#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 2.10 -0.27 -5.12 0.00 -1.26 -5.00 121.76 112.20 2npb s ALA 2 Ca 0.00 -1.82 -0.01 0.00 0.00 0.00 0.00 51.96 50.13 2npb s ALA 2 Cb 0.00 0.26 0.04 0.00 0.00 0.00 0.00 23.12 23.42 2npb s ALA 2 CO 0.00 -0.12 -0.05 -1.17 0.00 0.00 0.00 175.76 174.42 2npb s LEU 3 N -3.38 3.54 -0.22 0.00 2.96 -0.47 -4.95 118.68 116.17 2npb s LEU 3 Ca 0.28 -1.18 -0.29 0.00 -0.22 0.00 0.00 54.13 52.72 2npb s LEU 3 Cb 0.04 -1.65 -0.01 0.00 0.50 0.00 0.00 46.19 45.07 2npb s LEU 3 CO 0.10 -0.20 1.29 0.00 -1.32 0.00 0.00 176.35 176.22 2npb s ALA 4 N 1.24 3.53 -0.00 5.97 0.00 -1.26 -0.75 121.76 130.49 2npb s ALA 4 Ca -0.04 0.32 0.07 0.00 0.00 0.00 0.00 51.96 52.31 2npb s ALA 4 Cb -0.19 -3.69 -0.03 0.00 0.00 0.00 0.00 23.12 19.22 2npb s ALA 4 CO -0.03 -1.44 -0.22 0.08 0.00 0.00 0.00 175.76 174.15 2npb s VAL 5 N 3.91 2.45 0.14 0.00 1.01 0.69 -0.76 120.40 127.83 2npb s VAL 5 Ca 0.56 -1.09 0.07 0.00 0.00 0.00 0.00 61.98 61.52 2npb s VAL 5 Cb -0.20 -1.94 -0.04 0.00 0.00 0.00 0.00 36.38 34.20 2npb s VAL 5 CO 0.18 0.49 -0.15 -0.13 0.00 0.00 0.00 175.10 175.49 2npb s ARG 6 N -0.93 1.11 -0.19 2.72 1.81 -0.03 -0.86 118.95 122.58 2npb s ARG 6 Ca 0.12 -1.30 -0.03 0.00 -1.72 0.00 0.00 55.73 52.80 2npb s ARG 6 Cb -0.10 -1.04 0.06 0.00 -0.45 0.00 0.00 34.95 33.42 2npb s ARG 6 CO 0.01 0.20 0.03 0.08 -0.68 0.00 0.00 175.30 174.95 2npb s VAL 7 N -2.14 0.50 0.07 3.52 1.01 -0.80 -1.62 120.40 120.95 2npb s VAL 7 Ca 0.11 -0.51 -0.23 0.00 0.00 0.00 0.00 61.98 61.36 2npb s VAL 7 Cb -0.05 -0.99 -0.06 0.00 0.00 0.00 0.00 36.38 35.28 2npb s VAL 7 CO 0.04 -0.18 0.68 0.54 0.00 0.00 0.00 175.10 176.18 2npb s VAL 8 N 1.87 4.69 0.00 2.92 0.11 -0.73 -0.95 120.40 128.31 2npb s VAL 8 Ca -0.01 1.45 0.00 0.00 -2.93 0.00 0.00 61.98 60.50 2npb s VAL 8 Cb -0.17 -4.02 0.00 0.00 -1.53 0.00 0.00 36.38 30.66 2npb s VAL 8 CO -0.08 0.46 0.00 0.00 -3.33 0.00 0.00 175.10 172.15 2npb n TYR 9 N 2.24 -0.85 -4.00 1.54 9.36 -1.13 -1.24 117.16 123.09 2npb n TYR 9 Ca -0.06 0.00 -0.22 0.00 3.32 0.00 0.00 57.90 60.94 2npb n TYR 9 Cb 0.50 0.00 -0.04 0.00 -0.63 0.00 0.00 39.34 39.17 2npb n TYR 9 CO 0.00 0.00 0.00 -1.54 0.22 0.00 0.00 176.86 175.54 2npb s SER 10 N -0.66 5.26 0.00 2.98 1.04 -0.90 -4.28 113.70 117.14 2npb s SER 10 Ca 0.00 -0.44 0.26 0.00 0.48 0.00 0.00 55.95 56.24 2npb s SER 10 Cb 0.00 -1.10 1.52 0.00 0.10 0.00 0.00 66.02 66.54 2npb s SER 10 CO 0.00 -0.20 1.95 0.61 0.98 0.00 0.00 173.24 176.58 2npb n GLY 11 N -1.24 -0.94 0.33 7.32 0.00 -1.26 -4.74 105.19 104.66 2npb n GLY 11 Ca -0.05 -0.16 0.05 0.00 0.00 0.00 0.00 46.02 45.86 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 3.73 0.62 -2.49 4.61 0.00 -2.00 -3.40 119.26 120.32 2npb h ALA 12 Ca 0.00 0.35 -0.09 