -0.44 2.01 0.25 0.23 0.00 0.00 176.35 178.97 2hnb h LEU 41 N 2.57 0.71 0.00 1.79 5.85 -1.90 -0.85 115.31 123.48 2hnb h LEU 41 Ca -0.38 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.32 2hnb h LEU 41 Cb 1.21 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 42.06 2hnb h LEU 41 CO 0.64 0.52 0.00 -1.84 -0.34 0.00 0.00 178.44 177.42 2hnb n GLU 42 N -4.44 0.24 -0.61 1.25 0.28 -1.26 -2.66 120.64 113.43 2hnb n GLU 42 Ca 0.06 0.12 0.03 0.00 -0.16 0.00 0.00 57.16 57.21 2hnb n GLU 42 Cb 0.05 -1.50 0.05 0.00 1.43 0.00 0.00 31.44 31.46 2hnb n GLU 42 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 2hnb n ASP 43 N -1.19 0.79 -3.76 -1.84 2.03 -0.35 -5.03 116.55 107.20 2hnb n ASP 43 Ca 0.07 -2.36 -0.20 0.00 0.52 0.00 0.00 54.79 52.82 2hnb n ASP 43 Cb 0.08 -0.29 -0.17 0.00 -0.72 0.00 0.00 41.12 40.01 2hnb n ASP 43 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2hnb s LEU 44 N -0.81 0.65 0.73 -2.67 1.43 -1.06 -4.76 118.68 112.18 2hnb s LEU 44 Ca 0.16 -0.02 -0.11 0.00 -1.03 0.00 0.00 54.13 53.12 2hnb s LEU 44 Cb 0.16 -0.29 0.03 0.00 0.03 0.00 0.00 46.19 46.11 2hnb s LEU 44 CO -0.03 -0.18 1.08 -2.16 0.23 0.00 0.00 176.35 175.29 2hnb s PRO 45 N 1.72 2.64 -0.01 1.29 0.04 -1.26 -4.88 135.00 134.54 2hnb s PRO 45 Ca 0.00 1.08 0.01 0.00 0.04 0.00 0.00 61.00 62.13 2hnb s PRO 45 Cb -0.13 -1.95 0.04 0.00 0.04 0.00 0.00 34.50 32.51 2hnb s PRO 45 CO -0.03 -1.34 0.69 0.00 0.04 0.00 0.00 177.00 176.36 2hnb n ALA 46 N -3.24 2.55 -3.57 8.56 0.00 -1.26 -4.74 120.51 118.81 2hnb n ALA 46 Ca 0.08 -0.09 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 2hnb n ALA 46 Cb 0.53 -1.00 -0.13 0.00 0.00 0.00 0.00 19.45 18.85 2hnb n ALA 46 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2hnb s SER 47 N -0.31 -0.23 0.00 0.00 0.01 -1.26 -2.63 113.70 109.28 2hnb s SER 47 Ca 0.03 0.47 0.00 0.00 1.31 0.00 0.00 55.95 57.76 2hnb s SER 47 Cb 0.02 0.39 0.00 0.00 0.21 0.00 0.00 66.02 66.64 2hnb s SER 47 CO 0.01 -0.14 0.00 0.61 0.41 0.00 0.00 173.24 174.13 2hnb n GLY 48 N 3.92 0.11 2.99 3.44 0.00 -1.11 -4.87 105.19 109.67 2hnb n GLY 48 Ca -0.22 -1.50 -0.31 0.00 0.00 0.00 0.00 46.02 43.98 2hnb n GLY 48 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2hnb s ILE 49 N -1.71 2.56 0.55 -0.61 1.09 -1.24 -0.96 121.20 120.88 2hnb s ILE 49 Ca 0.00 -2.90 -0.00 0.00 -1.10 0.00 0.00 60.65 56.64 2hnb s ILE 49 Cb 0.00 -2.81 0.03 0.00 -1.06 0.00 0.00 42.46 38.62 2hnb s ILE 49 CO 0.00 -0.73 0.80 0.26 -0.10 0.00 0.00 174.94 175.17 2hnb s TRP 50 N 0.21 2.96 -0.24 3.97 0.23 0.15 -4.00 118.94 122.22 2hnb s TRP 50 Ca 0.14 0.14 -0.03 0.00 -2.03 0.00 0.00 56.10 54.33 2hnb s TRP 50 Cb -0.23 -2.73 0.11 0.00 0.03 0.00 0.00 33.47 30.66 2hnb s TRP 50 CO -0.03 -0.84 0.26 -1.17 0.96 0.00 0.00 176.95 176.12 2hnb s LEU 51 N -4.80 -0.17 0.18 2.99 2.96 -1.21 -2.38 118.68 116.24 2hnb s LEU 51 Ca 0.56 -0.42 -0.11 0.00 -0.22 0.00 0.00 54.13 53.93 2hnb s LEU 51 Cb -0.10 0.46 -0.07 0.00 0.50 0.00 0.00 46.19 46.98 2hnb s LEU 51 CO 0.40 -0.35 0.53 -0.69 -1.32 0.00 0.00 176.35 174.91 2hnb s VAL 52 N 2.35 4.93 -0.00 1.68 1.01 0.06 -0.69 120.40 129.74 2hnb s VAL 52 Ca 0.08 0.57 0.03 0.00 0.00 0.00 0.00 61.98 62.67 2hnb s VAL 52 Cb -0.15 -3.66 -0.01 0.00 0.00 0.00 0.00 36.38 32.56 2hnb s VAL 52 CO -0.21 0.08 -0.10 -0.63 0.00 0.00 0.00 175.10 174.23 2hnb s ILE 53 N -1.65 0.82 -0.01 2.22 1.09 -0.30 -1.33 121.20 122.04 2hnb s ILE 53 Ca 0.42 -0.49 -0.17 0.00 -1.10 0.00 0.00 60.65 59.31 2hnb s ILE 53 Cb -0.13 -0.69 0.03 0.00 -1.06 0.00 0.00 42.46 40.61 2hnb s ILE 53 CO 0.20 0.19 0.36 -0.44 -0.10 0.00 0.00 174.94 175.16 2hnb s SER 54 N -0.34 -0.25 