#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2npb s ALA 2 N 0.00 -0.59 -0.27 3.17 0.00 -1.26 -4.75 121.76 118.05 2npb s ALA 2 Ca 0.00 -0.04 -0.06 0.00 0.00 0.00 0.00 51.96 51.86 2npb s ALA 2 Cb 0.00 0.27 -0.00 0.00 0.00 0.00 0.00 23.12 23.39 2npb s ALA 2 CO 0.00 -0.37 0.06 -1.17 0.00 0.00 0.00 175.76 174.28 2npb s LEU 3 N -1.96 3.62 -0.53 0.00 2.96 -0.49 -4.94 118.68 117.34 2npb s LEU 3 Ca -0.06 -0.55 -0.27 0.00 -0.22 0.00 0.00 54.13 53.03 2npb s LEU 3 Cb -0.02 -1.87 0.03 0.00 0.50 0.00 0.00 46.19 44.84 2npb s LEU 3 CO -0.02 -0.13 1.06 0.00 -1.32 0.00 0.00 176.35 175.93 2npb s ALA 4 N 1.52 3.12 -0.00 5.97 0.00 -1.26 -0.91 121.76 130.20 2npb s ALA 4 Ca 0.04 -0.88 0.03 0.00 0.00 0.00 0.00 51.96 51.15 2npb s ALA 4 Cb -0.16 -3.85 -0.03 0.00 0.00 0.00 0.00 23.12 19.08 2npb s ALA 4 CO 0.02 -2.40 -0.08 0.08 0.00 0.00 0.00 175.76 173.38 2npb s VAL 5 N 4.34 3.53 0.03 0.00 1.01 0.10 -0.27 120.40 129.14 2npb s VAL 5 Ca 0.39 -0.79 -0.01 0.00 0.00 0.00 0.00 61.98 61.57 2npb s VAL 5 Cb -0.09 -2.51 -0.02 0.00 0.00 0.00 0.00 36.38 33.75 2npb s VAL 5 CO 0.25 0.42 -0.00 -0.13 0.00 0.00 0.00 175.10 175.63 2npb s ARG 6 N -1.32 0.44 -0.08 2.72 3.00 -0.24 -0.86 118.95 122.60 2npb s ARG 6 Ca 0.16 -0.77 -0.03 0.00 0.00 0.00 0.00 55.73 55.08 2npb s ARG 6 Cb -0.11 0.16 0.05 0.00 0.00 0.00 0.00 34.95 35.04 2npb s ARG 6 CO 0.06 -0.08 0.14 0.08 0.00 0.00 0.00 175.30 175.50 2npb s VAL 7 N -2.25 -0.23 -0.19 3.52 1.01 -1.23 -1.22 120.40 119.81 2npb s VAL 7 Ca -0.09 0.34 -0.27 0.00 0.00 0.00 0.00 61.98 61.96 2npb s VAL 7 Cb -0.04 -0.29 -0.00 0.00 0.00 0.00 0.00 36.38 36.05 2npb s VAL 7 CO -0.04 0.13 0.92 0.54 0.00 0.00 0.00 175.10 176.65 2npb s VAL 8 N 2.27 4.80 0.05 2.92 0.11 -0.73 -0.90 120.40 128.91 2npb s VAL 8 Ca 0.04 1.80 0.03 0.00 -2.93 0.00 0.00 61.98 60.92 2npb s VAL 8 Cb -0.12 -4.21 -0.02 0.00 -1.53 0.00 0.00 36.38 30.49 2npb s VAL 8 CO -0.06 -0.06 -0.10 -0.47 -3.33 0.00 0.00 175.10 171.08 2npb s TYR 9 N 2.60 0.88 -0.84 1.54 5.04 -0.61 -1.36 117.35 124.59 2npb s TYR 9 Ca 0.41 -0.46 -0.22 0.00 -2.44 0.00 0.00 57.07 54.36 2npb s TYR 9 Cb -0.16 -0.51 0.09 0.00 0.35 0.00 0.00 41.96 41.72 2npb s TYR 9 CO 0.10 -0.03 1.16 -1.54 -1.34 0.00 0.00 175.55 173.90 2npb s SER 10 N -1.56 6.41 0.00 4.32 1.04 -1.07 -1.42 113.70 121.43 2npb s SER 10 Ca -0.06 -1.43 0.00 0.00 0.48 0.00 0.00 55.95 54.93 2npb s SER 10 Cb -0.10 -2.46 0.00 0.00 0.10 0.00 0.00 66.02 63.57 2npb s SER 10 CO 0.01 -1.35 0.41 0.61 0.98 0.00 0.00 173.24 173.90 2npb n GLY 11 N 5.72 0.82 0.38 7.32 0.00 0.50 -4.69 105.19 115.24 2npb n GLY 11 Ca 0.15 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.32 2npb n GLY 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2npb h ALA 12 N 2.01 1.98 -2.80 4.61 0.00 -1.84 -3.41 119.26 119.81 2npb