0.00 0.00 0.00 0.00 54.91 55.17 2npb h ALA 12 Cb 0.00 0.68 -0.18 0.00 0.00 0.00 0.00 17.79 18.29 2npb h ALA 12 CO 0.00 -0.40 -0.16 0.00 0.00 0.00 0.00 179.25 178.69 2npb n GLY 14 N 0.76 0.00 0.22 0.00 0.00 -1.26 -4.87 105.19 100.04 2npb n GLY 14 Ca -0.19 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.45 0.04 1.61 -0.00 -1.88 -2.73 116.97 113.56 2npb h TYR 15 Ca 0.00 0.02 0.02 0.00 -0.00 0.00 0.00 58.73 58.77 2npb h TYR 15 Cb 0.39 0.21 -0.05 0.00 -0.00 0.00 0.00 36.73 37.27 2npb h TYR 15 CO 0.25 -0.25 -0.50 0.87 -0.00 0.00 0.00 178.16 178.53 2npb h LYS 16 N -0.26 -0.65 -0.15 0.10 1.57 -1.94 0.18 116.57 115.42 2npb h LYS 16 Ca 0.07 0.04 -0.09 0.00 -1.87 0.00 0.00 60.65 58.80 2npb h LYS 16 Cb 0.36 0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.80 2npb h LYS 16 CO -0.20 -0.43 -0.31 -1.00 -0.57 0.00 0.00 179.45 176.94 2npb h PRO 17 N -0.67 0.28 -0.32 3.15 0.13 -1.99 -1.55 132.00 131.03 2npb h PRO 17 Ca 0.02 -0.11 0.00 0.00 -0.87 0.00 0.00 66.00 65.04 2npb h PRO 17 Cb 0.72 -0.02 -0.02 0.00 0.13 0.00 0.00 31.00 31.82 2npb h PRO 17 CO -0.32 0.57 0.21 -0.22 -0.23 0.00 0.00 178.00 178.01 2npb h LYS 18 N 0.25 0.42 0.22 0.86 3.11 -1.07 -1.32 116.57 119.05 2npb h LYS 18 Ca 0.03 -0.03 0.01 0.00 -2.81 0.00 0.00 60.65 57.86 2npb h LYS 18 Cb 0.68 -0.10 -0.03 0.00 -1.00 0.00 0.00 32.23 31.78 2npb h LYS 18 CO 0.05 0.28 -0.34 1.88 -2.81 0.00 0.00 179.45 178.52 2npb h TYR 19 N 0.44 -0.92 -0.89 1.91 -1.99 -0.57 -3.11 116.97 111.84 2npb h TYR 19 Ca 0.12 0.01 0.12 0.00 2.00 0.00 0.00 58.73 60.98 2npb h TYR 19 Cb -0.05 0.37 -0.08 0.00 2.00 0.00 0.00 36.73 38.97 2npb h TYR 19 CO -0.05 -0.46 0.51 -0.07 -0.00 0.00 0.00 178.16 178.09 2npb h LEU 20 N -0.62 0.71 -0.93 3.88 3.38 -1.04 0.41 115.31 121.10 2npb h LEU 20 Ca 0.01 0.06 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 2npb h LEU 20 Cb 0.61 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.26 2npb h LEU 20 CO -0.14 0.36 0.23 -0.61 0.09 0.00 0.00 178.44 178.37 2npb h GLN 21 N 0.80 1.01 -0.04 1.13 -0.00 -1.18 0.39 115.11 117.22 2npb h GLN 21 Ca 0.45 -0.19 -0.02 0.00 -0.00 0.00 0.00 58.65 58.89 2npb h GLN 21 Cb 0.51 -0.16 0.00 0.00 0.00 0.00 0.00 27.48 27.83 2npb h GLN 21 CO -0.29 0.85 -0.07 1.25 0.00 0.00 0.00 178.83 180.57 2npb h LEU 22 N 0.98 0.13 0.70 -2.39 6.46 -1.44 -3.27 115.31 116.48 2npb h LEU 22 Ca 0.22 -0.56 -0.03 0.00 -0.12 0.00 0.00 57.88 57.39 2npb h LEU 22 Cb 0.25 -0.04 -0.01 0.00 -0.73 0.00 0.00 40.66 40.13 2npb h LEU 22 CO -0.01 0.67 -0.50 0.11 -0.62 0.00 0.00 178.44 178.08 2npb h LYS 23 N -0.40 -1.11 -0.90 1.25 1.79 -0.50 -2.71 116.57 113.99 2npb h LYS 23 Ca 0.00 0.08 0.21 0.00 -2.18 0.00 0.00 60.65 58.76 2npb h LYS 23 Cb 0.64 0.25 -0.17 0.00 -1.58 0.00 0.00 32.23 31.38 2npb h