0.76 3.58 0.01 -0.82 -3.52 113.70 113.12 2hnb s SER 54 Ca 0.03 0.12 -0.11 0.00 1.31 0.00 0.00 55.95 57.31 2hnb s SER 54 Cb -0.04 0.35 0.05 0.00 0.21 0.00 0.00 66.02 66.59 2hnb s SER 54 CO -0.00 -0.50 1.10 -0.44 0.41 0.00 0.00 173.24 173.80 2hnb s SER 55 N -1.44 4.56 -0.39 2.44 0.01 -1.25 -1.54 113.70 116.09 2hnb s SER 55 Ca -0.12 1.85 0.10 0.00 1.31 0.00 0.00 55.95 59.10 2hnb s SER 55 Cb -0.04 -2.53 0.31 0.00 0.21 0.00 0.00 66.02 63.98 2hnb s SER 55 CO 0.04 -2.00 0.67 0.35 0.41 0.00 0.00 173.24 172.71 2hnb n THR 56 N -3.38 -0.14 0.58 1.44 -2.24 0.46 -4.67 114.28 106.33 2hnb n THR 56 Ca 0.09 -4.45 -0.01 0.00 -2.27 0.00 0.00 64.05 57.42 2hnb n THR 56 Cb 0.53 -0.95 0.07 0.00 -2.10 0.00 0.00 70.33 67.88 2hnb n THR 56 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 2hnb n HIS 57 N 0.66 0.51 0.00 4.78 -0.00 -1.26 -3.49 115.22 116.42 2hnb n HIS 57 Ca 0.24 -0.35 0.00 0.00 0.46 0.00 0.00 57.72 58.07 2hnb n HIS 57 Cb 0.60 -0.25 0.00 0.00 -0.12 0.00 0.00 29.99 30.21 2hnb n HIS 57 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2hnb n GLY 58 N 0.14 2.77 0.14 1.57 0.00 -1.26 -4.89 105.19 103.66 2hnb n GLY 58 Ca 0.08 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.10 2hnb n GLY 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hnb h ALA 59 N 0.00 0.94 -3.87 4.61 0.00 -1.96 -3.48 119.26 115.50 2hnb h ALA 59 Ca 0.00 -0.54 -0.41 0.00 0.00 0.00 0.00 54.91 53.96 2hnb h ALA 59 Cb 0.00 -0.09 0.03 0.00 0.00 0.00 0.00 17.79 17.72 2hnb h ALA 59 CO 0.00 0.74 -0.58 0.41 0.00 0.00 0.00 179.25 179.82 2hnb n GLY 60 N 0.32 -0.51 3.09 0.00 0.00 -1.26 -5.00 105.19 101.84 2hnb n GLY 60 Ca -0.01 0.08 -0.11 0.00 0.00 0.00 0.00 46.02 45.98 2hnb n GLY 60 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2hnb s ASP 61 N -2.45 0.02 0.40 1.61 2.15 -1.26 -3.57 116.67 113.57 2hnb s ASP 61 Ca 0.18 -0.18 -0.26 0.00 0.43 0.00 0.00 52.55 52.72 2hnb s ASP 61 Cb -0.08 0.21 -0.09 0.00 -0.30 0.00 0.00 42.92 42.66 2hnb s ASP 61 CO 0.23 -0.34 1.33 -0.63 -0.17 0.00 0.00 175.17 175.59 2hnb s ILE 62 N -1.27 2.52 0.45 4.11 1.01 -1.26 -4.53 121.20 122.24 2hnb s ILE 62 Ca -0.14 0.48 -0.25 0.00 0.00 0.00 0.00 60.65 60.75 2hnb s ILE 62 Cb -0.07 -3.29 -0.08 0.00 0.01 0.00 0.00 42.46 39.03 2hnb s ILE 62 CO 0.01 0.08 1.37 -2.16 0.00 0.00 0.00 174.94 174.25 2hnb s PRO 63 N -2.20 3.68 0.55 2.79 0.04 -1.26 -4.55 135.00 134.04 2hnb s PRO 63 Ca 0.56 2.29 0.25 0.00 0.04 0.00 0.00 61.00 64.14 2hnb s PRO 63 Cb -0.40 -2.61 1.46 0.00 0.04 0.00 0.00 34.50 32.99 2hnb s PRO 63 CO 0.51 -0.78 2.05 0.22 0.04 0.00 0.00 177.00 179.05 2hnb h ASP 64 N 2.27 0.00 0.80 6.66 3.58 -1.91 0.75 116.42 128.57 2hnb h ASP 64 Ca -0.50 0.00 -0.06 0.00 0.42 0.00 0.00 57.03 56.89 2hnb h ASP 64 Cb 1.27 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.31 2hnb h ASP 64 CO 0.61 0.00 -0.28 -0.55 -2.88 0.00 0.00 179.24 176.14 2hnb h ASN 65 N 0.00 0.00 0.00 2.28 -1.07 -1.90 -3.36 115.58 111.53 2hnb h ASN 65 Ca 0.15 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.52 2hnb h ASN 65 Cb 0.66 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.91 2hnb h ASN 65 CO -0.00 0.28 -0.97 -0.11 0.07 0.00 0.00 177.43 176.69 2hnb n LEU 66 N -3.51 0.00 -0.02 6.14 7.94 -0.23 -4.31 117.00 123.01 2hnb n LEU 66 Ca -0.00 0.00 0.20 0.00 -1.11 0.00 0.00 56.01 55.10 2hnb n LEU 66 Cb 0.44 0.00 0.68 0.00 0.53 0.00 0.00 43.42 45.07 2hnb n LEU 66 CO 0.35 0.00 1.19 0.77 -1.11 0.00 0.00 177.39 178.58 2hnb h SER 67 N 0.00 0.03 -0.38 1.96 4.64 -1.07 -0.00 113.55 118.72 2hnb h SER 67 Ca 0.00 0.00 0.11 0.00 -0.47 0.00 0.00 61.79 61.43 2hnb h SER 67 Cb 0.34 -0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.41 2hnb h SER 67 CO 0.00 0.02 0.47 -0.65 -0.87 0.00 0.00 176.83 175.80 2hnb h PRO 68 N 0.03 0.00 -0.45 4.77 0.11 -1.86 -1.39 132.00 133.21 2hnb h PRO 68 Ca 0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.38 2hnb h PRO 68 Cb 1.02 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.11 2hnb h PRO 68 CO -0.01 0.00 0.29 0.35 -0.21 0.00 0.00 178.00 178.42 2hnb h PHE 69 N 0.00 0.58 -0.49 0.65 3.57 -1.22 -0.33 116.94 119.71 2hnb h PHE 69 Ca 0.18 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.63 2hnb h PHE 69 Cb 1.13 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 39.65 2hnb h PHE 69 CO 0.00 0.37 0.05 -0.92 -2.23 0.00 0.00 178.31 175.59 2hnb h TYR 70 N 0.61 0.81 -0.27 0.41 3.20 -1.43 -0.15 116.97 120.15 2hnb h TYR 70 Ca 0.16 -0.09 -0.03 0.00 3.14 0.00 0.00 58.73 61.91 2hnb h TYR 70 Cb -0.05 -0.23 -0.01 0.00 1.54 0.00 0.00 36.73 37.98 2hnb h TYR 70 CO -0.04 0.72 0.04 0.93 -1.64 0.00 0.00 178.16 178.17 2hnb h GLU 71 N 0.73 0.45 -0.58 1.82 4.39 -1.37 -1.73 114.58 118.29 2hnb h GLU 71 Ca 0.15 -0.13 -0.08 0.00 0.34 0.00 0.00 59.36 59.65 2hnb h GLU 71 Cb 0.37 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.95 2hnb h GLU 71 CO 0.01 0.58 0.07 0.00 -1.16 0.00 0.00 179.01 178.50 2hnb h ALA 72 N 0.86 0.77 0.22 3.43 0.00 -0.76 -1.28 119.26 122.50 2hnb h ALA 72 Ca 0.08 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 2hnb h ALA 72 Cb 0.35 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2hnb h ALA 72 CO 0.01 0.55 -0.11 -0.07 0.00 0.00 0.00 179.25 179.63 2hnb h LEU 73 N 0.88 -0.25 -1.01 0.00 3.38 -0.97 -1.09 115.31 116.24 2hnb h LEU 73 Ca 0.17 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 58.05 2hnb h LEU 73 Cb 0.46 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 2hnb h LEU 73 CO 0.02 -0.16 -0.43 0.06 0.09 0.00 0.00 178.44 178.02 2hnb h GLN 74 N -0.32 0.00 0.10 1.13 3.07 -1.26 0.22 115.11 118.05 2hnb h GLN 74 Ca -0.03 0.00 -0.00 0.00 0.09 0.00 0.00 58.65 58.70 2hnb h GLN 74 Cb 0.25 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.81 2hnb h GLN 74 CO 0.05 0.43 -0.05 1.49 0.09 0.00 0.00 178.83 180.84 2hnb h GLU 75 N 0.00 -0.13 0.00 0.06 4.81 -1.07 -3.34 114.58 114.91 2hnb h GLU 75 Ca -0.00 0.01 -0.10 0.00 -0.13 0.00 0.00 59.36 59.13 2hnb h GLU 75 Cb 0.88 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.27 2hnb h GLU 75 CO 0.06 0.24 -0.85 1.96 -0.73 0.00 0.00 179.01 179.68 2hnb h GLN 76 N -0.52 0.00 -6.85 1.92 4.20 -1.08 -3.49 115.11 109.29 2hnb h GLN 76 Ca -0.01 0.00 -0.58 0.00 0.06 0.00 0.00 58.65 58.12 2hnb h GLN 76 Cb 0.43 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.21 2hnb h GLN 76 CO 0.02 0.30 -1.01 1.63 -0.67 0.00 0.00 178.83 179.10 2hnb n LYS 77 N -3.01 -0.37 -0.98 1.46 5.02 0.05 -4.95 118.16 115.38 2hnb n LYS 77 Ca -0.02 0.13 -0.30 0.00 -2.02 0.00 0.00 58.31 56.10 2hnb n LYS 77 Cb 0.72 -2.72 0.24 0.00 -0.02 0.00 0.00 35.03 33.25 2hnb n LYS 77 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2hnb s PRO 78 N -7.24 -1.24 -0.39 1.97 0.04 -1.26 -5.01 135.00 121.87 2hnb s PRO 78 Ca 0.49 0.06 -0.09 0.00 0.04 0.00 0.00 61.00 61.50 2hnb s PRO 78 Cb -0.26 -1.58 0.06 0.00 0.04 0.00 0.00 34.50 32.76 2hnb s PRO 78 CO 0.96 -3.75 0.22 0.34 0.04 0.00 0.00 177.00 174.81 2hnb s ASP 79 N -3.70 5.61 -0.17 6.66 2.15 -1.26 -4.52 116.67 121.44 2hnb s ASP 79 Ca 0.70 -1.30 0.15 0.00 0.43 0.00 0.00 52.55 52.53 2hnb s ASP 79 Cb -0.12 -1.98 0.35 0.00 -0.30 0.00 0.00 42.92 40.88 2hnb s ASP 79 CO 0.57 -0.46 1.19 0.18 -0.17 0.00 0.00 175.17 176.48 2hnb n LEU 80 N 4.92 2.58 0.01 -1.34 4.77 0.15 -4.84 117.00 123.25 