#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 4.56 0.40 3.17 0.00 -1.26 -4.69 121.76 123.94 2npb s ALA 2 Ca 0.00 -1.80 0.08 0.00 0.00 0.00 0.00 51.96 50.23 2npb s ALA 2 Cb 0.00 -1.55 -0.03 0.00 0.00 0.00 0.00 23.12 21.55 2npb s ALA 2 CO 0.00 -0.43 0.34 -1.17 0.00 0.00 0.00 175.76 174.49 2npb s LEU 3 N -4.42 3.40 -0.10 0.00 1.98 -0.46 -4.95 118.68 114.13 2npb s LEU 3 Ca 0.56 -0.73 -0.01 0.00 -2.89 0.00 0.00 54.13 51.07 2npb s LEU 3 Cb -0.08 -2.03 0.03 0.00 0.66 0.00 0.00 46.19 44.77 2npb s LEU 3 CO 0.34 -0.58 -0.05 0.00 -1.89 0.00 0.00 176.35 174.17 2npb s ALA 4 N -2.45 1.14 0.14 5.97 0.00 -1.26 -1.87 121.76 123.43 2npb s ALA 4 Ca 0.46 -0.43 0.07 0.00 0.00 0.00 0.00 51.96 52.07 2npb s ALA 4 Cb -0.03 -0.87 -0.04 0.00 0.00 0.00 0.00 23.12 22.18 2npb s ALA 4 CO 0.27 -0.44 -0.07 0.08 0.00 0.00 0.00 175.76 175.60 2npb s VAL 5 N 1.79 3.43 0.07 0.00 1.01 0.22 -1.05 120.40 125.87 2npb s VAL 5 Ca 0.05 -1.38 0.03 0.00 0.00 0.00 0.00 61.98 60.68 2npb s VAL 5 Cb -0.12 -2.65 -0.03 0.00 0.00 0.00 0.00 36.38 33.57 2npb s VAL 5 CO -0.07 0.02 -0.09 -0.13 0.00 0.00 0.00 175.10 174.82 2npb s ARG 6 N -2.51 0.68 -0.35 2.72 1.81 0.70 -1.06 118.95 120.95 2npb s ARG 6 Ca 0.24 -0.96 -0.00 0.00 -1.72 0.00 0.00 55.73 53.29 2npb s ARG 6 Cb -0.10 -0.41 0.14 0.00 -0.45 0.00 0.00 34.95 34.13 2npb s ARG 6 CO 0.15 0.07 0.21 0.08 -0.68 0.00 0.00 175.30 175.13 2npb s VAL 7 N -1.93 0.19 -0.37 3.52 1.01 -0.65 -1.34 120.40 120.83 2npb s VAL 7 Ca -0.02 -1.71 -0.29 0.00 0.00 0.00 0.00 61.98 59.96 2npb s VAL 7 Cb -0.06 -1.15 0.02 0.00 0.00 0.00 0.00 36.38 35.18 2npb s VAL 7 CO -0.00 -0.97 1.21 -0.69 0.00 0.00 0.00 175.10 174.64 2npb s VAL 8 N 1.08 4.23 0.22 2.92 1.01 -0.67 -3.25 120.40 125.93 2npb s VAL 8 Ca 0.18 1.34 0.03 0.00 0.00 0.00 0.00 61.98 63.53 2npb s VAL 8 Cb -0.23 -4.37 -0.01 0.00 0.00 0.00 0.00 36.38 31.78 2npb s VAL 8 CO -0.01 -0.67 0.22 0.00 0.00 0.00 0.00 175.10 174.65 2npb n TYR 9 N 7.65 -0.70 -4.15 5.22 9.36 -1.26 -0.86 117.16 132.43 2npb n TYR 9 Ca 0.13 -1.71 -0.23 0.00 3.32 0.00 0.00 57.90 59.41 2npb n TYR 9 Cb 0.48 0.24 -0.06 0.00 -0.63 0.00 0.00 39.34 39.37 2npb n TYR 9 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 2npb s SER 10 N -2.47 4.82 0.00 2.98 0.15 -1.26 -3.78 113.70 114.14 2npb s SER 10 Ca 0.23 -0.62 0.00 0.00 0.70 