#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 -0.35 0.12 -5.12 0.00 -1.26 -4.95 121.76 110.20 2hnb s ALA 2 Ca 0.00 -0.50 0.05 0.00 0.00 0.00 0.00 51.96 51.51 2hnb s ALA 2 Cb 0.00 0.50 -0.18 0.00 0.00 0.00 0.00 23.12 23.43 2hnb s ALA 2 CO 0.00 -0.52 1.27 0.22 0.00 0.00 0.00 175.76 176.74 2hnb h ASP 3 N 2.75 0.10 -2.17 0.00 3.58 -1.91 -3.24 116.42 115.53 2hnb h ASP 3 Ca -0.34 -0.11 -0.60 0.00 0.42 0.00 0.00 57.03 56.41 2hnb h ASP 3 Cb 1.21 -0.03 -0.42 0.00 1.72 0.00 0.00 39.33 41.81 2hnb h ASP 3 CO 0.54 1.05 -0.65 -0.38 -2.88 0.00 0.00 179.24 176.92 2hnb n ILE 4 N -3.43 2.02 -2.06 2.25 5.41 -0.61 -3.67 119.36 119.27 2hnb n ILE 4 Ca -0.02 -5.09 -0.43 0.00 1.00 0.00 0.00 62.75 58.22 2hnb n ILE 4 Cb 0.93 -2.08 -0.03 0.00 -0.71 0.00 0.00 39.64 37.75 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 -2.34 3.63 0.41 1.39 2.01 -1.22 -3.59 115.64 115.94 2hnb s THR 5 Ca 0.39 0.73 -0.10 0.00 0.31 0.00 0.00 61.69 63.02 2hnb s THR 5 Cb 0.15 -3.60 -0.06 0.00 0.01 0.00 0.00 72.50 69.00 2hnb s THR 5 CO -0.02 -0.20 0.78 -0.76 -0.69 0.00 0.00 174.62 173.72 2hnb s LEU 6 N 4.93 3.81 -0.48 4.42 1.43 0.45 -3.45 118.68 129.79 2hnb s LEU 6 Ca 0.73 1.13 0.03 0.00 -1.03 0.00 0.00 54.13 55.00 2hnb s LEU 6 Cb -0.28 -4.02 0.13 0.00 0.03 0.00 0.00 46.19 42.05 2hnb s LEU 6 CO 0.29 -0.42 0.24 -0.63 0.23 0.00 0.00 176.35 176.07 2hnb s ILE 7 N -2.40 2.19 0.00 -0.59 1.01 0.74 -1.14 121.20 121.00 2hnb s ILE 7 Ca 0.51 -3.01 -0.30 0.00 0.00 0.00 0.00 60.65 57.85 2hnb s ILE 7 Cb -0.10 -2.53 -0.04 0.00 0.01 0.00 0.00 42.46 39.80 2hnb s ILE 7 CO 0.32 -0.82 1.08 -0.44 0.00 0.00 0.00 174.94 175.08 2hnb s SER 8 N -0.01 7.23 -0.45 3.58 0.01 -0.25 -2.11 113.70 121.70 2hnb s SER 8 Ca 0.17 1.78 0.09 0.00 1.31 0.00 0.00 55.95 59.30 2hnb s SER 8 Cb -0.25 -2.57 0.34 0.00 0.21 0.00 0.00 66.02 63.75 2hnb s SER 8 CO -0.01 -0.38 0.79 0.61 0.41 0.00 0.00 173.24 174.66 2hnb n GLY 9 N 3.07 4.24 3.08 3.44 0.00 -0.08 -1.63 105.19 117.31 2hnb n GLY 9 Ca 0.08 -2.07 -0.12 0.00 0.00 0.00 0.00 46.02 43.91 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 -2.68 -0.10 -0.03 1.61 1.04 -1.26 -2.34 113.70 109.93 2hnb s SER 10 Ca 0.43 0.14 -0.21 0.00 0.48 0.00 0.00 55.95 56.78 2hnb s SER 10 Cb 0.31 0.30 -0.32 0.00 0.10 0.00 0.00 66.02 66.41 2hnb s SER 10 CO -0.10 -0.19 0.92 0.71 0.98 0.00 0.00 173.24 175.56 2hnb h THR 11 N 4.62 1.47 0.00 2.02 1.35 -1.97 -3.34 112.91 117.06 2hnb h THR 11 Ca -0.27 -2.57 -0.03 0.00 -0.55 0.00 0.00 66.41 62.99 2hnb h THR 11 Cb 1.20 3.17 -0.00 0.00 -1.73 0.00 0.00 68.15 70.78 2hnb h THR 11 CO 0.40 0.74 -0.14 0.17 -0.25 0.00 0.00 175.52 176.44 2hnb h LEU 12 N -0.26 0.00 0.00 3.87 -0.00 -2.02 -3.47 115.31 113.42 2hnb h LEU 12 Ca -0.17 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.71 2hnb h LEU 12 Cb 1.75 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.41 2hnb h LEU 12 CO 0.18 0.14 0.00 0.61 -0.00 0.00 0.00 178.44 179.37 2hnb n GLY 13 N -0.89 0.83 0.20 0.17 0.00 -1.26 -4.99 105.19 99.27 2hnb n GLY 13 Ca -0.02 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.91 2hnb n GLY 13 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2hnb h GLY 14 N 0.00 0.69 1.64 -0.02 0.00 -1.91 0.01 103.07 103.48 2hnb h GLY 14 Ca 0.00 -0.40 -0.09 0.00 0.00 0.00 0.00 47.33 46.84 2hnb h GLY 14 CO 0.00 0.37 -0.27 0.00 0.00 0.00 0.00 176.54 176.65 2hnb h ALA 15 N 0.99 1.14 -0.55 3.60 0.00 -1.90 -1.56 119.26 120.97 2hnb h ALA 15 Ca 0.14 -0.34 -0.11 0.00 0.00 0.00 0.00 54.91 54.59 2hnb h ALA 15 Cb 0.24 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2hnb h ALA 15 CO -0.01 0.55 -0.10 0.93 0.00 0.00 0.00 179.25 180.62 2hnb h GLU 16 N 0.37 1.04 -0.22 0.00 5.08 -1.79 0.51 114.58 119.56 2hnb h GLU 16 Ca 0.05 -0.38 -0.04 0.00 -1.00 0.00 0.00 59.36 57.99 2hnb h GLU 16 Cb 0.67 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.84 2hnb h GLU 16 CO 0.05 1.07 -0.01 -0.92 -1.00 0.00 0.00 179.01 178.20 2hnb h TYR 17 N 0.92 0.44 -0.08 4.33 5.03 -0.75 -0.45 116.97 126.42 2hnb h TYR 17 Ca 0.14 -0.08 -0.00 0.00 2.58 0.00 0.00 58.73 61.37 2hnb h TYR 17 Cb 0.67 -0.11 -0.00 0.00 1.55 0.00 0.00 36.73 38.84 2hnb h TYR 17 CO 0.05 0.59 0.05 0.28 -1.32 0.00 0.00 178.16 177.80 2hnb h VAL 18 N 0.16 1.06 -0.99 1.81 2.07 -1.24 -2.49 116.25 116.63 2hnb h VAL 18 Ca 0.06 -0.15 0.01 0.00 0.82 0.00 0.00 66.70 67.44 2hnb h VAL 18 Cb 0.42 1.02 -0.05 0.00 -1.52 0.00 0.00 31.29 31.17 2hnb h VAL 18 CO 0.01 0.05 0.65 0.00 0.02 0.00 0.00 177.57 178.31 2hnb h ALA 19 N 0.98 1.28 -0.45 1.67 0.00 -0.72 -0.57 119.26 121.45 2hnb h ALA 19 Ca 0.03 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 2hnb h ALA 19 Cb 0.04 -0.40 -0.02 0.00 0.00 0.00 0.00 17.79 17.41 2hnb h ALA 19 CO -0.01 0.66 0.16 1.49 0.00 0.00 0.00 179.25 181.56 2hnb h GLU 20 N 1.35 0.68 -0.36 0.00 4.81 -0.92 0.12 114.58 120.25 2hnb h GLU 20 Ca 0.36 -0.13 -0.12 0.00 -0.13 0.00 0.00 