2hnb n LEU 80 Ca -0.11 -3.44 0.00 0.00 -0.03 0.00 0.00 56.01 52.43 2hnb n LEU 80 Cb 0.44 -0.48 0.02 0.00 -2.33 0.00 0.00 43.42 41.07 2hnb n LEU 80 CO 0.37 1.01 0.51 -1.20 -1.33 0.00 0.00 177.39 176.75 2hnb n SER 81 N -1.28 0.01 -0.24 -1.43 7.64 -1.23 -0.83 113.62 116.26 2hnb n SER 81 Ca 0.18 0.33 0.04 0.00 1.01 0.00 0.00 58.87 60.42 2hnb n SER 81 Cb 0.68 -0.33 0.02 0.00 -1.01 0.00 0.00 64.21 63.57 2hnb n SER 81 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2hnb n ALA 82 N -1.33 2.55 -1.81 -0.43 0.00 -1.23 -4.66 120.51 113.59 2hnb n ALA 82 Ca -0.00 -0.49 -0.38 0.00 0.00 0.00 0.00 53.44 52.56 2hnb n ALA 82 Cb 0.18 -0.25 -0.06 0.00 0.00 0.00 0.00 19.45 19.33 2hnb n ALA 82 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2hnb s VAL 83 N -0.78 4.20 0.05 0.00 1.01 -0.01 -2.74 120.40 122.13 2hnb s VAL 83 Ca 0.08 1.89 0.06 0.00 0.00 0.00 0.00 61.98 64.00 2hnb s VAL 83 Cb 0.06 -4.15 -0.03 0.00 0.00 0.00 0.00 36.38 32.26 2hnb s VAL 83 CO 0.12 0.34 -0.16 -0.60 0.00 0.00 0.00 175.10 174.81 2hnb s ARG 84 N -1.57 0.99 0.25 2.72 6.06 -0.13 -3.59 118.95 123.67 2hnb s ARG 84 Ca 0.44 -0.87 0.01 0.00 -2.50 0.00 0.00 55.73 52.81 2hnb s ARG 84 Cb -0.22 -1.04 -0.04 0.00 0.06 0.00 0.00 34.95 33.71 2hnb s ARG 84 CO 0.27 0.25 0.14 -0.59 -2.50 0.00 0.00 175.30 172.88 2hnb s PHE 85 N -0.97 1.39 0.17 5.12 -0.12 -0.59 -0.67 117.98 122.32 2hnb s PHE 85 Ca 0.02 -1.36 -0.04 0.00 -0.05 0.00 0.00 56.93 55.51 2hnb s PHE 85 Cb -0.09 -0.71 -0.03 0.00 -0.63 0.00 0.00 43.02 41.56 2hnb s PHE 85 CO 0.02 -0.57 0.17 0.20 -0.05 0.00 0.00 175.22 174.99 2hnb s GLY 86 N -3.26 1.02 -0.11 1.99 0.00 -1.00 -0.20 107.32 105.76 2hnb s GLY 86 Ca 0.38 -1.39 -0.08 0.00 0.00 0.00 0.00 44.72 43.63 2hnb s GLY 86 CO 0.15 -1.21 0.28 0.00 0.00 0.00 0.00 173.10 172.32 2hnb s ALA 87 N -4.07 -0.68 -0.05 3.20 0.00 -1.26 -0.76 121.76 118.14 2hnb s ALA 87 Ca 0.28 0.97 0.03 0.00 0.00 0.00 0.00 51.96 53.24 2hnb s ALA 87 Cb 0.06 -0.59 0.01 0.00 0.00 0.00 0.00 23.12 22.59 2hnb s ALA 87 CO 0.06 -0.18 -0.14 0.42 0.00 0.00 0.00 175.76 175.92 2hnb s ILE 88 N 0.79 1.20 -0.14 0.00 -1.09 -0.44 -2.07 121.20 119.45 2hnb s ILE 88 Ca -0.05 -0.55 -0.01 0.00 -2.23 0.00 0.00 60.65 57.80 2hnb s ILE 88 Cb -0.06 -1.07 -0.02 0.00 -1.58 0.00 0.00 42.46 39.73 2hnb s ILE 88 CO -0.05 0.36 -0.09 -0.83 -1.23 0.00 0.00 174.94 173.10 2hnb s GLY 89 N 0.36 1.61 -0.09 6.18 0.00 -0.49 -1.95 107.32 112.94 2hnb s GLY 89 Ca -0.09 -0.86 0.01 0.00 0.00 0.00 0.00 44.72 43.78 2hnb s GLY 89 CO 0.03 -0.17 -0.13 -0.42 0.00 0.00 0.00 173.10 172.41 2hnb s ILE 90 N 0.29 1.27 -0.36 0.90 1.01 -0.59 -0.60 121.20 123.13 2hnb s ILE 90 Ca -0.07 -0.51 0.00 0.00 0.00 0.00 0.00 60.65 60.06 2hnb s ILE 90 Cb -0.15 -1.18 0.00 0.00 0.01 0.00 0.00 42.46 41.14 2hnb s ILE 90 CO 0.04 0.39 0.00 0.61 0.00 0.00 0.00 174.94 175.99 2hnb n GLY 91 N 4.20 -0.80 3.07 6.18 0.00 -0.97 -0.41 105.19 116.47 2hnb n GLY 91 Ca -0.19 -0.19 -0.34 0.00 0.00 0.00 0.00 46.02 45.29 2hnb n GLY 91 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2hnb s SER 92 N -4.00 5.04 0.19 1.61 0.01 -1.23 -0.83 113.70 114.49 2hnb s SER 92 Ca 0.00 -2.15 0.17 0.00 1.31 0.00 0.00 55.95 55.28 2hnb s SER 92 Cb 0.00 -1.75 0.81 0.00 0.21 0.00 0.00 66.02 65.29 2hnb s SER 92 CO 0.00 -0.46 1.53 0.54 0.41 0.00 0.00 173.24 175.26 2hnb n ARG 93 N 4.36 0.11 0.14 12.44 3.00 -1.26 -0.60 116.66 134.85 2hnb n ARG 93 Ca 0.01 0.47 0.16 0.00 -0.01 0.00 0.00 57.85 58.48 2hnb n ARG 93 Cb 0.41 -1.77 0.73 0.00 0.00 0.00 0.00 32.46 31.84 2hnb n ARG 93 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.63 179.12 2hnb h GLU 94 N 0.00 0.00 0.00 5.56 4.57 -2.00 -3.28 114.58 119.43 2hnb h GLU 94 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 2hnb h GLU 94 Cb 0.18 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.77 2hnb h GLU 94 CO 0.00 0.00 -0.84 0.66 -1.18 0.00 0.00 179.01 177.65 2hnb n TYR 95 N -4.19 0.00 0.00 0.92 4.01 -0.53 -5.04 117.16 112.33 2hnb n TYR 95 Ca 0.04 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.78 2hnb n TYR 95 Cb 0.37 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.40 2hnb n TYR 95 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 2hnb n ASP 96 N -1.85 0.00 -1.47 7.72 2.03 0.23 -4.83 116.55 118.39 2hnb n ASP 96 Ca 0.00 0.00 0.19 0.00 0.52 0.00 0.00 54.79 55.50 2hnb n ASP 96 Cb 0.42 -0.58 -0.07 0.00 -0.72 0.00 0.00 41.12 40.17 2hnb n ASP 96 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 2hnb n THR 97 N -1.58 0.00 1.23 5.18 -1.04 -1.26 -4.40 114.28 112.40 2hnb n THR 97 Ca 0.00 0.41 0.11 0.00 -2.04 0.00 0.00 64.05 62.53 2hnb n THR 97 Cb 0.00 -0.91 0.61 0.00 -1.82 0.00 0.00 70.33 68.21 2hnb n THR 97 CO 0.00 0.00 0.00 0.33 -0.64 0.00 0.00 175.07 174.76 2hnb n PHE 98 N -4.32 0.00 -0.65 -1.42 7.35 -1.26 -4.89 117.46 112.26 2hnb n PHE 98 Ca -0.03 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.66 2hnb n PHE 98 Cb 0.68 -0.13 0.00 0.00 0.35 0.00 0.00 39.48 40.39 2hnb n PHE 98 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2hnb h GLY 100 N 0.00 0.46 1.54 0.00 0.00 -1.91 -0.77 103.07 102.39 2hnb h GLY 100 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.25 2hnb h GLY 100 CO 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 176.54 176.49 2hnb n ALA 101 N -2.65 1.25 0.00 3.60 0.00 -1.23 -2.33 120.51 119.15 2hnb n ALA 101 Ca 0.25 -0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.68 2hnb n ALA 101 Cb 1.07 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 19.51 2hnb n ALA 101 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 2hnb n ILE 102 N -1.27 0.00 -0.29 0.00 0.13 -0.74 -3.99 119.36 113.20 2hnb n ILE 102 Ca 0.00 0.00 0.20 0.00 -1.10 0.00 0.00 62.75 61.85 2hnb n ILE 102 Cb 0.00 0.00 0.49 0.00 -0.84 0.00 0.00 39.64 39.29 2hnb n ILE 102 CO 0.00 0.00 0.00 -0.78 2.80 0.00 0.00 176.55 178.57 2hnb h ASP 103 N 0.00 0.47 0.23 9.51 3.58 -1.10 -0.89 116.42 128.21 2hnb h ASP 103 Ca 0.00 0.06 -0.01 0.00 0.42 0.00 0.00 57.03 57.50 2hnb h ASP 103 Cb 0.00 -0.02 0.00 0.00 1.72 0.00 0.00 39.33 41.03 2hnb h ASP 103 CO 0.00 0.16 -0.11 0.11 -2.88 0.00 0.00 179.24 176.52 2hnb h LYS 104 N 0.45 -0.29 -0.65 0.28 6.56 -1.72 -1.49 116.57 119.70 2hnb h LYS 104 Ca 0.52 0.02 -0.07 0.00 -1.06 0.00 0.00 60.65 60.06 2hnb h LYS 104 Cb 1.25 0.07 -0.03 0.00 -0.57 0.00 0.00 32.23 32.95 2hnb h LYS 104 CO -0.24 0.08 0.12 1.37 -2.06 0.00 0.00 179.45 178.72 2hnb h LEU 105 N -0.89 1.03 -0.28 2.94 8.10 -1.76 -2.06 115.31 122.39 2hnb h LEU 105 Ca -0.03 -0.25 -0.20 0.00 0.11 0.00 0.00 57.88 57.51 2hnb h LEU 105 Cb 0.51 -0.27 0.00 0.00 -0.44 0.00 0.00 40.66 40.46 2hnb h LEU 105 CO 0.05 1.02 -0.63 1.05 -4.11 0.00 0.00 178.44 175.82 2hnb h GLU 106 N 1.00 0.79 -0.04 0.17 4.11 -1.23 -2.33 114.58 117.05 2hnb h GLU 106 Ca 0.20 -0.56 -0.07 0.00 0.07 0.00 0.00 59.36 59.00 2hnb h GLU 106 Cb 0.42 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 2hnb h GLU 106 CO 0.01 1.18 -0.32 0.00 0.07 0.00 0.00 179.01 179.95 2hnb h ALA 107 N 0.69 1.41 -0.11 1.06 0.00 -1.19 -1.56 119.26 119.55 2hnb h ALA 107 Ca -0.01 -0.31 -0.14 0.00 0.00 0.00 0.00 54.91 54.46 2hnb h ALA 107 Cb 1.24 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 2hnb h ALA 107 CO 0.13 0.43 -0.53 1.49 0.00 0.00 0.00 179.25 180.78 2hnb h GLU 