h ALA 12 Ca 0.00 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 2npb h ALA 12 Cb 0.41 -0.07 -0.11 0.00 0.00 0.00 0.00 17.79 18.01 2npb h ALA 12 CO 0.00 -0.26 -0.06 0.00 0.00 0.00 0.00 179.25 178.93 2npb n GLY 14 N -0.29 0.00 0.33 0.00 0.00 -1.26 -4.84 105.19 99.12 2npb n GLY 14 Ca -0.10 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.87 2npb n GLY 14 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 2npb h TYR 15 N 0.00 1.07 0.35 1.61 -0.00 -1.96 -3.23 116.97 114.81 2npb h TYR 15 Ca 0.00 -0.09 -0.00 0.00 -0.00 0.00 0.00 58.73 58.64 2npb h TYR 15 Cb 0.72 -0.32 -0.03 0.00 -0.00 0.00 0.00 36.73 37.11 2npb h TYR 15 CO 0.46 0.83 -0.48 0.87 -0.00 0.00 0.00 178.16 179.84 2npb h LYS 16 N 1.01 -0.84 -0.42 0.10 1.57 -1.95 0.65 116.57 116.70 2npb h LYS 16 Ca 0.23 0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 59.01 2npb h LYS 16 Cb 0.24 0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.72 2npb h LYS 16 CO -0.01 -0.56 0.01 -1.00 -0.57 0.00 0.00 179.45 177.32 2npb h PRO 17 N -0.87 0.67 -0.58 3.15 0.13 -1.99 -1.75 132.00 130.77 2npb h PRO 17 Ca -0.03 -0.16 0.09 0.00 -0.87 0.00 0.00 66.00 65.02 2npb h PRO 17 Cb 0.80 -0.09 -0.07 0.00 0.13 0.00 0.00 31.00 31.77 2npb h PRO 17 CO -0.14 0.69 0.21 -0.22 -0.23 0.00 0.00 178.00 178.31 2npb h LYS 18 N 0.64 0.37 0.79 0.86 1.63 -1.49 -0.23 116.57 119.15 2npb h LYS 18 Ca 0.13 -0.02 -0.04 0.00 -0.85 0.00 0.00 60.65 59.87 2npb h LYS 18 Cb 0.39 -0.08 0.01 0.00 -0.60 0.00 0.00 32.23 31.94 2npb h LYS 18 CO 0.01 0.25 -0.38 -0.92 -3.45 0.00 0.00 179.45 174.96 2npb h TYR 19 N 0.39 -0.98 -0.76 1.91 5.03 -0.66 -3.19 116.97 118.71 2npb h TYR 19 Ca 0.29 -0.02 0.11 0.00 2.58 0.00 0.00 58.73 61.69 2npb h TYR 19 Cb 0.35 0.32 -0.05 0.00 1.55 0.00 0.00 36.73 38.90 2npb h TYR 19 CO -0.17 -0.60 0.50 -0.07 -1.32 0.00 0.00 178.16 176.49 2npb h LEU 20 N -1.08 0.54 -1.86 2.82 4.07 -1.04 -1.23 115.31 117.53 2npb h LEU 20 Ca -0.11 0.02 -0.02 0.00 0.08 0.00 0.00 57.88 57.85 2npb h LEU 20 Cb 0.81 -0.09 -0.00 0.00 1.08 0.00 0.00 40.66 42.46 2npb h LEU 20 CO 0.18 0.31 -0.09 -0.61 -1.08 0.00 0.00 178.44 177.15 2npb h GLN 21 N 0.59 0.00 0.03 1.13 -0.00 -1.03 0.37 115.11 116.20 2npb h GLN 21 Ca 0.36 0.00 -0.04 0.00 -0.00 0.00 0.00 58.65 58.96 2npb h GLN 21 Cb 0.59 0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.08 2npb h GLN 21 CO -0.13 0.09 -0.19 1.25 0.00 0.00 0.00 178.83 179.85 2npb h LEU 22 N 0.00 0.12 0.11 -2.39 5.85 -1.51 -3.38 115.31 114.11 2npb h LEU 22 Ca -0.00 -0.96 -0.01 0.00 0.84 0.00 0.00 57.88 57.75 2npb h LEU 22 Cb 0.16 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.15 2npb h LEU 22 CO 0.01 1.07 -0.05 0.50 -0.34 0.00 0.00 178.44 179.62 2npb h LYS 23 N -0.82 -0.15 -0.96 1.25 3.64 0.02 -2.82 116.57 116.74 2npb h LYS 23 Ca -0.03 