LYS 23 CO 0.02 -0.74 -0.10 1.49 -1.08 0.00 0.00 179.45 179.04 2npb h GLU 24 N -1.15 0.02 -0.01 3.15 4.22 -0.41 0.03 114.58 120.44 2npb h GLU 24 Ca -0.09 -0.00 -0.00 0.00 0.08 0.00 0.00 59.36 59.35 2npb h GLU 24 Cb 0.95 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.19 2npb h GLU 24 CO 0.04 0.02 0.01 -0.22 -2.18 0.00 0.00 179.01 176.68 2npb h LYS 25 N 0.02 0.01 0.38 1.92 1.63 -1.57 0.44 116.57 119.41 2npb h LYS 25 Ca 0.48 -0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 60.28 2npb h LYS 25 Cb 0.86 -0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 32.46 2npb h LYS 25 CO -0.88 0.07 -0.34 -0.07 -3.45 0.00 0.00 179.45 174.78 2npb h LEU 26 N -0.05 -0.92 -1.64 5.20 4.07 -0.98 -0.57 115.31 120.43 2npb h LEU 26 Ca 0.00 0.08 0.07 0.00 0.08 0.00 0.00 57.88 58.11 2npb h LEU 26 Cb 0.06 0.30 -0.03 0.00 1.08 0.00 0.00 40.66 42.07 2npb h LEU 26 CO -0.00 -0.49 0.36 -0.33 -1.08 0.00 0.00 178.44 176.89 2npb h GLU 27 N -0.74 0.42 -0.63 1.13 5.08 -1.02 -0.62 114.58 118.20 2npb h GLU 27 Ca -0.03 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.25 2npb h GLU 27 Cb 0.65 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.78 2npb h GLU 27 CO -0.04 0.28 0.19 1.25 -1.00 0.00 0.00 179.01 179.68 2npb h HIS 28 N 0.43 1.03 -0.25 4.33 2.76 -0.65 -2.16 115.15 120.64 2npb h HIS 28 Ca 0.23 -0.11 -0.12 0.00 -2.20 0.00 0.00 60.37 58.17 2npb h HIS 28 Cb 0.37 -0.30 -0.01 0.00 1.55 0.00 0.00 27.41 29.03 2npb h HIS 28 CO -0.00 0.85 -0.36 1.49 -1.30 0.00 0.00 177.93 178.61 2npb h GLU 29 N 0.92 0.56 -1.29 5.26 4.57 0.35 -3.38 114.58 121.55 2npb h GLU 29 Ca 0.20 -0.26 -0.40 0.00 -1.18 0.00 0.00 59.36 57.72 2npb h GLU 29 Cb 0.31 -0.01 -0.27 0.00 -0.16 0.00 0.00 28.75 28.62 2npb h GLU 29 CO -0.00 0.84 -0.80 1.97 -1.18 0.00 0.00 179.01 179.84 2npb n PHE 30 N -4.05 -1.95 -2.23 0.92 1.16 -0.49 -5.03 117.46 105.78 2npb n PHE 30 Ca -0.01 -2.60 -0.39 0.00 -1.87 0.00 0.00 57.45 52.57 2npb n PHE 30 Cb 0.49 0.65 -0.02 0.00 -1.61 0.00 0.00 39.48 38.99 2npb n PHE 30 CO 0.00 0.00 0.00 -1.25 -1.87 0.00 0.00 176.76 173.64 2npb s PRO 31 N -0.04 4.13 0.00 3.97 0.04 -0.81 -4.02 135.00 138.27 2npb s PRO 31 Ca 0.33 1.97 0.00 0.00 0.04 0.00 0.00 61.00 63.34 2npb s PRO 31 Cb 0.14 -2.80 0.00 0.00 0.04 0.00 0.00 34.50 31.87 2npb s PRO 31 CO -0.16 -0.29 0.00 0.41 0.04 0.00 0.00 177.00 177.00 2npb n GLY 32 N 0.72 0.84 0.20 0.56 0.00 -1.26 -4.54 105.19 101.71 2npb n GLY 32 Ca 0.03 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.20 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 -5.25 2.96 -0.14 0.00 2.01 -1.26 -1.37 118.68 115.62 2npb s LEU 34 Ca 0.02 -0.26 -0.08 0.00 0.01 0.00 0.00 54.13 53.83 2npb s LEU 34 Cb 0.09 -1.71 -0.04 0.00 0.01 0.00 0.00 46.19 44.54 2npb s LEU 34 