108 N 0.06 0.32 -0.69 0.00 4.57 -0.99 0.13 114.58 117.98 2hnb h GLU 108 Ca 0.01 -0.19 -0.06 0.00 -1.18 0.00 0.00 59.36 57.94 2hnb h GLU 108 Cb 0.59 0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 29.17 2hnb h GLU 108 CO 0.04 0.77 0.22 -0.07 -1.18 0.00 0.00 179.01 178.79 2hnb h LEU 109 N 0.25 1.01 -0.52 1.64 3.38 -0.93 -0.21 115.31 119.93 2hnb h LEU 109 Ca 0.01 -0.21 -0.03 0.00 0.09 0.00 0.00 57.88 57.74 2hnb h LEU 109 Cb 1.01 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.47 2hnb h LEU 109 CO 0.09 0.95 0.20 0.50 0.09 0.00 0.00 178.44 180.26 2hnb h LYS 110 N 1.02 0.79 -0.71 1.13 3.64 -0.77 -0.68 116.57 120.98 2hnb h LYS 110 Ca 0.22 -0.15 -0.04 0.00 -1.27 0.00 0.00 60.65 59.41 2hnb h LYS 110 Cb 0.30 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 31.96 2hnb h LYS 110 CO -0.01 0.70 0.28 -0.97 -2.27 0.00 0.00 179.45 177.18 2hnb h ASN 111 N 0.70 0.97 0.42 4.20 -1.24 -0.64 -0.91 115.58 119.08 2hnb h ASN 111 Ca 0.17 -0.14 0.00 0.00 0.71 0.00 0.00 56.30 57.04 2hnb h ASN 111 Cb 0.22 -0.25 0.00 0.00 0.73 0.00 0.00 38.32 39.01 2hnb h ASN 111 CO -0.01 0.87 0.00 -1.20 -1.29 0.00 0.00 177.43 175.80 2hnb n SER 112 N -4.29 0.09 0.00 1.15 7.64 -0.10 -4.87 113.62 113.23 2hnb n SER 112 Ca 0.06 0.52 0.00 0.00 1.01 0.00 0.00 58.87 60.47 2hnb n SER 112 Cb 0.18 -0.54 0.00 0.00 -1.01 0.00 0.00 64.21 62.84 2hnb n SER 112 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2hnb n GLY 113 N -0.31 1.94 3.42 0.23 0.00 -0.35 -0.67 105.19 109.45 2hnb n GLY 113 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 2hnb n GLY 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hnb s ALA 114 N -1.74 -0.40 0.08 4.61 0.00 -0.39 -4.21 121.76 119.71 2hnb s ALA 114 Ca 0.00 -0.65 -0.08 0.00 0.00 0.00 0.00 51.96 51.23 2hnb s ALA 114 Cb 0.00 -3.02 -0.00 0.00 0.00 0.00 0.00 23.12 20.10 2hnb s ALA 114 CO 0.00 -4.17 0.18 0.15 0.00 0.00 0.00 175.76 171.92 2hnb s LYS 115 N -4.97 0.82 0.90 0.00 1.02 -1.24 -4.17 119.74 112.11 2hnb s LYS 115 Ca 0.69 -0.95 -0.12 0.00 0.02 0.00 0.00 55.97 55.61 2hnb s LYS 115 Cb -0.16 0.33 0.13 0.00 -0.52 0.00 0.00 37.83 37.61 2hnb s LYS 115 CO 0.59 -0.25 1.11 -1.14 -0.92 0.00 0.00 175.35 174.74 2hnb s GLN 116 N -3.78 1.24 0.03 1.68 0.74 -1.26 -1.54 119.66 116.77 2hnb s GLN 116 Ca 0.04 0.47 0.03 0.00 0.05 0.00 0.00 55.36 55.96 2hnb s GLN 116 Cb 0.05 -1.84 -0.02 0.00 1.10 0.00 0.00 33.01 32.30 2hnb s GLN 116 CO -0.11 -2.17 -0.10 0.99 -0.55 0.00 0.00 175.29 173.36 2hnb s THR 117 N -3.15 0.77 0.00 -0.34 2.01 0.72 -4.70 115.64 110.94 2hnb s THR 117 Ca 0.63 -0.81 0.00 0.00 0.31 0.00 0.00 61.69 61.82 2hnb s THR 117 Cb -0.16 -0.72 0.00 0.00 0.01 0.00 0.00 72.50 71.63 2hnb s THR 117 CO 0.55 -0.07 0.00 0.61 -0.69 0.00 0.00 174.62 175.02 2hnb n GLY 118 N 2.07 3.34 3.11 4.40 0.00 -1.26 -4.69 105.19 112.16 2hnb n GLY 118 Ca -0.18 -0.17 -0.07 0.00 0.00 0.00 0.00 46.02 45.59 2hnb n GLY 118 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2hnb s GLU 119 N 0.00 0.65 0.84 1.61 2.12 -1.26 -5.09 118.70 117.57 2hnb s GLU 119 Ca 0.00 -1.19 -0.12 0.00 0.36 0.00 0.00 54.97 54.02 2hnb s GLU 119 Cb 0.00 0.23 0.10 0.00 0.26 0.00 0.00 34.13 34.72 2hnb s GLU 119 CO 0.00 -0.14 1.17 0.99 -0.54 0.00 0.00 175.26 176.74 2hnb s THR 120 N -3.91 2.21 0.09 -1.70 2.01 -1.26 -4.83 115.64 108.24 2hnb s THR 120 Ca 0.07 0.08 0.07 0.00 0.31 0.00 0.00 61.69 62.22 2hnb s THR 120 Cb 0.08 -2.34 -0.03 0.00 0.01 0.00 0.00 72.50 70.21 2hnb s THR 120 CO -0.10 -0.08 -0.19 -0.22 -0.69 0.00 0.00 174.62 173.35 2hnb s LEU 121 N -6.05 2.29 0.08 4.42 2.96 -0.88 -5.05 118.68 116.46 2hnb s LEU 121 Ca 0.69 -0.66 0.08 0.00 -0.22 