59.36 59.34 2hnb h GLU 20 Cb -0.15 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.12 2hnb h GLU 20 CO -0.08 0.64 -0.24 0.45 -0.73 0.00 0.00 179.01 179.05 2hnb h HIS 21 N 0.59 0.94 -0.63 0.92 3.86 -0.98 -1.17 115.15 118.67 2hnb h HIS 21 Ca 0.15 -0.25 -0.04 0.00 -1.16 0.00 0.00 60.37 59.07 2hnb h HIS 21 Cb 0.22 -0.21 -0.03 0.00 1.06 0.00 0.00 27.41 28.46 2hnb h HIS 21 CO 0.01 1.02 0.24 -0.07 0.86 0.00 0.00 177.93 179.98 2hnb h LEU 22 N 0.59 0.88 -0.51 2.43 3.38 -1.02 -2.66 115.31 118.40 2hnb h LEU 22 Ca 0.07 -0.18 -0.00 0.00 0.09 0.00 0.00 57.88 57.86 2hnb h LEU 22 Cb 0.80 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 2hnb h LEU 22 CO 0.07 0.82 0.32 0.00 0.09 0.00 0.00 178.44 179.73 2hnb h ALA 23 N 1.09 0.66 -0.74 1.53 0.00 -0.58 -0.57 119.26 120.64 2hnb h ALA 23 Ca 0.21 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.09 2hnb h ALA 23 Cb 0.23 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 2hnb h ALA 23 CO -0.01 0.13 0.46 1.49 0.00 0.00 0.00 179.25 181.32 2hnb h GLU 24 N 0.69 0.87 -0.53 0.00 4.81 -1.03 0.41 114.58 119.81 2hnb h GLU 24 Ca 0.19 -0.05 -0.11 0.00 -0.13 0.00 0.00 59.36 59.25 2hnb h GLU 24 Cb -0.02 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.14 2hnb h GLU 24 CO -0.04 0.58 -0.12 0.87 -0.73 0.00 0.00 179.01 179.57 2hnb h LYS 25 N 0.90 1.01 -0.66 1.92 1.57 -1.12 -1.90 116.57 118.29 2hnb h LYS 25 Ca 0.30 -0.37 -0.03 0.00 -1.87 0.00 0.00 60.65 58.68 2hnb h LYS 25 Cb 0.04 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.26 2hnb h LYS 25 CO -0.12 1.06 0.30 -0.07 -0.57 0.00 0.00 179.45 180.05 2hnb h LEU 26 N 0.89 0.86 -0.72 2.94 3.38 -0.43 -0.61 115.31 121.62 2hnb h LEU 26 Ca 0.14 -0.10 -0.10 0.00 0.09 0.00 0.00 57.88 57.91 2hnb h LEU 26 Cb 0.68 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 2hnb h LEU 26 CO 0.05 0.74 -0.07 -0.33 0.09 0.00 0.00 178.44 178.92 2hnb h GLU 27 N 0.94 0.91 -0.35 1.13 5.08 -0.61 0.11 114.58 121.79 2hnb h GLU 27 Ca 0.23 -0.30 -0.08 0.00 -1.00 0.00 0.00 59.36 58.20 2hnb h GLU 27 Cb 0.13 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.28 2hnb h GLU 27 CO -0.03 0.95 -0.13 0.93 -1.00 0.00 0.00 179.01 179.73 2hnb h GLU 28 N 0.83 0.63 0.00 2.33 5.08 -0.94 -2.07 114.58 120.43 2hnb h GLU 28 Ca 0.14 -0.20 -0.05 0.00 -1.00 0.00 0.00 59.36 58.25 2hnb h GLU 28 Cb 0.59 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 2hnb h GLU 28 CO 0.04 0.74 -0.26 0.00 -1.00 0.00 0.00 179.01 178.53 2hnb h ALA 29 N 1.28 1.25 0.00 3.43 0.00 -0.69 -3.47 119.26 121.07 2hnb h ALA 29 Ca 0.10 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2hnb h ALA 29 Cb 0.56 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.31 2hnb h ALA 29 CO 0.04 0.32 0.00 0.41 0.00 0.00 0.00 179.25 180.02 2hnb n GLY 30 N -0.38 0.96 3.81 0.00 0.00 -0.12 -5.08 105.19 104.39 2hnb n GLY 30 Ca -0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 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 -1.76 3.43 0.33 1.61 0.08 -0.38 -4.94 117.98 116.36 2hnb s PHE 31 Ca 0.00 1.59 -0.26 0.00 0.12 0.00 0.00 56.93 58.38 2hnb s PHE 31 Cb 0.00 -2.81 -0.10 0.00 -0.57 0.00 0.00 43.02 39.54 2hnb s PHE 31 CO 0.00 0.02 0.97 0.95 -0.10 0.00 0.00 175.22 177.06 2hnb s THR 32 N -1.98 4.11 0.11 0.64 -4.23 -1.26 -3.77 115.64 109.26 2hnb s THR 32 Ca 0.57 1.74 -0.02 0.00 -1.18 0.00 0.00 61.69 62.80 2hnb s THR 32 Cb -0.12 -3.96 -0.04 0.00 1.34 0.00 0.00 72.50 69.72 2hnb s THR 32 CO 0.17 0.13 0.05 0.42 -0.54 0.00 0.00 174.62 174.85 2hnb s THR 33 N -1.60 0.13 0.00 3.99 -4.23 -1.26 -1.58 115.64 111.09 2hnb s THR 33 Ca 0.51 -1.84 -0.16 0.00 -1.18 0.00 0.00 61.69 59.03 2hnb s THR 33 Cb -0.20 -1.89 0.03 0.00 1.34 0.00 0.00 72.50 71.78 2hnb s THR 33 CO 0.25 -0.59 0.33 -0.70 -0.54 0.00 0.00 174.62 173.38 2hnb s GLU 34 N -4.01 0.74 -0.90 3.99 2.56 -1.24 -4.82 118.70 115.03 2hnb s GLU 34 Ca 0.19 -0.26 -0.01 0.00 0.00 0.00 0.00 54.97 54.89 2hnb s GLU 34 Cb 0.07 0.33 0.27 0.00 2.00 0.00 0.00 34.13 36.80 2hnb s GLU 34 CO -0.01 -0.22 1.06 0.25 -0.56 0.00 0.00 175.26 175.78 2hnb n THR 35 N 1.01 3.81 -2.39 -1.70 -2.24 -1.26 -0.41 114.28 111.11 2hnb n THR 35 Ca -0.20 -5.49 -0.41 0.00 -2.27 0.00 0.00 64.05 55.68 2hnb n THR 35 Cb 0.57 -2.19 -0.03 0.00 -2.10 0.00 0.00 70.33 66.59 2hnb n THR 35 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2hnb s LEU 36 N -2.27 3.36 -0.11 3.22 0.20 -0.29 -4.78 118.68 118.02 2hnb s LEU 36 Ca 0.33 0.19 -0.30 0.00 0.69 0.00 0.00 54.13 55.04 2hnb s LEU 36 Cb 0.04 -2.95 -0.03 0.00 -0.43 0.00 0.00 46.19 42.82 2hnb s LEU 36 CO 0.00 -1.78 1.34 -1.38 -0.29 0.00 0.00 176.35 174.24 2hnb s HIS 37 N 6.24 2.75 -1.33 5.38 -3.43 -1.26 -1.09 115.29 122.56 2hnb s HIS 37 Ca 0.51 0.87 -0.04 0.00 -0.80 0.00 0.00 55.06 55.61 2hnb s HIS 37 Cb -0.11 -3.58 -0.00 0.00 -1.43 0.00 0.00 32.58 27.46 2hnb s HIS 37 CO 0.23 -2.11 0.56 0.41 -2.00 0.00 0.00 174.74 171.83 2hnb n