CO 0.45 0.27 0.13 -0.62 1.01 0.00 0.00 176.35 177.59 2npb s ASP 35 N -1.46 6.32 -0.16 2.29 2.15 0.07 -4.87 116.67 121.02 2npb s ASP 35 Ca 0.16 0.41 -0.04 0.00 0.43 0.00 0.00 52.55 53.50 2npb s ASP 35 Cb -0.11 -2.06 0.06 0.00 -0.30 0.00 0.00 42.92 40.51 2npb s ASP 35 CO 0.07 0.35 0.11 -0.63 -0.17 0.00 0.00 175.17 174.90 2npb s ILE 36 N -0.69 -0.13 0.49 4.11 1.01 -1.26 -0.23 121.20 124.50 2npb s ILE 36 Ca 0.13 -0.07 0.04 0.00 0.00 0.00 0.00 60.65 60.75 2npb s ILE 36 Cb -0.12 -0.53 -0.02 0.00 0.01 0.00 0.00 42.46 41.81 2npb s ILE 36 CO 0.03 -0.20 0.10 0.00 0.00 0.00 0.00 174.94 174.86 2npb s GLY 38 N -3.92 2.55 0.30 0.00 0.00 -1.26 -1.90 107.32 103.09 2npb s GLY 38 Ca 0.20 -1.31 -0.10 0.00 0.00 0.00 0.00 44.72 43.51 2npb s GLY 38 CO 0.11 -1.84 0.52 1.85 0.00 0.00 0.00 173.10 173.74 2npb s GLU 39 N -3.74 1.75 -0.13 2.90 2.12 -0.13 -4.81 118.70 116.67 2npb s GLU 39 Ca 0.25 -1.44 0.05 0.00 0.36 0.00 0.00 54.97 54.19 2npb s GLU 39 Cb 0.03 0.48 0.15 0.00 0.26 0.00 0.00 34.13 35.06 2npb s GLU 39 CO 0.14 -0.74 0.89 0.41 -0.54 0.00 0.00 175.26 175.41 2npb n GLY 40 N -0.46 0.32 3.76 -1.50 0.00 -1.26 -2.81 105.19 103.23 2npb n GLY 40 Ca -0.02 -0.06 -0.37 0.00 0.00 0.00 0.00 46.02 45.57 2npb n GLY 40 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2npb s THR 41 N 0.05 2.53 -1.38 2.61 -4.23 -1.26 -4.89 115.64 109.07 2npb s THR 41 Ca 0.03 0.37 -0.12 0.00 -1.18 0.00 0.00 61.69 60.80 2npb s THR 41 Cb 0.17 -3.17 -0.05 0.00 1.34 0.00 0.00 72.50 70.78 2npb s THR 41 CO -0.05 -0.03 2.51 -0.81 -0.54 0.00 0.00 174.62 175.70 2npb n PRO 42 N -1.11 2.98 0.00 3.99 -0.04 -1.26 -4.22 135.00 135.34 2npb n PRO 42 Ca 0.11 -2.17 0.00 0.00 -0.04 0.00 0.00 63.50 61.40 2npb n PRO 42 Cb 0.47 -2.90 0.00 0.00 -0.04 0.00 0.00 33.50 31.03 2npb n PRO 42 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2npb n GLN 43 N 4.76 0.00 -0.02 0.54 1.13 -1.26 -5.02 117.38 117.51 2npb n GLN 43 Ca 0.63 0.00 0.01 0.00 -1.94 0.00 0.00 57.00 55.69 2npb n GLN 43 Cb 0.28 0.00 0.01 0.00 0.11 0.00 0.00 30.24 30.64 2npb n GLN 43 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 2npb n VAL 44 N -0.61 0.78 0.00 5.09 0.31 -1.26 -4.95 118.33 117.69 2npb n VAL 44 Ca 0.00 -0.89 0.00 0.00 -0.01 0.00 0.00 64.34 63.44 2npb n VAL 44 Cb 0.00 0.62 0.00 0.00 -0.91 0.00 0.00 33.84 33.55 2npb n VAL 44 CO 0.00 0.00 0.00 1.07 -1.32 0.00 0.00 176.83 176.58 2npb n THR 45 N -0.29 0.00 0.31 2.52 5.66 -1.26 -3.23 114.28 117.99 2npb n THR 45 Ca 0.01 0.00 0.20 0.00 -3.05 0.00 0.00 64.05 61.21 2npb n THR 45 Cb 0.22 -0.97 0.93 0.00 -1.55 0.00 0.00 70.33 68.96 2npb n THR 45 CO 0.00 0.00 0.00 1.23 -3.05 0.00 0.00 175.07 173.25 2npb h GLY 46 N 0.00 0.00 -7.28 1.09 0.00 -1.93 -2.39 103.07 92.56 2npb h GLY 46 Ca 