0.00 0.00 54.13 54.03 2hnb s LEU 121 Cb -0.25 -0.77 -0.04 0.00 0.50 0.00 0.00 46.19 45.63 2hnb s LEU 121 CO 0.53 0.02 -0.18 -0.54 -1.32 0.00 0.00 176.35 174.86 2hnb s LYS 122 N -1.83 1.89 -0.01 1.98 3.01 -1.26 -1.40 119.74 122.12 2hnb s LYS 122 Ca 0.04 -1.10 0.03 0.00 -1.01 0.00 0.00 55.97 53.92 2hnb s LYS 122 Cb -0.10 -2.14 -0.00 0.00 -1.01 0.00 0.00 37.83 34.58 2hnb s LYS 122 CO 0.04 0.50 -0.09 0.42 0.51 0.00 0.00 175.35 176.73 2hnb s ILE 123 N -1.05 0.72 -0.12 2.17 -1.09 0.23 -4.92 121.20 117.14 2hnb s ILE 123 Ca 0.16 -0.37 -0.02 0.00 -2.23 0.00 0.00 60.65 58.19 2hnb s ILE 123 Cb -0.11 -0.62 -0.03 0.00 -1.58 0.00 0.00 42.46 40.13 2hnb s ILE 123 CO 0.08 0.21 -0.04 0.21 -1.23 0.00 0.00 174.94 174.18 2hnb s ASN 124 N -0.09 4.85 0.00 3.58 2.47 -1.26 -2.29 114.94 122.20 2hnb s ASN 124 Ca 0.02 -0.05 0.00 0.00 0.42 0.00 0.00 52.86 53.24 2hnb s ASN 124 Cb -0.05 -1.59 0.00 0.00 -1.45 0.00 0.00 41.25 38.16 2hnb s ASN 124 CO -0.00 0.25 0.57 2.30 -3.72 0.00 0.00 177.10 176.50 2hnb n ILE 125 N 2.99 0.32 -0.11 -5.21 -6.64 -0.01 -4.07 119.36 106.64 2hnb n ILE 125 Ca -0.18 -0.48 -0.05 0.00 -1.77 0.00 0.00 62.75 60.27 2hnb n ILE 125 Cb 0.53 1.02 0.15 0.00 -1.44 0.00 0.00 39.64 39.89 2hnb n ILE 125 CO 0.00 0.00 0.00 0.25 -1.77 0.00 0.00 176.55 175.03 2hnb h LEU 126 N 0.00 0.77 0.00 7.28 5.85 -1.95 -3.44 115.31 123.82 2hnb h LEU 126 Ca 0.00 -0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.52 2hnb h LEU 126 Cb 0.43 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.25 2hnb h LEU 126 CO 0.00 0.85 0.00 -0.67 -0.34 0.00 0.00 178.44 178.28 2hnb n ASP 127 N -4.20 0.00 -3.82 1.25 2.03 -1.26 -5.13 116.55 105.42 2hnb n ASP 127 Ca 0.02 0.00 -0.12 0.00 0.52 0.00 0.00 54.79 55.21 2hnb n ASP 127 Cb 0.32 0.07 -0.12 0.00 -0.72 0.00 0.00 41.12 40.67 2hnb n ASP 127 CO 0.00 0.00 0.00 -1.00 -1.92 0.00 0.00 177.20 174.28 2hnb s HIS 128 N -1.22 -0.16 -1.28 -0.67 3.76 -1.26 -5.07 115.29 109.38 2hnb s HIS 128 Ca 0.00 0.39 -0.07 0.00 -0.15 0.00 0.00 55.06 55.23 2hnb s HIS 128 Cb 0.00 0.05 0.01 0.00 1.11 0.00 0.00 32.58 33.75 2hnb s HIS 128 CO 0.00 -0.10 2.73 -3.47 -0.85 0.00 0.00 174.74 173.05 2hnb n ASP 129 N 2.86 8.02 -3.95 1.40 2.03 -1.26 -4.47 116.55 121.19 2hnb n ASP 129 Ca -0.13 -2.88 -0.28 0.00 0.52 0.00 0.00 54.79 52.02 2hnb n ASP 129 Cb 0.59 -1.43 -0.05 0.00 -0.72 0.00 0.00 41.12 39.50 2hnb n ASP 129 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 2hnb n ILE 130 N 2.43 -1.13 0.29 5.18 -0.00 -1.26 -4.84 119.36 120.02 2hnb n ILE 130 Ca 0.67 -0.41 0.17 0.00 -0.00 0.00 0.00 62.75 63.17 2hnb n ILE 130 Cb 0.31 -1.05 0.87 0.00 -0.00 0.00 0.00 39.64 39.78 2hnb n ILE 130 CO 0.00 0.00 0.00 1.55 -0.00 0.00 0.00 176.55 178.10 2hnb h PRO 131 N -1.25 0.00 0.00 6.28 0.13 -1.99 -0.77 132.00 134.41 2hnb h PRO 131 Ca -0.53 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.60 2hnb h PRO 131 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 2hnb h PRO 131 CO 0.51 0.05 0.00 -0.85 -0.23 0.00 0.00 178.00 177.49 2hnb n GLU 132 N -3.40 0.18 -2.90 0.86 0.28 -1.26 -4.42 120.64 109.98 2hnb n GLU 132 Ca -0.02 0.21 -0.13 0.00 -0.16 0.00 0.00 57.16 57.06 2hnb n GLU 132 Cb 0.19 -1.74 0.02 0.00 1.43 0.00 0.00 31.44 31.35 2hnb n GLU 132 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 2hnb n ASP 133 N -2.07 -1.54 -4.74 -1.84 2.03 -0.31 -5.15 116.55 102.93 2hnb n ASP 133 Ca 0.05 -3.25 -0.34 0.00 0.52 0.00 0.00 54.79 51.77 2hnb n ASP 133 Cb 0.36 0.98 0.07 0.00 -0.72 0.00 0.00 41.12 41.81 2hnb n ASP 133 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2hnb s PRO 134 N -0.30 2.49 0.63 -0.67 0.04 -1.14 -4.89 