0.01 0.22 0.00 -1.27 0.00 0.00 60.65 59.58 2npb h LYS 23 Cb 1.12 0.03 -0.18 0.00 -0.41 0.00 0.00 32.23 32.80 2npb h LYS 23 CO 0.04 0.05 -0.12 1.49 -2.27 0.00 0.00 179.45 178.64 2npb h GLU 24 N -0.33 0.01 -0.35 1.90 4.22 -0.58 -0.81 114.58 118.63 2npb h GLU 24 Ca -0.02 -0.00 -0.02 0.00 0.08 0.00 0.00 59.36 59.40 2npb h GLU 24 Cb 0.27 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 2npb h GLU 24 CO 0.03 0.01 0.13 -0.22 -2.18 0.00 0.00 179.01 176.78 2npb h LYS 25 N 0.01 0.53 0.09 1.92 1.63 -1.68 0.18 116.57 119.25 2npb h LYS 25 Ca 0.51 -0.10 -0.00 0.00 -0.85 0.00 0.00 60.65 60.21 2npb h LYS 25 Cb 0.91 -0.08 0.00 0.00 -0.60 0.00 0.00 32.23 32.46 2npb h LYS 25 CO -0.95 0.53 -0.04 -0.07 -3.45 0.00 0.00 179.45 175.47 2npb h LEU 26 N 0.42 -0.10 -1.20 5.20 4.07 -1.16 -1.28 115.31 121.26 2npb h LEU 26 Ca 0.12 -0.18 -0.08 0.00 0.08 0.00 0.00 57.88 57.82 2npb h LEU 26 Cb 0.20 0.03 -0.01 0.00 1.08 0.00 0.00 40.66 41.96 2npb h LEU 26 CO -0.01 0.13 -0.27 -0.33 -1.08 0.00 0.00 178.44 176.87 2npb h GLU 27 N -0.32 0.20 -0.41 1.13 5.08 -1.20 -2.00 114.58 117.06 2npb h GLU 27 Ca -0.01 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.26 2npb h GLU 27 Cb 0.27 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.49 2npb h GLU 27 CO 0.02 0.47 0.17 1.25 -1.00 0.00 0.00 179.01 179.91 2npb h HIS 28 N 0.18 0.63 -0.52 4.33 2.76 -0.60 -2.36 115.15 119.57 2npb h HIS 28 Ca 0.03 -0.05 -0.12 0.00 -2.20 0.00 0.00 60.37 58.03 2npb h HIS 28 Cb 0.59 -0.19 -0.02 0.00 1.55 0.00 0.00 27.41 29.34 2npb h HIS 28 CO 0.01 0.55 -0.16 0.93 -1.30 0.00 0.00 177.93 177.96 2npb h GLU 29 N 0.52 1.03 -1.18 5.26 4.39 -1.03 -3.39 114.58 120.18 2npb h GLU 29 Ca 0.14 -0.41 -0.40 0.00 0.34 0.00 0.00 59.36 59.03 2npb h GLU 29 Cb 0.19 -0.05 -0.40 0.00 -0.10 0.00 0.00 28.75 28.39 2npb h GLU 29 CO -0.01 1.10 -1.14 1.19 -1.16 0.00 0.00 179.01 178.98 2npb n PHE 30 N -4.13 1.32 -1.83 4.33 3.72 -0.77 -5.10 117.46 115.00 2npb n PHE 30 Ca 0.01 -2.95 -0.42 0.00 -0.05 0.00 0.00 57.45 54.04 2npb n PHE 30 Cb 0.43 -0.35 -0.02 0.00 -0.94 0.00 0.00 39.48 38.60 2npb n PHE 30 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 2npb s PRO 31 N -3.10 4.16 0.00 -1.08 0.04 -0.89 -2.12 135.00 132.02 2npb s PRO 31 Ca 0.31 2.51 0.00 0.00 0.04 0.00 0.00 61.00 63.86 2npb s PRO 31 Cb 0.44 -3.06 0.00 0.00 0.04 0.00 0.00 34.50 31.92 2npb s PRO 31 CO 0.00 -0.61 0.00 0.41 0.04 0.00 0.00 177.00 176.84 2npb n GLY 32 N 2.62 1.39 0.08 0.56 0.00 -1.26 -4.60 105.19 103.98 2npb n GLY 32 Ca 0.10 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.22 2npb n GLY 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2npb s LEU 34 N -3.99 2.35 -0.06 0.00 1.43 -0.90 -1.40 118.68 116.11 2npb s LEU 34 Ca 0.06 -0.71 0.04 0.00 -1.03 0.00 0.00 54.13 52.49 2npb s LEU 