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.80 2npb h GLY 46 CO 0.00 0.00 1.49 -1.36 0.00 0.00 0.00 176.54 176.67 2npb s PHE 47 N -3.89 1.31 -0.73 5.60 0.08 -1.20 -4.73 117.98 114.43 2npb s PHE 47 Ca -0.02 0.98 -0.26 0.00 0.12 0.00 0.00 56.93 57.76 2npb s PHE 47 Cb 0.11 -3.85 -0.05 0.00 -0.57 0.00 0.00 43.02 38.65 2npb s PHE 47 CO 0.48 -3.03 2.02 0.12 -0.10 0.00 0.00 175.22 174.71 2npb s PHE 48 N 9.67 1.59 -0.15 0.36 2.19 -1.25 -3.90 117.98 126.49 2npb s PHE 48 Ca 0.91 0.96 0.01 0.00 0.33 0.00 0.00 56.93 59.13 2npb s PHE 48 Cb -0.22 -3.94 0.02 0.00 -1.31 0.00 0.00 43.02 37.57 2npb s PHE 48 CO 0.29 -2.04 -0.16 -1.21 1.83 0.00 0.00 175.22 173.94 2npb s GLU 49 N 7.38 2.45 -0.21 10.12 0.41 -0.37 -1.78 118.70 136.70 2npb s GLU 49 Ca 0.75 -0.62 -0.05 0.00 -0.41 0.00 0.00 54.97 54.64 2npb s GLU 49 Cb -0.11 -2.18 -0.02 0.00 -1.78 0.00 0.00 34.13 30.04 2npb s GLU 49 CO 0.12 -0.20 -0.00 0.08 -0.49 0.00 0.00 175.26 174.77 2npb s VAL 50 N 1.36 3.88 -0.02 2.63 1.01 -0.22 -1.76 120.40 127.28 2npb s VAL 50 Ca 0.03 -0.33 0.05 0.00 0.00 0.00 0.00 61.98 61.72 2npb s VAL 50 Cb -0.13 -2.76 -0.01 0.00 0.00 0.00 0.00 36.38 33.47 2npb s VAL 50 CO -0.10 0.42 -0.15 -0.89 0.00 0.00 0.00 175.10 174.38 2npb s THR 51 N 1.15 1.22 -0.07 3.92 2.01 -0.64 -0.90 115.64 122.34 2npb s THR 51 Ca 0.03 -0.65 0.03 0.00 0.31 0.00 0.00 61.69 61.41 2npb s THR 51 Cb -0.14 -1.03 0.01 0.00 0.01 0.00 0.00 72.50 71.35 2npb s THR 51 CO 0.01 0.35 -0.16 0.54 -0.69 0.00 0.00 174.62 174.67 2npb s VAL 52 N -0.27 1.40 -0.47 3.82 0.11 -0.06 -0.85 120.40 124.08 2npb s VAL 52 Ca 0.04 -0.65 -0.02 0.00 -2.93 0.00 0.00 61.98 58.43 2npb s VAL 52 Cb -0.07 -1.24 0.02 0.00 -1.53 0.00 0.00 36.38 33.56 2npb s VAL 52 CO -0.00 0.41 0.06 0.00 -3.33 0.00 0.00 175.10 172.24 2npb n ALA 53 N 3.60 -0.95 -0.45 1.54 0.00 0.06 -0.54 120.51 123.78 2npb n ALA 53 Ca -0.21 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.25 2npb n ALA 53 Cb 0.52 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.95 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 -0.65 0.75 3.00 0.00 0.00 -1.26 -5.09 105.19 101.94 2npb n GLY 54 Ca -0.04 -0.23 -0.27 0.00 0.00 0.00 0.00 46.02 45.48 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 -0.71 1.93 0.24 1.61 1.02 0.30 -5.11 119.74 119.02 2npb s LYS 55 Ca 0.00 -0.44 -0.31 0.00 0.02 0.00 0.00 55.97 55.23 2npb s LYS 55 Cb 0.00 -1.73 -0.13 0.00 -0.52 0.00 0.00 37.83 35.45 2npb s LYS 55 CO 0.00 -0.13 1.54 -0.11 -0.92 0.00 0.00 175.35 175.74 2npb n LEU 56 N 4.41 3.68 0.00 3.17 0.00 -1.26 -0.88 117.00 126.11 2npb n LEU 56 Ca -0.18 1.12 0.00 0.00 0.00 0.00 0.00 56.01 56.96 2npb n LEU 56 Cb 0.51 -1.51 0.00 0.00 0.00 0.00 0.00 43.42 42.42 2npb n LEU 56 CO 0.22 -0.14 -0.36 0.52 0.00 0.00 0.00 