GLY 38 N 3.67 -0.38 3.54 -1.38 0.00 -0.65 -4.94 105.19 105.04 2hnb n GLY 38 Ca 0.14 0.20 -0.30 0.00 0.00 0.00 0.00 46.02 46.06 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 -6.28 -1.30 0.30 1.61 0.04 -1.26 -4.81 135.00 123.30 2hnb s PRO 39 Ca 0.09 0.15 0.04 0.00 0.04 0.00 0.00 61.00 61.32 2hnb s PRO 39 Cb -0.03 -1.57 -0.06 0.00 0.04 0.00 0.00 34.50 32.88 2hnb s PRO 39 CO 0.86 -3.81 0.04 -0.51 0.04 0.00 0.00 177.00 173.62 2hnb s LEU 40 N -7.08 2.18 0.33 -3.56 1.43 -1.26 -4.64 118.68 106.08 2hnb s LEU 40 Ca 0.69 -1.34 0.06 0.00 -1.03 0.00 0.00 54.13 52.51 2hnb s LEU 40 Cb -0.13 -0.37 0.71 0.00 0.03 0.00 0.00 46.19 46.42 2hnb s LEU 40 CO 0.58 -0.58 1.89 0.25 0.23 0.00 0.00 176.35 178.71 2hnb h LEU 41 N 2.19 0.75 0.00 1.79 6.46 -1.91 -0.42 115.31 124.17 2hnb h LEU 41 Ca -0.40 0.03 0.00 0.00 -0.12 0.00 0.00 57.88 57.39 2hnb h LEU 41 Cb 1.24 -0.12 0.00 0.00 -0.73 0.00 0.00 40.66 41.05 2hnb h LEU 41 CO 0.68 0.42 0.00 -1.84 -0.62 0.00 0.00 178.44 177.08 2hnb n GLU 42 N -4.54 0.31 0.00 1.25 0.28 -1.26 -3.20 120.64 113.47 2hnb n GLU 42 Ca 0.16 0.09 0.00 0.00 -0.16 0.00 0.00 57.16 57.25 2hnb n GLU 42 Cb 0.36 -1.50 0.00 0.00 1.43 0.00 0.00 31.44 31.73 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 -1.17 1.43 -3.92 -1.84 2.03 -0.17 -5.02 116.55 107.89 2hnb n ASP 43 Ca 0.08 -1.69 -0.10 0.00 0.52 0.00 0.00 54.79 53.60 2hnb n ASP 43 Cb 0.09 0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 40.38 2hnb n ASP 43 CO 0.00 0.00 0.00 -1.48 -1.92 0.00 0.00 177.20 173.80 2hnb s LEU 44 N -0.69 1.88 0.75 -2.67 0.05 -1.19 -4.86 118.68 111.94 2hnb s LEU 44 Ca 0.00 -0.34 -0.11 0.00 0.05 0.00 0.00 54.13 53.73 2hnb s LEU 44 Cb 0.00 0.40 0.04 0.00 -2.05 0.00 0.00 46.19 44.58 2hnb s LEU 44 CO 0.00 -0.33 1.09 -2.16 -0.55 0.00 0.00 176.35 174.40 2hnb s PRO 45 N -1.39 2.51 -0.02 1.48 0.04 -1.26 -4.91 135.00 131.44 2hnb s PRO 45 Ca -0.15 0.58 0.01 0.00 0.04 0.00 0.00 61.00 61.48 2hnb s PRO 45 Cb -0.09 -1.97 0.07 0.00 0.04 0.00 0.00 34.50 32.55 2hnb s PRO 45 CO 0.00 -1.31 0.66 0.00 0.04 0.00 0.00 177.00 176.40 2hnb n ALA 46 N -3.21 2.63 -3.36 8.56 0.00 -1.26 -4.75 120.51 119.12 2hnb n ALA 46 Ca 0.07 -0.17 -0.14 0.00 0.00 0.00 0.00 53.44 53.20 2hnb n ALA 46 Cb 0.56 -1.01 -0.09 0.00 0.00 0.00 0.00 19.45 18.91 2hnb n ALA 46 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2hnb s SER 47 N 0.04 -0.44 0.00 0.00 1.04 -1.26 -3.28 113.70 109.79 2hnb s SER 47 Ca 0.05 0.71 0.00 0.00 0.48 0.00 0.00 55.95 57.19 2hnb s SER 47 Cb 0.04 0.75 0.00 0.00 0.10 0.00 0.00 66.02 66.91 2hnb s SER 47 CO 0.01 -0.29 0.00 0.61 0.98 0.00 0.00 173.24 174.55 2hnb n GLY 48 N 2.21 -0.57 2.80 7.32 0.00 -1.17 -4.87 105.19 110.90 2hnb n GLY 48 Ca -0.16 -1.64 -0.30 0.00 0.00 0.00 0.00 46.02 43.92 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 -1.79 1.61 0.47 -0.61 1.09 -1.24 -0.82 121.20 119.91 2hnb s ILE 49 Ca 0.00 -2.43 0.04 0.00 -1.10 0.00 0.00 60.65 57.17 2hnb s ILE 49 Cb 0.00 -2.15 0.02 0.00 -1.06 0.00 0.00 42.46 39.27 2hnb s ILE 49 CO 0.00 -0.80 0.66 0.26 -0.10 0.00 0.00 174.94 174.96 2hnb s TRP 50 N 0.57 2.89 -0.06 3.97 0.23 0.08 -4.10 118.94 122.51 2hnb s TRP 50 Ca 0.15 -0.17 -0.00 0.00 -2.03 0.00 0.00 56.10 54.05 2hnb s TRP 50 Cb -0.23 -2.51 0.03 0.00 0.03 0.00 0.00 33.47 30.79 2hnb s TRP 50 CO -0.06 -0.58 -0.01 -1.17 0.96 0.00 0.00 176.95 176.09 2hnb s LEU 51 N -4.53 0.89 -0.18 2.99 2.96 -1.22 -2.01 118.68 117.58 2hnb s LEU 51 Ca 0.55 -0.09 -0.07 0.00 -0.22 0.00 0.00 54.13 54.29 2hnb s LEU 51 Cb -0.10 -0.42 -0.04 0.00 0.50 0.00 0.00 46.19 46.13 2hnb s LEU 51 CO 0.36 -0.14 0.06 -0.69 -1.32 0.00 0.00 176.35 174.62 2hnb s VAL 52 N 1.53 4.79 -0.10 1.68 1.01 -0.05 -0.19 120.40 129.07 2hnb s VAL 52 Ca -0.02 -0.04 -0.00 0.00 0.00 0.00 0.00 61.98 61.92 2hnb s VAL 52 Cb -0.13 -3.15 0.02 0.00 0.00 0.00 0.00 36.38 33.12 2hnb s VAL 52 CO -0.03 0.47 -0.07 -0.63 0.00 0.00 0.00 175.10 174.84 2hnb s ILE 53 N 0.29 0.92 -0.02 2.22 1.09 -0.90 -1.36 121.20 123.45 2hnb s ILE 53 Ca 0.03 -0.23 0.00 0.00 -1.10 0.00 0.00 60.65 59.35 2hnb s ILE 53 Cb -0.12 -0.95 0.02 0.00 -1.06 0.00 0.00 42.46 40.34 2hnb s ILE 53 CO 0.00 0.35 -0.00 -0.44 -0.10 0.00 0.00 174.94 174.75 2hnb s SER 54 N 1.65 0.29 0.74 3.58 0.01 -0.67 -0.90 113.70 118.40 2hnb s SER 54 Ca 0.03 -0.02 -0.11 0.00 1.31 0.00 0.00 55.95 57.16 2hnb s SER 54 Cb -0.13 -0.13 0.04 0.00 0.21 0.00 0.00 66.02 66.01 2hnb s SER 54 CO -0.07 -0.07 1.09 -0.44 0.41 0.00 0.00 173.24 174.17 2hnb s SER 55 N 0.69 5.05 -0.22 2.44 0.01 -0.99 -1.77 113.70 118.91 2hnb s SER 55 Ca -0.07 1.28 -0.02 0.00 1.31 0.00 0.00 55.95 58.45 2hnb s SER 55 Cb -0.10 -2.08 0.00 0.00 0.21 0.00 0.00 66.02 64.06 2hnb s SER 55 CO -0.01 -1.61 -0.08 -0.89 0.41 0.00 0.00 173.24 171.05 2hnb s THR 56 N -3.22 2.98 0.39 1.44 2.01 0.52 -4.26 115.64 115.50 2hnb s THR 56 Ca 0.59 -0.70 0.13 0.00 0.31 0.00 0.00 61.69 62.02 2hnb s THR 