34 Cb 0.10 -0.07 -0.00 0.00 0.03 0.00 0.00 46.19 46.25 2npb s LEU 34 CO 0.38 -0.33 -0.19 -0.62 0.23 0.00 0.00 176.35 175.83 2npb s ASP 35 N -2.09 2.42 -0.07 2.29 2.15 -0.09 -4.87 116.67 116.41 2npb s ASP 35 Ca -0.03 -0.41 -0.01 0.00 0.43 0.00 0.00 52.55 52.53 2npb s ASP 35 Cb -0.04 -0.84 0.03 0.00 -0.30 0.00 0.00 42.92 41.76 2npb s ASP 35 CO -0.02 0.15 -0.02 -0.63 -0.17 0.00 0.00 175.17 174.48 2npb s ILE 36 N 0.18 0.51 0.35 4.11 1.09 -1.26 0.00 121.20 126.18 2npb s ILE 36 Ca -0.09 0.02 0.00 0.00 -1.10 0.00 0.00 60.65 59.48 2npb s ILE 36 Cb -0.14 -0.62 -0.00 0.00 -1.06 0.00 0.00 42.46 40.63 2npb s ILE 36 CO 0.04 0.27 0.00 0.00 -0.10 0.00 0.00 174.94 175.16 2npb s GLY 38 N -2.91 -0.34 -0.62 0.00 0.00 -1.26 -3.49 107.32 98.71 2npb s GLY 38 Ca 0.01 0.08 0.05 0.00 0.00 0.00 0.00 44.72 44.86 2npb s GLY 38 CO 0.00 -0.10 0.48 1.18 0.00 0.00 0.00 173.10 174.66 2npb n GLU 39 N -0.34 1.43 -3.35 2.90 -0.58 -0.08 -4.91 120.64 115.72 2npb n GLU 39 Ca -0.14 -4.13 -0.45 0.00 -0.42 0.00 0.00 57.16 52.02 2npb n GLU 39 Cb 0.63 -2.10 -0.01 0.00 -0.57 0.00 0.00 31.44 29.40 2npb n GLU 39 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 2npb s GLY 40 N -1.15 3.07 0.40 0.62 0.00 -1.26 -1.57 107.32 107.43 2npb s GLY 40 Ca 0.28 -3.70 -0.24 0.00 0.00 0.00 0.00 44.72 41.06 2npb s GLY 40 CO -0.16 1.30 1.06 -1.08 0.00 0.00 0.00 173.10 174.22 2npb s THR 41 N -0.88 3.66 -1.97 0.90 -1.32 -0.51 -4.71 115.64 110.82 2npb s THR 41 Ca 0.27 1.29 0.20 0.00 -1.21 0.00 0.00 61.69 62.24 2npb s THR 41 Cb -0.10 -3.67 0.56 0.00 -1.51 0.00 0.00 72.50 67.77 2npb s THR 41 CO -0.08 0.02 1.58 -0.81 -2.21 0.00 0.00 174.62 173.12 2npb n PRO 42 N -0.04 0.60 -1.98 7.08 -0.04 -1.26 -0.37 135.00 139.00 2npb n PRO 42 Ca 0.05 0.01 -0.25 0.00 -0.04 0.00 0.00 63.50 63.26 2npb n PRO 42 Cb 0.49 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.39 2npb n PRO 42 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 2npb s GLN 43 N -2.03 2.30 -0.82 0.54 -0.21 -1.26 -4.72 119.66 113.45 2npb s GLN 43 Ca 0.29 -0.68 -0.23 0.00 0.02 0.00 0.00 55.36 54.76 2npb s GLN 43 Cb 0.14 -5.12 -0.19 0.00 1.00 0.00 0.00 33.01 28.83 2npb s GLN 43 CO 0.24 -3.99 2.42 1.55 -2.12 0.00 0.00 175.29 173.39 2npb n VAL 44 N 8.03 -0.02 -0.06 1.09 3.14 -1.26 -4.56 118.33 124.69 2npb n VAL 44 Ca 0.43 -0.45 0.00 0.00 -2.96 0.00 0.00 64.34 61.36 2npb n VAL 44 Cb 0.46 -1.30 0.00 0.00 -1.06 0.00 0.00 33.84 31.94 2npb n VAL 44 CO 0.00 0.00 0.00 0.35 -6.46 0.00 0.00 176.83 170.72 2npb n THR 45 N 7.43 0.00 -0.35 1.55 -2.24 -1.26 -5.07 114.28 114.34 2npb n THR 45 Ca 0.55 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.33 2npb n THR 45 Cb 0.28 0.36 0.00 0.00 -2.10 0.00 0.00 70.33 68.87 2npb n THR 45 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2npb n GLY 