177.39 177.64 2npb n VAL 57 N 2.50 0.00 -3.78 1.96 0.31 -0.08 -4.93 118.33 114.31 2npb n VAL 57 Ca 0.12 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.32 2npb n VAL 57 Cb 0.33 0.35 -0.11 0.00 -0.91 0.00 0.00 33.84 33.51 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 -1.43 -0.29 -0.30 3.52 5.65 -1.16 -4.90 115.29 116.39 2npb s HIS 58 Ca 0.00 0.68 -0.02 0.00 0.25 0.00 0.00 55.06 55.97 2npb s HIS 58 Cb 0.00 0.10 0.19 0.00 -1.18 0.00 0.00 32.58 31.69 2npb s HIS 58 CO 0.00 -0.19 0.73 0.45 -0.65 0.00 0.00 174.74 175.08 2npb s SER 59 N -0.10 -1.19 0.51 9.88 0.15 -1.25 -1.05 113.70 120.64 2npb s SER 59 Ca -0.02 0.46 0.30 0.00 0.70 0.00 0.00 55.95 57.38 2npb s SER 59 Cb -0.03 1.88 1.17 0.00 -1.71 0.00 0.00 66.02 67.34 2npb s SER 59 CO 0.01 -0.22 1.91 0.11 1.20 0.00 0.00 173.24 176.25 2npb h LYS 60 N 7.91 0.00 -0.00 5.44 1.79 -1.46 0.20 116.57 130.45 2npb h LYS 60 Ca -0.13 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.34 2npb h LYS 60 Cb 1.17 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.82 2npb h LYS 60 CO 0.12 0.06 -0.12 0.36 -1.08 0.00 0.00 179.45 178.79 2npb n LYS 61 N -3.17 0.06 -0.03 3.15 -0.00 -1.26 -3.50 118.16 113.41 2npb n LYS 61 Ca 0.01 -0.01 0.04 0.00 -0.00 0.00 0.00 58.31 58.34 2npb n LYS 61 Cb 0.36 -1.50 -0.13 0.00 -0.00 0.00 0.00 35.03 33.76 2npb n LYS 61 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.40 180.29 2npb n ARG 62 N -1.46 0.77 -1.23 -1.58 -4.01 -1.25 -5.03 116.66 102.87 2npb n ARG 62 Ca 0.07 -0.11 0.00 0.00 -1.04 0.00 0.00 57.85 56.77 2npb n ARG 62 Cb 0.33 -1.40 0.00 0.00 -3.04 0.00 0.00 32.46 28.35 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 1.68 0.68 0.13 2.89 0.00 -1.16 -5.03 105.19 104.38 2npb n GLY 63 Ca -0.09 -0.32 -0.21 0.00 0.00 0.00 0.00 46.02 45.40 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 0.58 -5.00 1.61 3.58 -0.90 -3.50 116.42 112.79 2npb h ASP 64 Ca 0.00 -0.77 0.00 0.00 0.42 0.00 0.00 57.03 56.68 2npb h ASP 64 Cb 0.56 -0.19 0.00 0.00 1.72 0.00 0.00 39.33 41.42 2npb h ASP 64 CO 0.00 1.64 0.00 0.61 -2.88 0.00 0.00 179.24 178.61 2npb n GLY 65 N 1.75 0.80 0.00 -0.78 0.00 -1.15 -4.90 105.19 100.90 2npb n GLY 65 Ca -0.19 -2.21 0.00 0.00 0.00 0.00 0.00 46.02 43.61 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 -0.41 0.00 -2.56 1.61 4.01 -1.26 -3.89 117.16 114.65 2npb n TYR 66 Ca 0.00 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.32 2npb n TYR 66 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.02 2npb n TYR 66 CO 0.00 0.00 0.00 0.14 -0.46 0.00 0.00 176.86 176.54 2npb s VAL 67 N 0.54 4.04 -0.04 -0.72 -7.23 -1.26 -4.75 120.40 110.98 2npb s VAL 67 Ca 0.00 -1.55 0.22 0.00 -1.81 0.00 0.00 61.98 58.83 2npb s VAL 67 Cb 0.00 -5.14 0.21 0.00 0.56 0.00 