56 Cb -0.13 -2.37 0.11 0.00 0.01 0.00 0.00 72.50 70.12 2hnb s THR 56 CO 0.53 0.40 1.86 -0.74 -0.69 0.00 0.00 174.62 175.98 2hnb h HIS 57 N 8.06 0.01 0.00 4.92 2.76 -1.51 -3.44 115.15 125.94 2hnb h HIS 57 Ca -0.41 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.76 2hnb h HIS 57 Cb 1.15 -0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.10 2hnb h HIS 57 CO 0.56 0.34 0.00 0.41 -1.30 0.00 0.00 177.93 177.94 2hnb n GLY 58 N -0.57 1.15 0.46 5.26 0.00 -1.26 -5.00 105.19 105.23 2hnb n GLY 58 Ca -0.02 -0.08 0.06 0.00 0.00 0.00 0.00 46.02 45.99 2hnb n GLY 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hnb n ALA 59 N 0.00 2.60 -0.06 4.61 0.00 -1.26 -1.69 120.51 124.70 2hnb n ALA 59 Ca 0.00 -2.47 0.00 0.00 0.00 0.00 0.00 53.44 50.97 2hnb n ALA 59 Cb 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 19.45 19.01 2hnb n ALA 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2hnb n GLY 60 N -0.86 0.46 3.78 0.00 0.00 -1.26 -4.90 105.19 102.40 2hnb n GLY 60 Ca 0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.71 5.89 0.02 1.61 2.15 -1.26 -4.44 116.67 117.93 2hnb s ASP 61 Ca 0.00 2.18 0.05 0.00 0.43 0.00 0.00 52.55 55.21 2hnb s ASP 61 Cb 0.00 -2.58 -0.03 0.00 -0.30 0.00 0.00 42.92 40.00 2hnb s ASP 61 CO 0.00 -1.10 -0.13 -0.63 -0.17 0.00 0.00 175.17 173.14 2hnb s ILE 62 N -1.74 3.18 0.28 4.11 1.01 -1.26 -1.27 121.20 125.51 2hnb s ILE 62 Ca 0.70 -0.97 -0.28 0.00 0.00 0.00 0.00 60.65 60.10 2hnb s ILE 62 Cb -0.24 -2.35 -0.14 0.00 0.01 0.00 0.00 42.46 39.73 2hnb s ILE 62 CO 0.28 0.38 0.95 -2.65 0.00 0.00 0.00 174.94 173.90 2hnb n PRO 63 N 1.62 1.18 0.32 2.79 -0.02 -1.26 -4.58 135.00 135.05 2hnb n PRO 63 Ca -0.16 0.41 0.20 0.00 -2.02 0.00 0.00 63.50 61.94 2hnb n PRO 63 Cb 0.52 -1.74 1.11 0.00 -0.02 0.00 0.00 33.50 33.37 2hnb n PRO 63 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 2hnb h ASP 64 N 1.88 0.00 0.38 2.55 3.58 -1.96 -0.73 116.42 122.12 2hnb h ASP 64 Ca -0.38 0.00 -0.07 0.00 0.42 0.00 0.00 57.03 56.99 2hnb h ASP 64 Cb 1.35 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.39 2hnb h ASP 64 CO 0.60 0.00 -0.35 -0.55 -2.88 0.00 0.00 179.24 176.06 2hnb h ASN 65 N 0.00 0.00 0.00 2.28 -1.07 -1.89 -3.37 115.58 111.53 2hnb h ASN 65 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.37 2hnb h ASN 65 Cb 0.06 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.31 2hnb h ASN 65 CO -0.00 0.35 -0.62 -0.11 0.07 0.00 0.00 177.43 177.13 2hnb n LEU 66 N -4.06 0.00 -0.12 6.14 7.94 -0.82 -4.21 117.00 121.86 2hnb n LEU 66 Ca -0.02 0.00 0.21 0.00 -1.11 0.00 0.00 56.01 55.09 2hnb n LEU 66 Cb 0.40 0.00 0.63 0.00 0.53 0.00 0.00 43.42 44.98 2hnb n LEU 66 CO 0.38 0.00 1.22 0.77 -1.11 0.00 0.00 177.39 178.65 2hnb h SER 67 N 0.00 0.14 -0.32 1.96 4.64 -1.31 0.13 113.55 118.80 2hnb h SER 67 Ca 0.00 0.01 0.09 0.00 -0.47 0.00 0.00 61.79 61.42 2hnb h SER 67 Cb 0.13 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.19 2hnb h SER 67 CO 0.00 0.07 0.47 -0.65 -0.87 0.00 0.00 176.83 175.84 2hnb h PRO 68 N 0.15 0.00 -0.63 4.77 0.11 -1.86 -1.46 132.00 133.08 2hnb h PRO 68 Ca 0.36 0.00 0.04 0.00 0.11 0.00 0.00 66.00 66.51 2hnb h PRO 68 Cb 1.19 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.27 2hnb h PRO 68 CO -0.05 0.00 0.42 0.35 -0.21 0.00 0.00 178.00 178.50 2hnb h PHE 69 N 0.00 0.69 -0.62 0.65 3.57 -1.22 -0.82 116.94 119.19 2hnb h PHE 69 Ca 0.15 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.65 2hnb h PHE 69 Cb 1.08 -0.23 -0.03 0.00 2.79 0.00 0.00 35.95 39.56 2hnb h PHE 69 CO 0.00 0.39 0.29 -0.92 -2.23 0.00 0.00 178.31 175.85 2hnb h TYR 70 N 0.71 0.90 -0.09 0.41 3.20 -1.45 -0.75 116.97 119.89 2hnb h TYR 70 Ca 0.26 -0.05 -0.03 0.00 3.14 0.00 0.00 58.73 62.05 2hnb h TYR 70 Cb 0.14 -0.28 -0.00 0.00 1.54 0.00 0.00 36.73 38.13 2hnb h TYR 70 CO -0.00 0.68 -0.06 0.93 -1.64 0.00 0.00 178.16 178.07 2hnb h GLU 71 N 0.85 0.19 -0.32 1.82 4.39 -1.46 -1.93 114.58 118.12 2hnb h GLU 71 Ca 0.21 -0.09 -0.08 0.00 0.34 0.00 0.00 59.36 59.74 2hnb h GLU 71 Cb 0.13 -0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.76 2hnb h GLU 71 CO -0.03 0.58 -0.15 0.00 -1.16 0.00 0.00 179.01 178.25 2hnb h ALA 72 N 0.61 1.14 0.22 3.43 0.00 -1.11 -0.32 119.26 123.23 2hnb h ALA 72 Ca 0.02 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 2hnb h ALA 72 Cb 0.53 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2hnb h ALA 72 CO 0.02 0.54 -0.11 -0.07 0.00 0.00 0.00 179.25 179.63 2hnb h LEU 73 N 0.52 -0.25 -1.08 0.00 3.38 -1.13 -3.01 115.31 113.73 2hnb h LEU 73 Ca 0.09 -0.19 -0.09 0.00 0.09 0.00 0.00 57.88 57.78 2hnb h LEU 73 Cb 0.57 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 2hnb h LEU 73 CO 0.04 0.06 -0.42 0.06 0.09 0.00 0.00 178.44 178.27 2hnb h GLN 74 N -0.59 0.00 -0.25 1.13 3.07 -1.14 0.15 115.11 117.48 2hnb h GLN 74 Ca -0.03 0.00 -0.11 0.00 0.09 0.00 0.00 58.65 58.60 2hnb h GLN 74 Cb 