46 N 0.00 0.70 3.77 3.38 0.00 -1.26 -5.07 105.19 106.71 2npb n GLY 46 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 2npb n GLY 46 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2npb s PHE 47 N -2.56 3.06 -0.47 1.61 0.40 -1.26 -4.58 117.98 114.19 2npb s PHE 47 Ca 0.00 1.49 0.06 0.00 -0.60 0.00 0.00 56.93 57.88 2npb s PHE 47 Cb 0.00 -3.55 0.19 0.00 0.51 0.00 0.00 43.02 40.16 2npb s PHE 47 CO 0.00 -1.61 0.59 0.34 0.70 0.00 0.00 175.22 175.24 2npb n PHE 48 N 0.49 -2.64 -4.18 0.36 7.35 -1.23 -2.58 117.46 115.02 2npb n PHE 48 Ca 0.02 -2.17 -0.34 0.00 -0.76 0.00 0.00 57.45 54.20 2npb n PHE 48 Cb 0.44 0.98 -0.13 0.00 0.35 0.00 0.00 39.48 41.12 2npb n PHE 48 CO 0.00 0.00 0.00 -1.21 -0.76 0.00 0.00 176.76 174.79 2npb s GLU 49 N 0.50 3.48 -0.15 -4.13 0.41 -0.46 -2.61 118.70 115.73 2npb s GLU 49 Ca 0.31 -0.60 -0.02 0.00 -0.41 0.00 0.00 54.97 54.26 2npb s GLU 49 Cb 0.03 -2.94 -0.02 0.00 -1.78 0.00 0.00 34.13 29.42 2npb s GLU 49 CO -0.12 -0.01 -0.09 0.08 -0.49 0.00 0.00 175.26 174.63 2npb s VAL 50 N 0.99 3.31 0.05 2.63 1.01 -0.87 -1.77 120.40 125.74 2npb s VAL 50 Ca 0.00 -0.56 0.06 0.00 0.00 0.00 0.00 61.98 61.48 2npb s VAL 50 Cb -0.15 -2.42 -0.02 0.00 0.00 0.00 0.00 36.38 33.79 2npb s VAL 50 CO 0.01 0.50 -0.18 0.42 0.00 0.00 0.00 175.10 175.85 2npb s THR 51 N 0.54 1.42 -0.04 3.92 -4.23 -0.36 -0.61 115.64 116.28 2npb s THR 51 Ca -0.06 -1.15 -0.00 0.00 -1.18 0.00 0.00 61.69 59.30 2npb s THR 51 Cb -0.15 -1.26 0.03 0.00 1.34 0.00 0.00 72.50 72.45 2npb s THR 51 CO 0.03 0.09 0.01 0.54 -0.54 0.00 0.00 174.62 174.75 2npb s VAL 52 N -0.86 0.17 -0.36 2.29 0.11 0.12 -1.08 120.40 120.78 2npb s VAL 52 Ca 0.05 0.15 0.00 0.00 -2.93 0.00 0.00 61.98 59.24 2npb s VAL 52 Cb -0.09 -0.30 0.00 0.00 -1.53 0.00 0.00 36.38 34.47 2npb s VAL 52 CO 0.02 0.17 0.00 0.00 -3.33 0.00 0.00 175.10 171.96 2npb n ALA 53 N 4.51 -0.80 0.00 1.54 0.00 0.62 -0.30 120.51 126.08 2npb n ALA 53 Ca -0.19 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.28 2npb n ALA 53 Cb 0.50 -0.79 0.00 0.00 0.00 0.00 0.00 19.45 19.16 2npb n ALA 53 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2npb n GLY 54 N -0.52 3.18 3.61 0.00 0.00 -1.26 -5.03 105.19 105.16 2npb n GLY 54 Ca -0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.54 2npb n GLY 54 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2npb s LYS 55 N -0.40 3.35 0.13 1.61 -0.14 0.59 -4.86 119.74 120.02 2npb s LYS 55 Ca 0.00 1.75 -0.35 0.00 -1.36 0.00 0.00 55.97 56.01 2npb s LYS 55 Cb 0.00 -4.25 -0.16 0.00 -1.68 0.00 0.00 37.83 31.74 2npb s LYS 55 CO 0.00 -1.85 1.29 -0.11 -0.76 0.00 0.00 175.35 173.93 2npb n LEU 56 N 10.49 1.76 0.00 3.17 0.00 -1.26 -0.71 117.00 130.46 2npb n LEU 56 Ca 0.25 1.13 0.00 0.00 0.00 0.00 0.00 56.01 57.39 2npb n LEU 56 Cb 0.46 -1.23 0.00 