0.00 36.38 32.02 2npb s VAL 67 CO 0.00 -1.97 1.69 0.44 -0.31 0.00 0.00 175.10 174.95 2npb h ASP 68 N 8.28 0.00 -5.34 4.85 3.32 -1.92 -3.47 116.42 122.15 2npb h ASP 68 Ca 0.37 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 57.29 2npb h ASP 68 Cb 0.91 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 40.34 2npb h ASP 68 CO 1.44 0.25 -0.37 0.42 -1.72 0.00 0.00 179.24 179.26 2npb s THR 69 N -3.38 0.04 0.16 0.35 -4.23 -1.26 -5.03 115.64 102.29 2npb s THR 69 Ca 0.03 -1.57 -0.16 0.00 -1.18 0.00 0.00 61.69 58.81 2npb s THR 69 Cb 0.09 -2.07 0.05 0.00 1.34 0.00 0.00 72.50 71.91 2npb s THR 69 CO 0.67 -0.20 1.72 -0.33 -0.54 0.00 0.00 174.62 175.94 2npb h GLU 70 N 2.53 0.18 0.00 3.99 4.39 -1.99 -1.15 114.58 122.53 2npb h GLU 70 Ca -0.32 -0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.37 2npb h GLU 70 Cb 1.23 -0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 29.84 2npb h GLU 70 CO 0.48 0.12 -0.03 1.03 -1.16 0.00 0.00 179.01 179.44 2npb h SER 71 N 0.18 0.00 -0.18 1.42 0.87 -1.98 0.13 113.55 114.00 2npb h SER 71 Ca 0.19 0.00 -0.14 0.00 -1.23 0.00 0.00 61.79 60.61 2npb h SER 71 Cb 0.23 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.19 2npb h SER 71 CO -0.26 0.03 -0.44 0.11 -0.53 0.00 0.00 176.83 175.75 2npb h LYS 72 N 0.00 0.62 0.56 2.24 1.79 -1.82 -2.53 116.57 117.43 2npb h LYS 72 Ca -0.00 -0.42 -0.02 0.00 -2.18 0.00 0.00 60.65 58.03 2npb h LYS 72 Cb 0.06 0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 30.76 2npb h LYS 72 CO 0.00 1.04 -0.40 0.35 -1.08 0.00 0.00 179.45 179.36 2npb h PHE 73 N 0.29 -1.08 0.00 -1.35 3.57 -0.34 -3.25 116.94 114.77 2npb h PHE 73 Ca -0.00 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.48 2npb h PHE 73 Cb 1.05 0.40 -0.00 0.00 2.79 0.00 0.00 35.95 40.18 2npb h PHE 73 CO 0.09 -0.59 -0.04 0.00 -2.23 0.00 0.00 178.31 175.54 2npb h ARG 74 N -0.93 0.00 0.00 1.11 -0.00 -0.82 -0.41 114.38 113.33 2npb h ARG 74 Ca -0.06 0.00 -0.04 0.00 -0.50 0.00 0.00 59.98 59.38 2npb h ARG 74 Cb 0.78 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 30.74 2npb h ARG 74 CO 0.03 0.04 -0.18 -0.22 0.00 0.00 0.00 179.97 179.64 2npb h LYS 75 N 0.00 0.00 0.04 0.04 3.11 -1.49 0.27 116.57 118.54 2npb h LYS 75 Ca -0.00 0.00 -0.29 0.00 -2.81 0.00 0.00 60.65 57.55 2npb h LYS 75 Cb 0.16 0.00 -0.03 0.00 -1.00 0.00 0.00 32.23 31.35 2npb h LYS 75 CO 0.01 0.18 -1.60 -0.11 -2.81 0.00 0.00 179.45 175.12 2npb n LEU 76 N -4.19 2.11 -0.34 5.20 0.00 -0.29 -3.76 117.00 115.74 2npb n LEU 76 Ca -0.02 0.34 0.02 0.00 0.00 0.00 0.00 56.01 56.35 2npb n LEU 76 Cb 0.25 -1.00 0.19 0.00 0.00 0.00 0.00 43.42 42.86 2npb n LEU 76 CO 0.35 0.48 1.27 0.58 0.00 0.00 0.00 177.39 180.07 2npb h VAL 77 N -0.68 1.13 -0.58 1.96 2.07 -1.16 -0.34 116.25 118.66 