0.43 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.98 2hnb h GLN 74 CO 0.05 0.42 -0.30 1.49 0.09 0.00 0.00 178.83 180.58 2hnb h GLU 75 N 0.00 0.51 0.00 0.06 4.81 -1.10 -3.36 114.58 115.50 2hnb h GLU 75 Ca -0.00 -0.21 -0.20 0.00 -0.13 0.00 0.00 59.36 58.81 2hnb h GLU 75 Cb 0.82 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 30.15 2hnb h GLU 75 CO 0.05 0.76 -1.76 1.04 -0.73 0.00 0.00 179.01 178.37 2hnb n GLN 76 N -4.09 1.54 -3.80 1.92 6.02 -1.08 -5.04 117.38 112.86 2hnb n GLN 76 Ca -0.01 0.03 -0.23 0.00 -0.01 0.00 0.00 57.00 56.78 2hnb n GLN 76 Cb 0.44 -1.28 -0.01 0.00 1.02 0.00 0.00 30.24 30.41 2hnb n GLN 76 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 2hnb n LYS 77 N -2.59 -0.70 -1.10 -1.09 4.81 0.52 -4.94 118.16 113.07 2hnb n LYS 77 Ca -0.20 -0.15 -0.29 0.00 -0.87 0.00 0.00 58.31 56.80 2hnb n LYS 77 Cb 0.82 -1.12 0.20 0.00 0.02 0.00 0.00 35.03 34.95 2hnb n LYS 77 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 2hnb s PRO 78 N -6.05 -0.17 -0.46 1.64 0.04 -1.26 -4.91 135.00 123.82 2hnb s PRO 78 Ca 0.19 0.35 -0.28 0.00 0.04 0.00 0.00 61.00 61.31 2hnb s PRO 78 Cb -0.11 -1.68 -0.01 0.00 0.04 0.00 0.00 34.50 32.75 2hnb s PRO 78 CO 0.52 -3.10 1.64 0.34 0.04 0.00 0.00 177.00 176.44 2hnb s ASP 79 N -3.52 5.90 -0.17 6.66 2.15 -1.26 -4.69 116.67 121.74 2hnb s ASP 79 Ca 0.67 0.76 0.17 0.00 0.43 0.00 0.00 52.55 54.58 2hnb s ASP 79 Cb -0.17 -2.53 0.48 0.00 -0.30 0.00 0.00 42.92 40.40 2hnb s ASP 79 CO 0.58 -1.80 1.37 0.18 -0.17 0.00 0.00 175.17 175.33 2hnb n LEU 80 N 10.36 3.58 -0.50 -1.34 4.77 -0.20 -4.84 117.00 128.84 2hnb n LEU 80 Ca 0.19 -3.07 0.00 0.00 -0.03 0.00 0.00 56.01 53.10 2hnb n LEU 80 Cb 0.49 -0.53 0.00 0.00 -2.33 0.00 0.00 43.42 41.05 2hnb n LEU 80 CO 0.70 0.71 0.04 -1.20 -1.33 0.00 0.00 177.39 176.31 2hnb n SER 81 N -0.73 0.16 0.00 -1.43 7.64 -1.25 -1.22 113.62 116.79 2hnb n SER 81 Ca 0.21 -0.33 0.00 0.00 1.01 0.00 0.00 58.87 59.76 2hnb n SER 81 Cb 0.85 -0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.97 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 0.41 0.60 -2.39 -0.43 0.00 -1.25 -4.84 120.51 112.60 2hnb n ALA 82 Ca 0.00 -0.12 -0.41 0.00 0.00 0.00 0.00 53.44 52.91 2hnb n ALA 82 Cb 0.04 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.45 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 -0.00 4.66 -0.03 0.00 1.01 -0.35 -3.04 120.40 122.65 2hnb s VAL 83 Ca 0.00 1.87 0.01 0.00 0.00 0.00 0.00 61.98 63.86 2hnb s VAL 83 Cb 0.00 -4.23 -0.03 0.00 0.00 0.00 0.00 36.38 32.12 2hnb s VAL 83 CO 0.00 0.31 -0.03 -0.13 0.00 0.00 0.00 175.10 175.25 2hnb s ARG 84 N 0.15 2.75 0.21 2.72 0.52 -0.00 -2.77 118.95 122.53 2hnb s ARG 84 Ca 0.44 -0.59 0.01 0.00 -0.52 0.00 0.00 55.73 55.07 2hnb s ARG 84 Cb -0.22 -2.63 -0.05 0.00 0.52 0.00 0.00 34.95 32.57 2hnb s ARG 84 CO 0.26 0.64 0.08 -0.59 0.02 0.00 0.00 175.30 175.72 2hnb s PHE 85 N -0.97 1.31 0.20 -0.53 -0.12 -0.47 -0.74 117.98 116.67 2hnb s PHE 85 Ca 0.16 -1.20 0.04 0.00 -0.05 0.00 0.00 56.93 55.88 2hnb s PHE 85 Cb -0.11 -0.73 -0.05 0.00 -0.63 0.00 0.00 43.02 41.50 2hnb s PHE 85 CO 0.06 -0.40 -0.04 0.20 -0.05 0.00 0.00 175.22 174.99 2hnb s GLY 86 N -3.22 1.38 -0.10 1.99 0.00 -0.85 -0.51 107.32 106.02 2hnb s GLY 86 Ca 0.34 -1.67 -0.04 0.00 0.00 0.00 0.00 44.72 43.35 2hnb s GLY 86 CO 0.10 -1.64 0.20 0.00 0.00 0.00 0.00 173.10 171.76 2hnb s ALA 87 N -3.37 -0.38 -0.03 3.20 0.00 -1.25 -0.87 121.76 119.05 2hnb s ALA 87 Ca 0.24 0.78 0.02 0.00 0.00 0.00 0.00 51.96 53.00 2hnb s ALA 87 Cb 0.04 -0.75 0.01 0.00 0.00 0.00 0.00 23.12 22.42 2hnb s ALA 87 CO 0.06 -0.41 -0.07 0.42 0.00 0.00 0.00 175.76 175.75 2hnb s ILE 88 N 1.86 0.65 0.11 0.00 1.01 -0.46 -2.73 121.20 121.63 2hnb s ILE 88 Ca -0.03 -0.25 0.07 0.00 0.00 0.00 0.00 60.65 60.44 2hnb s ILE 88 Cb -0.12 -0.62 -0.04 0.00 0.01 0.00 0.00 42.46 41.70 2hnb s ILE 88 CO -0.07 0.23 -0.06 -0.83 0.00 0.00 0.00 174.94 174.20 2hnb s GLY 89 N 0.50 1.82 0.02 6.18 0.00 -0.19 -1.67 107.32 113.98 2hnb s GLY 89 Ca -0.07 -1.22 0.00 0.00 0.00 0.00 0.00 44.72 43.42 2hnb s GLY 89 CO 0.01 -1.21 -0.03 -0.42 0.00 0.00 0.00 173.10 171.44 2hnb s ILE 90 N -1.30 0.14 0.00 0.90 1.01 -0.73 -1.33 121.20 119.89 2hnb s ILE 90 Ca 0.23 -0.96 0.00 0.00 0.00 0.00 0.00 60.65 59.92 2hnb s ILE 90 Cb -0.11 -0.33 0.00 0.00 0.01 0.00 0.00 42.46 42.03 2hnb s ILE 90 CO 0.15 -0.52 0.00 0.61 0.00 0.00 0.00 174.94 175.19 2hnb n GLY 91 N 1.53 1.91 0.00 6.18 0.00 -1.12 -0.36 105.19 113.33 2hnb n GLY 91 Ca -0.23 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.64 2hnb n GLY 91 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2hnb n SER 92 N 0.00 0.00 0.00 1.61 7.64 -1.25 -4.50 113.62 117.12 2hnb n SER 92 Ca 0.00 0.00 0.06 0.00 1.01 0.00 0.00 58.87 59.94 2hnb n SER 92 Cb 0.00 0.00 0.34 0.00 -1.01 0.00 0.00 64.21 63.54 2hnb n SER 92 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2hnb