0.00 0.00 0.00 0.00 43.42 42.65 2npb n LEU 56 CO 0.67 -1.06 -0.47 0.52 0.00 0.00 0.00 177.39 177.05 2npb n VAL 57 N 2.18 0.00 -4.11 1.96 0.31 0.22 -4.91 118.33 113.97 2npb n VAL 57 Ca 0.17 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.37 2npb n VAL 57 Cb 0.22 -0.47 -0.11 0.00 -0.91 0.00 0.00 33.84 32.58 2npb n VAL 57 CO 0.00 0.00 0.00 -2.28 -1.32 0.00 0.00 176.83 173.23 2npb s HIS 58 N -1.91 0.81 -0.29 3.52 5.65 -1.13 -4.98 115.29 116.96 2npb s HIS 58 Ca 0.00 -0.65 0.03 0.00 0.25 0.00 0.00 55.06 54.69 2npb s HIS 58 Cb 0.00 -0.47 0.17 0.00 -1.18 0.00 0.00 32.58 31.10 2npb s HIS 58 CO 0.00 -0.09 0.46 0.45 -0.65 0.00 0.00 174.74 174.92 2npb s SER 59 N -2.15 -0.25 0.43 9.88 0.15 -1.26 -2.05 113.70 118.44 2npb s SER 59 Ca -0.01 -0.11 0.12 0.00 0.70 0.00 0.00 55.95 56.65 2npb s SER 59 Cb -0.04 1.41 0.98 0.00 -1.71 0.00 0.00 66.02 66.66 2npb s SER 59 CO -0.01 -0.33 2.00 0.50 1.20 0.00 0.00 173.24 176.59 2npb h LYS 60 N 8.11 0.44 0.00 5.44 3.11 -1.83 -1.89 116.57 129.95 2npb h LYS 60 Ca -0.08 -0.03 0.00 0.00 -2.81 0.00 0.00 60.65 57.73 2npb h LYS 60 Cb 1.14 -0.10 0.00 0.00 -1.00 0.00 0.00 32.23 32.27 2npb h LYS 60 CO 0.23 0.29 0.00 1.17 -2.81 0.00 0.00 179.45 178.34 2npb n LYS 61 N -4.47 0.10 0.04 1.90 4.81 -1.26 -1.90 118.16 117.37 2npb n LYS 61 Ca 0.08 0.20 0.12 0.00 -0.87 0.00 0.00 58.31 57.84 2npb n LYS 61 Cb 0.30 -1.65 0.13 0.00 0.02 0.00 0.00 35.03 33.84 2npb n LYS 61 CO 0.00 0.00 0.00 2.89 1.17 0.00 0.00 177.40 181.46 2npb n ARG 62 N -1.82 0.23 -1.72 1.64 -4.01 -0.78 -4.99 116.66 105.20 2npb n ARG 62 Ca 0.05 0.04 0.00 0.00 -1.04 0.00 0.00 57.85 56.89 2npb n ARG 62 Cb 0.29 -1.61 0.00 0.00 -3.04 0.00 0.00 32.46 28.10 2npb n ARG 62 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 2npb n GLY 63 N 1.38 0.74 0.20 2.89 0.00 -0.80 -4.99 105.19 104.61 2npb n GLY 63 Ca 0.03 -0.68 -0.00 0.00 0.00 0.00 0.00 46.02 45.36 2npb n GLY 63 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2npb h ASP 64 N 0.00 0.17 -3.89 1.61 3.58 -1.59 -3.50 116.42 112.80 2npb h ASP 64 Ca 0.00 -0.07 0.05 0.00 0.42 0.00 0.00 57.03 57.44 2npb h ASP 64 Cb 0.81 -0.05 -0.03 0.00 1.72 0.00 0.00 39.33 41.78 2npb h ASP 64 CO 0.00 0.55 -0.53 0.61 -2.88 0.00 0.00 179.24 176.98 2npb n GLY 65 N -0.30 -3.30 1.45 -0.78 0.00 -1.26 -5.02 105.19 95.97 2npb n GLY 65 Ca -0.01 -1.13 -0.14 0.00 0.00 0.00 0.00 46.02 44.74 2npb n GLY 65 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2npb n TYR 66 N -2.40 -2.87 -1.57 1.61 4.01 -1.26 -4.79 117.16 109.88 2npb n TYR 66 Ca -0.02 -0.38 -0.42 0.00 -0.16 0.00 0.00 57.90 56.92 2npb n TYR 66 Cb 0.27 -0.56 -0.02 0.00 -0.31 0.00 0.00 39.34 38.72 2npb n TYR 66 CO 0.00 0.00 0.00 1.33 -0.46 0.00 0.00 176.86 177.73 2npb n VAL 67 N -4.24 3.01 0.38 -0.72 0.24 -1.26 -4.62 118.33 