135.00 131.16 2hnb s PRO 134 Ca 0.31 1.61 0.39 0.00 0.04 0.00 0.00 61.00 63.35 2hnb s PRO 134 Cb 0.25 -1.89 2.16 0.00 0.04 0.00 0.00 34.50 35.06 2hnb s PRO 134 CO -0.14 -1.53 2.31 0.00 0.04 0.00 0.00 177.00 177.68 2hnb h ALA 135 N -0.05 1.16 -0.84 8.56 0.00 -1.94 -2.64 119.26 123.51 2hnb h ALA 135 Ca -0.47 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 54.49 2hnb h ALA 135 Cb 1.27 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 19.01 2hnb h ALA 135 CO 0.52 0.01 0.55 1.49 0.00 0.00 0.00 179.25 181.82 2hnb h GLU 136 N 0.00 0.92 -0.34 0.00 4.81 -1.98 0.46 114.58 118.45 2hnb h GLU 136 Ca -0.00 -0.06 -0.15 0.00 -0.13 0.00 0.00 59.36 59.02 2hnb h GLU 136 Cb 0.05 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.22 2hnb h GLU 136 CO 0.00 0.61 -0.40 0.93 -0.73 0.00 0.00 179.01 179.42 2hnb h GLU 137 N 0.95 0.81 -0.46 1.92 5.08 -1.84 -2.01 114.58 119.03 2hnb h GLU 137 Ca 0.36 -0.43 -0.06 0.00 -1.00 0.00 0.00 59.36 58.23 2hnb h GLU 137 Cb 0.20 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 2hnb h GLU 137 CO -0.13 1.06 0.05 2.35 -1.00 0.00 0.00 179.01 181.35 2hnb h TRP 138 N 0.66 0.83 -0.92 4.33 7.01 -1.60 -3.24 115.95 123.02 2hnb h TRP 138 Ca 0.05 -0.13 -0.00 0.00 2.11 0.00 0.00 58.89 60.93 2hnb h TRP 138 Cb 0.96 -0.22 -0.04 0.00 -2.10 0.00 0.00 29.16 27.75 2hnb h TRP 138 CO 0.05 0.79 0.57 1.25 -2.79 0.00 0.00 178.44 178.31 2hnb h LEU 139 N 0.64 1.09 -0.33 0.65 5.85 -0.53 -0.61 115.31 122.06 2hnb h LEU 139 Ca 0.14 -0.05 0.06 0.00 0.84 0.00 0.00 57.88 58.86 2hnb h LEU 139 Cb 0.42 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 41.13 2hnb h LEU 139 CO 0.01 0.82 0.02 1.23 -0.34 0.00 0.00 178.44 180.18 2hnb h GLY 140 N 1.27 0.34 1.45 3.75 0.00 -1.40 -0.07 103.07 108.40 2hnb h GLY 140 Ca 0.33 0.02 -0.07 0.00 0.00 0.00 0.00 47.33 47.61 2hnb h GLY 140 CO -0.07 -0.06 -0.05 1.76 0.00 0.00 0.00 176.54 178.13 2hnb h SER 141 N 0.12 0.65 0.08 0.19 0.02 -1.36 -1.98 113.55 111.26 2hnb h SER 141 Ca 0.16 -0.16 -0.00 0.00 -0.84 0.00 0.00 61.79 60.94 2hnb h SER 141 Cb 0.20 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.57 2hnb h SER 141 CO -0.25 0.75 -0.04 -0.25 -1.14 0.00 0.00 176.83 175.90 2hnb h TRP 142 N 0.63 -0.10 0.00 3.45 7.01 -0.49 -3.09 115.95 123.36 2hnb h TRP 142 Ca 0.12 -0.00 -0.05 0.00 2.11 0.00 0.00 58.89 61.06 2hnb h TRP 142 Cb 0.46 0.03 -0.01 0.00 -2.10 0.00 0.00 29.16 27.55 2hnb h TRP 142 CO 0.02 0.21 -0.26 -0.39 -2.79 0.00 0.00 178.44 175.23 2hnb h VAL 143 N -0.42 1.08 -0.10 2.65 -1.51 -0.97 -2.28 116.25 114.71 2hnb h VAL 143 Ca -0.01 -0.92 0.03 0.00 -1.23 0.00 0.00 66.70 64.57 2hnb h VAL 143 Cb 0.36 1.51 -0.00 0.00 -2.13 0.00 0.00 31.29 31.02 2hnb h VAL 143 CO 0.02 0.25 0.14 -1.13 -1.23 0.00 0.00 177.57 175.62 2hnb h ASN 144 N 0.00 0.00 -0.23 4.19 -0.73 -1.27 0.13 115.58 117.68 2hnb h ASN 144 Ca -0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 2hnb h ASN 144 Cb 0.49 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.08 2hnb h ASN 144 CO 0.03 0.00 0.00 0.18 -0.37 0.00 0.00 177.43 177.27 2hnb n LEU 145 N -3.63 3.10 0.00 0.34 4.77 -0.86 -4.37 117.00 116.36 2hnb n LEU 145 Ca -0.00 -1.31 0.00 0.00 -0.03 0.00 0.00 56.01 54.67 2hnb n LEU 145 Cb 0.24 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 2hnb n LEU 145 CO 0.25 0.62 -0.01 0.00 -1.33 0.00 0.00 177.39 176.92 2hnb n LEU 146 N 1.29 0.00 0.00 2.23 -0.00 -0.47 -4.91 117.00 115.14 2hnb n LEU 146 Ca 0.16 -0.38 0.00 0.00 -0.00 0.00 0.00 56.01 55.79 2hnb n LEU 146 Cb 0.55 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.97 2hnb n LEU 146 CO 0.14 0.00 0.06 2.29 -0.00 0.00 0.00 177.39 179.88