n ARG 93 N 0.43 0.39 0.19 1.43 1.74 -1.26 -1.98 116.66 117.60 2hnb n ARG 93 Ca 0.00 0.00 0.05 0.00 -0.77 0.00 0.00 57.85 57.13 2hnb n ARG 93 Cb 0.00 -1.46 0.48 0.00 -1.02 0.00 0.00 32.46 30.46 2hnb n ARG 93 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 2hnb h GLU 94 N 0.00 0.07 -7.23 5.56 4.39 -1.92 -3.44 114.58 112.01 2hnb h GLU 94 Ca 0.00 -0.01 -0.51 0.00 0.34 0.00 0.00 59.36 59.18 2hnb h GLU 94 Cb 0.00 -0.01 0.10 0.00 -0.10 0.00 0.00 28.75 28.74 2hnb h GLU 94 CO 0.00 0.23 0.36 0.71 -1.16 0.00 0.00 179.01 179.15 2hnb s TYR 95 N -4.69 2.70 0.30 4.33 2.02 -0.84 -4.97 117.35 116.21 2hnb s TYR 95 Ca -0.04 1.54 -0.01 0.00 -0.37 0.00 0.00 57.07 58.18 2hnb s TYR 95 Cb 0.16 -3.10 0.46 0.00 -0.40 0.00 0.00 41.96 39.09 2hnb s TYR 95 CO 0.71 -1.59 1.93 0.22 -1.57 0.00 0.00 175.55 175.24 2hnb h ASP 96 N -0.22 0.86 -3.68 2.29 3.58 -1.83 -3.37 116.42 114.05 2hnb h ASP 96 Ca -0.46 -0.06 -0.62 0.00 0.42 0.00 0.00 57.03 56.31 2hnb h ASP 96 Cb 1.24 -0.22 -0.14 0.00 1.72 0.00 0.00 39.33 41.93 2hnb h ASP 96 CO 0.54 0.68 -0.30 -0.89 -2.88 0.00 0.00 179.24 176.40 2hnb s THR 97 N -5.67 5.22 -1.04 2.25 2.01 -0.68 -5.00 115.64 112.72 2hnb s THR 97 Ca -0.11 0.50 -0.19 0.00 0.31 0.00 0.00 61.69 62.21 2hnb s THR 97 Cb 0.17 -3.66 -0.08 0.00 0.01 0.00 0.00 72.50 68.94 2hnb s THR 97 CO 0.79 0.21 2.05 0.49 -0.69 0.00 0.00 174.62 177.48 2hnb n PHE 98 N 4.99 2.50 -2.80 4.92 3.72 -1.26 -4.18 117.46 125.35 2hnb n PHE 98 Ca -0.10 -2.27 -0.17 0.00 -0.05 0.00 0.00 57.45 54.87 2hnb n PHE 98 Cb 0.51 -2.04 -0.00 0.00 -0.94 0.00 0.00 39.48 37.01 2hnb n PHE 98 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2hnb n GLY 100 N -0.98 -0.17 0.28 0.00 0.00 -1.26 -4.34 105.19 98.72 2hnb n GLY 100 Ca -0.10 -0.42 0.12 0.00 0.00 0.00 0.00 46.02 45.62 2hnb n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hnb h ALA 101 N 4.22 1.62 -0.17 4.61 0.00 -1.85 -0.93 119.26 126.77 2hnb h ALA 101 Ca 0.00 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 54.93 2hnb h ALA 101 Cb 0.47 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2hnb h ALA 101 CO 0.00 0.04 0.14 0.97 0.00 0.00 0.00 179.25 180.40 2hnb h ILE 102 N 0.00 0.73 -0.97 0.00 6.09 -1.83 -3.00 117.51 118.52 2hnb h ILE 102 Ca -0.00 0.00 0.18 0.00 -1.37 0.00 0.00 64.86 63.66 2hnb h ILE 102 Cb 0.07 0.90 -0.09 0.00 0.47 0.00 0.00 36.82 38.17 2hnb h ILE 102 CO 0.00 0.00 0.61 -0.78 -3.07 0.00 0.00 178.15 174.92 2hnb h ASP 103 N 0.00 0.73 -0.13 2.19 3.58 -1.50 -1.20 116.42 120.08 2hnb h ASP 103 Ca 0.08 0.07 -0.20 0.00 0.42 0.00 0.00 57.03 57.40 2hnb h ASP 103 Cb 0.36 -0.06 0.01 0.00 1.72 0.00 0.00 39.33 41.36 2hnb h ASP 103 CO -0.00 0.30 -0.70 0.11 -2.88 0.00 0.00 179.24 176.07 2hnb h LYS 104 N 0.73 0.71 0.13 0.28 1.79 -1.74 -1.00 116.57 117.47 2hnb h LYS 104 Ca 0.53 -0.59 -0.01 0.00 -2.18 0.00 0.00 60.65 58.41 2hnb h LYS 104 Cb 0.86 0.12 0.00 0.00 -1.58 0.00 0.00 32.23 31.64 2hnb h LYS 104 CO -0.30 1.20 -0.06 -0.07 -1.08 0.00 0.00 179.45 179.14 2hnb h LEU 105 N 0.41 -0.14 -0.58 2.94 3.38 -1.56 -2.95 115.31 116.80 2hnb h LEU 105 Ca -0.05 -0.17 -0.13 0.00 0.09 0.00 0.00 57.88 57.62 2hnb h LEU 105 Cb 1.34 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 42.11 2hnb h LEU 105 CO 0.15 0.09 -0.24 1.05 0.09 0.00 0.00 178.44 179.58 2hnb h GLU 106 N -0.38 0.88 -0.19 1.13 4.11 -1.24 -2.83 114.58 116.06 2hnb h GLU 106 Ca -0.02 -0.37 -0.09 0.00 0.07 0.00 0.00 59.36 58.95 2hnb h GLU 106 Cb 0.31 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 2hnb h GLU 106 CO 0.03 1.02 -0.27 0.00 0.07 0.00 0.00 179.01 179.86 2hnb h ALA 107 N 0.97 1.19 -0.01 1.06 0.00 -1.22 -1.41 119.26 119.84 2hnb h ALA 107 Ca 0.10 -0.33 -0.16 0.00 0.00 0.00 0.00 54.91 54.52 2hnb h ALA 107 Cb 0.79 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 2hnb h ALA 107 CO 0.07 0.52 -0.72 1.49 0.00 0.00 0.00 179.25 180.61 2hnb h GLU 108 N 0.31 0.08 -0.51 0.00 4.57 -1.32 0.76 114.58 118.48 2hnb h GLU 108 Ca 0.05 -0.07 -0.04 0.00 -1.18 0.00 0.00 59.36 58.11 2hnb h GLU 108 Cb 0.65 0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 29.23 2hnb h GLU 108 CO 0.05 0.77 0.17 -0.07 -1.18 0.00 0.00 179.01 178.74 2hnb h LEU 109 N 0.05 0.73 -0.55 1.64 3.38 -1.24 -0.73 115.31 118.60 2hnb h LEU 109 Ca -0.01 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.74 2hnb h LEU 109 Cb 1.28 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.81 2hnb h LEU 109 CO 0.10 0.74 0.28 0.50 0.09 0.00 0.00 178.44 180.15 2hnb h LYS 110 N 0.69 0.78 -0.44 1.13 3.64 -0.85 -1.39 116.57 120.13 2hnb h LYS 110 Ca 0.17 -0.10 -0.06 0.00 -1.27 0.00 0.00 60.65 59.39 2hnb h LYS 110 Cb 0.26 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 31.91 2hnb h LYS 110 CO -0.01 0.62 0.04 -0.97 -2.27 0.00 0.00 179.45 176.86 2hnb h ASN 111 N 0.74 0.65 0.42 4.20 -1.24 -0.76 -0.89 115.58 118.71 2hnb h ASN 111 Ca 0.19 -0.13 0.00 0.00 0.71 0.00 0.00 