111.12 2npb n VAL 67 Ca 0.06 -2.62 0.13 0.00 -2.04 0.00 0.00 64.34 59.88 2npb n VAL 67 Cb 0.27 -2.53 0.53 0.00 -1.47 0.00 0.00 33.84 30.64 2npb n VAL 67 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 2npb h ASP 68 N 6.51 0.00 -5.00 -1.34 3.32 -1.95 -3.45 116.42 114.51 2npb h ASP 68 Ca 0.53 0.00 0.01 0.00 0.02 0.00 0.00 57.03 57.59 2npb h ASP 68 Cb 0.65 0.00 -0.10 0.00 0.22 0.00 0.00 39.33 40.10 2npb h ASP 68 CO 1.91 0.00 0.21 -0.89 -1.72 0.00 0.00 179.24 178.75 2npb s THR 69 N -3.39 0.00 0.34 0.35 2.01 -1.26 -5.02 115.64 108.67 2npb s THR 69 Ca 0.04 -0.37 0.03 0.00 0.31 0.00 0.00 61.69 61.70 2npb s THR 69 Cb 0.09 -1.36 0.28 0.00 0.01 0.00 0.00 72.50 71.52 2npb s THR 69 CO 0.45 -0.00 1.97 -0.33 -0.69 0.00 0.00 174.62 176.01 2npb h GLU 70 N 2.00 0.86 -0.11 4.92 4.39 -2.00 -0.10 114.58 124.55 2npb h GLU 70 Ca -0.29 -0.05 -0.07 0.00 0.34 0.00 0.00 59.36 59.29 2npb h GLU 70 Cb 1.29 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 29.73 2npb h GLU 70 CO 0.33 0.57 -0.25 1.03 -1.16 0.00 0.00 179.01 179.53 2npb h SER 71 N 0.88 0.19 -0.17 1.42 0.87 -1.98 0.74 113.55 115.51 2npb h SER 71 Ca 0.30 -0.05 -0.04 0.00 -1.23 0.00 0.00 61.79 60.77 2npb h SER 71 Cb 0.10 -0.05 -0.00 0.00 -0.44 0.00 0.00 62.40 62.01 2npb h SER 71 CO -0.09 0.44 -0.06 0.50 -0.53 0.00 0.00 176.83 177.09 2npb h LYS 72 N 0.18 0.34 -0.43 2.24 1.63 -1.43 -2.82 116.57 116.27 2npb h LYS 72 Ca 0.03 -0.14 0.05 0.00 -0.85 0.00 0.00 60.65 59.74 2npb h LYS 72 Cb 0.54 -0.01 -0.04 0.00 -0.60 0.00 0.00 32.23 32.11 2npb h LYS 72 CO 0.04 0.63 0.18 0.35 -3.45 0.00 0.00 179.45 177.20 2npb h PHE 73 N 0.02 0.33 -0.36 1.91 3.57 -0.99 -2.81 116.94 118.61 2npb h PHE 73 Ca 0.04 0.02 0.10 0.00 3.53 0.00 0.00 57.97 61.66 2npb h PHE 73 Cb 0.52 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.16 2npb h PHE 73 CO 0.06 0.15 0.26 -0.09 -2.23 0.00 0.00 178.31 176.46 2npb h ARG 74 N 0.37 0.00 -0.30 1.11 1.12 -0.83 0.69 114.38 116.54 2npb h ARG 74 Ca 0.20 0.00 -0.05 0.00 -1.11 0.00 0.00 59.98 59.01 2npb h ARG 74 Cb 0.15 0.00 -0.02 0.00 -0.01 0.00 0.00 29.97 30.10 2npb h ARG 74 CO -0.17 0.00 -0.04 -0.22 -3.11 0.00 0.00 179.97 176.43 2npb h LYS 75 N 0.00 0.47 0.17 0.20 3.11 -1.23 0.64 116.57 119.93 2npb h LYS 75 Ca 0.17 -0.10 -0.24 0.00 -2.81 0.00 0.00 60.65 57.67 2npb h LYS 75 Cb 0.70 -0.07 0.03 0.00 -1.00 0.00 0.00 32.23 31.89 2npb h LYS 75 CO -0.00 0.52 -1.05 1.25 -2.81 0.00 0.00 179.45 177.36 2npb h LEU 76 N 0.45 0.63 -0.30 5.20 7.12 -1.00 -3.19 115.31 124.22 2npb h LEU 76 Ca 0.09 -0.93 0.07 0.00 0.13 0.00 0.00 57.88 57.25 2npb h LEU 76 Cb 0.35 -0.20 -0.07 0.00 -0.53 0.00 0.00 40.66 40.21 2npb h LEU 76 CO 0.01 1.50 -0.15 0.58 -0.13 0.00 0.00 178.44 180.26 2npb h VAL 77 N -0.15 0.54 -0.84 1.05 2.07 -1.03 -1.68 116.25 116.22 2npb h