2npb h VAL 77 Ca -0.40 -0.40 -0.11 0.00 0.82 0.00 0.00 66.70 66.61 2npb h VAL 77 Cb 1.55 -0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 31.17 2npb h VAL 77 CO -0.14 0.21 -0.06 0.74 0.02 0.00 0.00 177.57 178.34 2npb h THR 78 N 1.16 1.27 0.00 2.57 2.02 -1.15 -2.24 112.91 116.54 2npb h THR 78 Ca 0.39 -1.22 -0.15 0.00 0.77 0.00 0.00 66.41 66.19 2npb h THR 78 Cb 0.07 0.89 -0.02 0.00 -1.74 0.00 0.00 68.15 67.35 2npb h THR 78 CO -0.13 0.44 -0.72 0.00 0.37 0.00 0.00 175.52 175.47 2npb h ALA 79 N 0.95 0.75 -0.08 6.16 0.00 -1.22 -0.80 119.26 125.03 2npb h ALA 79 Ca 0.16 -0.66 -0.24 0.00 0.00 0.00 0.00 54.91 54.17 2npb h ALA 79 Cb 0.63 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.32 2npb h ALA 79 CO 0.04 0.91 -0.89 0.82 0.00 0.00 0.00 179.25 180.13 2npb h ILE 80 N 0.00 1.29 -0.38 0.00 1.08 -1.17 -1.27 117.51 117.06 2npb h ILE 80 Ca -0.01 -2.12 -0.07 0.00 -0.39 0.00 0.00 64.86 62.28 2npb h ILE 80 Cb 1.33 2.17 -0.01 0.00 -3.07 0.00 0.00 36.82 37.23 2npb h ILE 80 CO 0.09 0.66 -0.03 0.50 -0.69 0.00 0.00 178.15 178.68 2npb h LYS 81 N 0.45 0.69 -0.44 2.37 3.64 -1.20 -1.13 116.57 120.95 2npb h LYS 81 Ca -0.08 -0.24 -0.08 0.00 -1.27 0.00 0.00 60.65 58.98 2npb h LYS 81 Cb 1.53 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 33.28 2npb h LYS 81 CO 0.18 0.81 -0.03 0.00 -2.27 0.00 0.00 179.45 178.13 2npb h ALA 82 N 0.86 0.60 -0.85 5.00 0.00 -1.20 -0.49 119.26 123.18 2npb h ALA 82 Ca 0.10 -0.29 0.02 0.00 0.00 0.00 0.00 54.91 54.74 2npb h ALA 82 Cb 0.52 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.10 2npb h ALA 82 CO 0.03 0.42 0.56 0.00 0.00 0.00 0.00 179.25 180.26 2npb h ALA 83 N 0.89 1.10 0.49 0.00 0.00 -1.16 -2.80 119.26 117.79 2npb h ALA 83 Ca 0.12 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 2npb h ALA 83 Cb 0.54 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2npb h ALA 83 CO 0.03 0.45 -0.24 1.25 0.00 0.00 0.00 179.25 180.75 2npb h LEU 84 N 1.13 -0.56 -0.55 0.00 7.12 -0.83 -0.90 115.31 120.71 2npb h LEU 84 Ca 0.32 -0.07 0.00 0.00 0.13 0.00 0.00 57.88 58.26 2npb h LEU 84 Cb -0.08 0.14 0.00 0.00 -0.53 0.00 0.00 40.66 40.19 2npb h LEU 84 CO -0.09 -0.18 0.00 0.00 -0.13 0.00 0.00 178.44 178.05 2npb n ALA 85 N -2.60 1.47 -0.06 1.25 0.00 -0.22 -0.69 120.51 119.65 2npb n ALA 85 Ca -0.10 0.06 -0.20 0.00 0.00 0.00 0.00 53.44 53.20 2npb n ALA 85 Cb 0.31 -1.29 -0.13 0.00 0.00 0.00 0.00 19.45 18.34 2npb n ALA 85 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2npb n GLN 86 N -1.95 0.70 -0.08 0.00 0.00 -1.06 -4.09 117.38 110.91 2npb n GLN 86 Ca 0.02 0.21 0.03 0.00 -0.00 0.00 0.00 57.00 57.26 2npb n GLN 86 Cb 0.15 -1.61 0.37 0.00 0.00 0.00 0.00 30.24 29.15 2npb n GLN 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06