56.30 57.07 2hnb h ASN 111 Cb 0.08 -0.17 0.00 0.00 0.73 0.00 0.00 38.32 38.96 2hnb h ASN 111 CO -0.03 0.70 0.00 -1.20 -1.29 0.00 0.00 177.43 175.61 2hnb n SER 112 N -4.26 0.00 0.00 1.15 7.64 -0.29 -4.89 113.62 112.98 2hnb n SER 112 Ca 0.02 0.22 0.00 0.00 1.01 0.00 0.00 58.87 60.12 2hnb n SER 112 Cb 0.26 -0.37 0.00 0.00 -1.01 0.00 0.00 64.21 63.09 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 0.20 2.07 3.44 0.23 0.00 -0.34 -1.03 105.19 109.77 2hnb n GLY 113 Ca 0.07 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.04 -0.66 0.03 4.61 0.00 -0.61 -4.10 121.76 118.99 2hnb s ALA 114 Ca 0.00 -0.30 -0.04 0.00 0.00 0.00 0.00 51.96 51.62 2hnb s ALA 114 Cb 0.00 -3.18 -0.01 0.00 0.00 0.00 0.00 23.12 19.93 2hnb s ALA 114 CO 0.00 -4.07 0.06 0.15 0.00 0.00 0.00 175.76 171.89 2hnb s LYS 115 N -4.57 0.50 0.68 0.00 1.02 -1.11 -4.17 119.74 112.09 2hnb s LYS 115 Ca 0.69 -0.71 -0.14 0.00 0.02 0.00 0.00 55.97 55.83 2hnb s LYS 115 Cb -0.23 0.19 0.01 0.00 -0.52 0.00 0.00 37.83 37.28 2hnb s LYS 115 CO 0.64 -0.11 1.09 -1.14 -0.92 0.00 0.00 175.35 174.90 2hnb s GLN 116 N -2.27 2.80 0.10 1.68 0.74 -1.26 -1.36 119.66 120.09 2hnb s GLN 116 Ca -0.08 1.26 0.07 0.00 0.05 0.00 0.00 55.36 56.65 2hnb s GLN 116 Cb -0.03 -1.96 -0.03 0.00 1.10 0.00 0.00 33.01 32.08 2hnb s GLN 116 CO -0.03 -1.24 -0.17 0.99 -0.55 0.00 0.00 175.29 174.30 2hnb s THR 117 N -2.57 1.43 0.00 -0.34 2.01 0.34 -4.78 115.64 111.73 2hnb s THR 117 Ca 0.64 -1.55 0.00 0.00 0.31 0.00 0.00 61.69 61.09 2hnb s THR 117 Cb -0.18 -1.42 0.00 0.00 0.01 0.00 0.00 72.50 70.91 2hnb s THR 117 CO 0.45 -0.23 0.00 0.61 -0.69 0.00 0.00 174.62 174.76 2hnb n GLY 118 N 0.92 1.60 3.14 4.40 0.00 -1.26 -4.63 105.19 109.36 2hnb n GLY 118 Ca -0.18 -0.56 -0.12 0.00 0.00 0.00 0.00 46.02 45.16 2hnb n GLY 118 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2hnb s GLU 119 N 0.00 0.75 0.62 1.61 2.02 -1.26 -5.07 118.70 117.37 2hnb s GLU 119 Ca 0.00 -1.14 -0.17 0.00 0.02 0.00 0.00 54.97 53.68 2hnb s GLU 119 Cb 0.00 -0.28 -0.02 0.00 0.10 0.00 0.00 34.13 33.93 2hnb s GLU 119 CO 0.00 0.02 1.14 0.99 0.02 0.00 0.00 175.26 177.42 2hnb s THR 120 N -2.80 3.07 0.03 3.63 2.01 -1.26 -4.83 115.64 115.49 2hnb s THR 120 Ca 0.05 0.58 0.05 0.00 0.31 0.00 0.00 61.69 62.67 2hnb s THR 120 Cb -0.00 -3.14 -0.02 0.00 0.01 0.00 0.00 72.50 69.35 2hnb s THR 120 CO -0.03 -0.23 -0.14 -0.22 -0.69 0.00 0.00 174.62 173.31 2hnb s LEU 121 N -4.43 2.13 0.17 4.42 2.96 -1.11 -5.04 118.68 117.79 2hnb s LEU 121 Ca 0.71 -0.40 0.09 0.00 -0.22 0.00 0.00 54.13 54.31 2hnb s LEU 121 Cb -0.23 -0.63 -0.04 0.00 0.50 0.00 0.00 46.19 45.79 2hnb s LEU 121 CO 0.36 0.07 -0.13 -0.54 -1.32 0.00 0.00 176.35 174.79 2hnb s LYS 122 N -0.91 1.94 -0.20 1.98 -0.14 -1.26 -1.03 119.74 120.12 2hnb s LYS 122 Ca 0.03 -1.30 -0.03 0.00 -1.36 0.00 0.00 55.97 53.31 2hnb s LYS 122 Cb -0.07 -2.10 0.06 0.00 -1.68 0.00 0.00 37.83 34.04 2hnb s LYS 122 CO 0.01 0.43 0.04 0.42 -0.76 0.00 0.00 175.35 175.50 2hnb s ILE 123 N -1.63 0.51 0.16 2.17 1.01 -0.44 -4.94 121.20 118.03 2hnb s ILE 123 Ca 0.23 -0.60 -0.30 0.00 0.00 0.00 0.00 60.65 59.98 2hnb s ILE 123 Cb -0.09 -1.05 -0.07 0.00 0.01 0.00 0.00 42.46 41.26 2hnb s ILE 123 CO 0.14 -0.26 1.03 0.21 0.00 0.00 0.00 174.94 176.06 2hnb s ASN 124 N 1.86 7.39 0.00 3.58 3.84 -1.26 -2.78 114.94 127.57 2hnb s ASN 124 Ca 0.00 1.97 0.00 0.00 0.21 0.00 0.00 52.86 55.04 2hnb s ASN 124 Cb -0.17 -2.60 0.00 0.00 -0.55 0.00 0.00 41.25 37.93 2hnb s ASN 124 CO -0.10 -0.12 0.00 2.30 -2.79 0.00 0.00 177.10 176.39 2hnb n ILE 125 N 2.41 0.00 0.10 -5.21 -5.35 -1.26 -2.28 119.36 107.76 2hnb n ILE 125 Ca 0.02 -0.12 0.11 0.00 -0.27 0.00 0.00 62.75 62.50 2hnb n ILE 125 Cb 0.47 0.58 -0.07 0.00 -1.74 0.00 0.00 39.64 38.88 2hnb n ILE 125 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 2hnb n LEU 126 N -0.69 0.47 0.07 7.28 4.77 -1.26 -4.49 117.00 123.15 2hnb n LEU 126 Ca 0.00 0.15 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 2hnb n LEU 126 Cb 0.00 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.05 2hnb n LEU 126 CO 0.00 -0.09 0.00 -0.67 -1.33 0.00 0.00 177.39 175.30 2hnb n ASP 127 N -2.43 -0.51 0.03 -1.43 2.03 -1.26 -4.90 116.55 108.08 2hnb n ASP 127 Ca -0.02 0.26 -0.14 0.00 0.52 0.00 0.00 54.79 55.41 2hnb n ASP 127 Cb 0.55 0.62 -0.03 0.00 -0.72 0.00 0.00 41.12 41.53 2hnb n ASP 127 CO 0.00 0.00 0.00 0.45 -1.92 0.00 0.00 177.20 175.73 2hnb h HIS 128 N 0.00 0.77 -6.76 -0.67 3.86 -1.88 -3.48 115.15 107.00 2hnb h HIS 128 Ca 0.00 -0.37 -0.52 0.00 -1.16 0.00 0.00 60.37 58.32 2hnb h HIS 128 Cb 0.00 -0.11 0.00 0.00 1.06 0.00 0.00 27.41 28.36 2hnb h HIS 128 CO 0.00 1.17 -1.01 -3.47 0.86 0.00 0.00 177.93 175.48 2hnb n ASP 129 N -3.84 -4.64 -4.54 2.45 2.03 -1.22 -4.75 116.55 102.03 2hnb n ASP 129 Ca -0.07 -1.11 -0.55 0.00 0.52 0.00 0.00 54.79 53.58 2hnb n ASP 129 Cb 0.77 -1.93 -0.07 0.00 -0.72 0.00 0.00 41.12 