VAL 77 Ca -0.18 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.34 2npb h VAL 77 Cb 1.82 0.54 -0.04 0.00 -1.52 0.00 0.00 31.29 32.09 2npb h VAL 77 CO 0.20 0.00 0.54 0.74 0.02 0.00 0.00 177.57 179.07 2npb h THR 78 N -0.11 1.22 0.00 2.57 2.02 -0.97 0.23 112.91 117.88 2npb h THR 78 Ca 0.16 -0.43 -0.18 0.00 0.77 0.00 0.00 66.41 66.73 2npb h THR 78 Cb 0.34 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 66.73 2npb h THR 78 CO -0.37 0.22 -0.85 0.00 0.37 0.00 0.00 175.52 174.89 2npb h ALA 79 N 1.45 0.46 0.01 6.16 0.00 -1.43 -1.95 119.26 123.95 2npb h ALA 79 Ca 0.30 -0.77 -0.26 0.00 0.00 0.00 0.00 54.91 54.18 2npb h ALA 79 Cb -0.10 -0.13 0.02 0.00 0.00 0.00 0.00 17.79 17.58 2npb h ALA 79 CO -0.06 1.05 -1.03 0.82 0.00 0.00 0.00 179.25 180.03 2npb h ILE 80 N 0.00 1.30 -0.29 0.00 1.08 -0.89 -2.64 117.51 116.07 2npb h ILE 80 Ca -0.01 -2.30 -0.08 0.00 -0.39 0.00 0.00 64.86 62.08 2npb h ILE 80 Cb 1.65 2.40 -0.01 0.00 -3.07 0.00 0.00 36.82 37.79 2npb h ILE 80 CO 0.11 0.71 -0.13 0.50 -0.69 0.00 0.00 178.15 178.64 2npb h LYS 81 N 0.36 0.61 0.39 2.37 3.64 -0.51 0.25 116.57 123.68 2npb h LYS 81 Ca -0.12 -0.26 -0.02 0.00 -1.27 0.00 0.00 60.65 58.98 2npb h LYS 81 Cb 1.69 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.49 2npb h LYS 81 CO 0.20 0.83 -0.19 0.00 -2.27 0.00 0.00 179.45 178.03 2npb h ALA 82 N 0.76 -0.52 0.00 5.00 0.00 -1.47 -2.02 119.26 121.01 2npb h ALA 82 Ca 0.07 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 2npb h ALA 82 Cb 0.64 0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 2npb h ALA 82 CO 0.04 -0.76 -0.16 0.00 0.00 0.00 0.00 179.25 178.38 2npb h ALA 83 N 0.01 1.64 0.36 0.00 0.00 -1.38 -1.72 119.26 118.17 2npb h ALA 83 Ca -0.05 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 2npb h ALA 83 Cb 0.44 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2npb h ALA 83 CO 0.09 0.20 -0.17 1.25 0.00 0.00 0.00 179.25 180.61 2npb h LEU 84 N 0.00 -0.41 -2.86 0.00 7.12 -0.85 -1.28 115.31 117.02 2npb h LEU 84 Ca -0.00 -0.12 0.00 0.00 0.13 0.00 0.00 57.88 57.89 2npb h LEU 84 Cb 0.29 0.11 -0.00 0.00 -0.53 0.00 0.00 40.66 40.53 2npb h LEU 84 CO 0.02 -0.10 0.03 0.00 -0.13 0.00 0.00 178.44 178.26 2npb h ALA 85 N -0.23 1.09 0.07 1.25 0.00 -0.83 0.11 119.26 120.72 2npb h ALA 85 Ca -0.05 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 2npb h ALA 85 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2npb h ALA 85 CO 0.08 -0.03 -0.03 1.96 0.00 0.00 0.00 179.25 181.23 2npb h GLN 86 N 0.00 -0.09 0.00 0.00 4.20 -1.22 -3.33 115.11 114.67 2npb h GLN 86 Ca 0.00 0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.72 2npb h GLN 86 Cb 0.06 0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.86 2npb h GLN 86 CO -0.00 0.29 0.00 0.00 -0.67 0.00 0.00 178.83 178.45