39.18 2hnb n ASP 129 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2hnb n ILE 130 N -3.93 0.09 -0.50 5.18 3.06 -0.97 -4.95 119.36 117.35 2hnb n ILE 130 Ca -0.19 -0.02 -0.29 0.00 -2.50 0.00 0.00 62.75 59.75 2hnb n ILE 130 Cb 0.62 -0.41 0.24 0.00 0.54 0.00 0.00 39.64 40.63 2hnb n ILE 130 CO 0.00 0.00 0.00 -2.65 -2.50 0.00 0.00 176.55 171.40 2hnb n PRO 131 N 1.96 -2.51 0.13 9.51 -0.02 -1.26 -4.96 135.00 137.86 2hnb n PRO 131 Ca 0.19 -0.71 -0.01 0.00 -2.02 0.00 0.00 63.50 60.95 2hnb n PRO 131 Cb 0.14 -2.00 0.14 0.00 -0.02 0.00 0.00 33.50 31.77 2hnb n PRO 131 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2hnb h GLU 132 N -2.63 0.00 -0.30 -0.52 4.81 -2.01 -3.36 114.58 110.57 2hnb h GLU 132 Ca -0.59 0.00 0.05 0.00 -0.13 0.00 0.00 59.36 58.69 2hnb h GLU 132 Cb 1.34 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.67 2hnb h GLU 132 CO 0.45 0.64 -0.02 0.22 -0.73 0.00 0.00 179.01 179.56 2hnb h ASP 133 N 0.00 -0.17 0.58 1.04 3.58 -2.00 -0.87 116.42 118.58 2hnb h ASP 133 Ca -0.01 0.07 -0.06 0.00 0.42 0.00 0.00 57.03 57.46 2hnb h ASP 133 Cb 1.18 0.14 -0.01 0.00 1.72 0.00 0.00 39.33 42.36 2hnb h ASP 133 CO 0.08 -0.05 -0.26 1.55 -2.88 0.00 0.00 179.24 177.68 2hnb h PRO 134 N 0.06 0.00 -0.36 0.28 0.13 -1.97 -1.18 132.00 128.96 2hnb h PRO 134 Ca 0.14 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.23 2hnb h PRO 134 Cb 0.20 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.32 2hnb h PRO 134 CO -0.26 0.26 0.05 0.00 -0.23 0.00 0.00 178.00 177.82 2hnb h ALA 135 N 1.74 0.48 -0.46 -0.56 0.00 -1.42 -0.30 119.26 118.73 2hnb h ALA 135 Ca -0.00 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 2hnb h ALA 135 Cb 0.62 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2hnb h ALA 135 CO 0.03 0.20 0.22 1.49 0.00 0.00 0.00 179.25 181.20 2hnb h GLU 136 N 0.44 0.67 -0.02 0.00 4.81 -0.85 -0.12 114.58 119.50 2hnb h GLU 136 Ca 0.11 -0.10 -0.00 0.00 -0.13 0.00 0.00 59.36 59.24 2hnb h GLU 136 Cb 0.38 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.64 2hnb h GLU 136 CO 0.01 0.57 0.01 1.49 -0.73 0.00 0.00 179.01 180.35 2hnb h GLU 137 N 0.61 0.03 -0.32 1.92 4.81 -1.12 -1.19 114.58 119.31 2hnb h GLU 137 Ca 0.16 -0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.27 2hnb h GLU 137 Cb 0.12 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.48 2hnb h GLU 137 CO -0.02 0.14 -0.27 2.35 -0.73 0.00 0.00 179.01 180.48 2hnb h TRP 138 N -0.09 0.73 -0.85 0.92 2.91 -0.97 -1.94 115.95 116.65 2hnb h TRP 138 Ca 0.01 -0.17 0.00 0.00 1.13 0.00 0.00 58.89 59.86 2hnb h TRP 138 Cb 0.12 -0.17 -0.04 0.00 -0.51 0.00 0.00 29.16 28.56 2hnb h TRP 138 CO -0.03 0.84 0.54 1.25 -1.03 0.00 0.00 178.44 180.01 2hnb h LEU 139 N 0.55 1.00 -0.27 0.65 5.85 -0.91 -0.12 115.31 122.06 2hnb h LEU 139 Ca 0.07 -0.04 0.05 0.00 0.84 0.00 0.00 57.88 58.80 2hnb h LEU 139 Cb 0.75 -0.25 -0.05 0.00 0.37 0.00 0.00 40.66 41.48 2hnb h LEU 139 CO 0.06 0.74 -0.05 1.23 -0.34 0.00 0.00 178.44 180.07 2hnb h GLY 140 N 1.16 0.21 1.36 3.75 0.00 -0.50 0.09 103.07 109.15 2hnb h GLY 140 Ca 0.31 0.08 -0.02 0.00 0.00 0.00 0.00 47.33 47.69 2hnb h GLY 140 CO -0.06 -0.09 0.26 1.76 0.00 0.00 0.00 176.54 178.40 2hnb h SER 141 N 0.02 0.74 0.21 0.19 0.02 -0.88 -1.50 113.55 112.35 2hnb h SER 141 Ca 0.13 -0.08 -0.01 0.00 -0.84 0.00 0.00 61.79 60.99 2hnb h SER 141 Cb 0.19 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 62.55 2hnb h SER 141 CO -0.27 0.65 -0.10 -0.25 -1.14 0.00 0.00 176.83 175.72 2hnb h TRP 142 N 0.82 -0.26 0.00 3.45 7.01 -0.35 -3.21 115.95 123.40 2hnb h TRP 142 Ca 0.20 -0.01 -0.06 0.00 2.11 0.00 0.00 58.89 61.13 2hnb h TRP 142 Cb 0.11 0.09 -0.01 0.00 -2.10 0.00 0.00 29.16 27.25 2hnb h TRP 142 CO 0.01 0.06 -0.31 -0.39 -2.79 0.00 0.00 178.44 175.02 2hnb h VAL 143 N -0.60 1.21 -0.30 2.65 -1.51 -0.83 -2.58 116.25 114.29 2hnb h VAL 143 Ca -0.03 -1.06 0.09 0.00 -1.23 0.00 0.00 66.70 64.47 2hnb h VAL 143 Cb 0.44 1.57 -0.01 0.00 -2.13 0.00 0.00 31.29 31.16 2hnb h VAL 143 CO 0.05 0.30 0.35 -1.13 -1.23 0.00 0.00 177.57 175.91 2hnb h ASN 144 N 0.00 0.00 -0.03 4.19 -0.73 -1.28 0.39 115.58 118.12 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 0.55 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.14 2hnb h ASN 144 CO 0.04 0.00 -0.03 0.18 -0.37 0.00 0.00 177.43 177.25 2hnb n LEU 145 N -3.69 2.92 0.00 0.34 4.77 -0.97 -4.39 117.00 115.98 2hnb n LEU 145 Ca 0.05 -0.99 0.00 0.00 -0.03 0.00 0.00 56.01 55.04 2hnb n LEU 145 Cb 0.50 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 2hnb n LEU 145 CO 0.26 0.49 0.02 0.00 -1.33 0.00 0.00 177.39 176.84 2hnb n LEU 146 N 1.26 0.09 0.00 2.23 -0.00 -0.05 -4.93 117.00 115.59 2hnb n LEU 146 Ca 0.14 -0.43 0.00 0.00 -0.00 0.00 0.00 56.01 55.72 2hnb n LEU 146 Cb 0.58 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 44.00 2hnb n LEU 146 CO 0.15 0.02 0.09 0.29 -0.00 0.00 0.00 177.39 177.95