0.00 0.00 55.95 56.26 2npb s SER 10 Cb 0.01 -0.89 0.00 0.00 -1.71 0.00 0.00 66.02 63.42 2npb s SER 10 CO 0.17 -0.16 0.78 0.61 1.20 0.00 0.00 173.24 175.84 2npb n GLY 11 N -1.09 1.69 0.37 9.45 0.00 -1.26 -4.70 105.19 109.65 2npb n GLY 11 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.97 2npb n GLY 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2npb n ALA 12 N 0.41 1.65 -1.08 4.61 0.00 -1.26 -4.95 120.51 119.88 2npb n ALA 12 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.57 2npb n ALA 12 Cb 0.39 -1.00 -0.03 0.00 0.00 0.00 0.00 19.45 18.81 2npb n ALA 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2npb n GLY 14 N -2.95 0.67 0.33 0.00 0.00 -1.26 -4.76 105.19 97.22 2npb n GLY 14 Ca 0.01 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 1.04 -0.49 1.61 -0.00 -1.91 -3.36 116.97 113.87 2npb h TYR 15 Ca 0.00 0.03 0.09 0.00 -0.00 0.00 0.00 58.73 58.85 2npb h TYR 15 Cb 0.00 -0.34 -0.10 0.00 -0.00 0.00 0.00 36.73 36.29 2npb h TYR 15 CO 0.00 0.57 -0.35 0.87 -0.00 0.00 0.00 178.16 179.25 2npb h LYS 16 N 1.05 -0.22 -0.46 0.10 1.57 -1.97 0.31 116.57 116.95 2npb h LYS 16 Ca 0.37 0.01 -0.11 0.00 -1.87 0.00 0.00 60.65 59.05 2npb h LYS 16 Cb 0.08 0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.43 2npb h LYS 16 CO -0.14 -0.14 -0.17 -1.00 -0.57 0.00 0.00 179.45 177.43 2npb h PRO 17 N -0.22 0.90 -0.57 3.15 0.13 -2.00 -1.66 132.00 131.72 2npb h PRO 17 Ca 0.19 -0.34 -0.04 0.00 -0.87 0.00 0.00 66.00 64.93 2npb h PRO 17 Cb 0.55 -0.05 -0.03 0.00 0.13 0.00 0.00 31.00 31.60 2npb h PRO 17 CO -0.61 0.99 0.17 -0.22 -0.23 0.00 0.00 178.00 178.10 2npb h LYS 18 N 0.79 0.86 0.87 0.86 3.11 -1.32 0.12 116.57 121.85 2npb h LYS 18 Ca 0.12 -0.16 -0.04 0.00 -2.81 0.00 0.00 60.65 57.76 2npb h LYS 18 Cb 0.70 -0.14 0.01 0.00 -1.00 0.00 0.00 32.23 31.80 2npb h LYS 18 CO 0.05 0.74 -0.44 -0.92 -2.81 0.00 0.00 179.45 176.07 2npb h TYR 19 N 0.83 -1.16 -0.70 1.91 5.03 -0.38 -2.16 116.97 120.34 2npb h TYR 19 Ca 0.19 -0.02 0.09 0.00 2.58 0.00 0.00 58.73 61.57 2npb h TYR 19 Cb 0.25 0.39 -0.07 0.00 1.55 0.00 0.00 36.73 38.85 2npb h TYR 19 CO 0.02 -0.70 0.34 -0.07 -1.32 0.00 0.00 178.16 176.43 2npb h LEU 20 N -1.20 0.43 -1.47 2.82 4.07 -1.17 0.12 115.31 118.91 2npb h LEU 20 Ca -0.12 0.06 -0.06 0.00 0.08 0.00 0.00 57.88 57.85 2npb h LEU 20 Cb 0.93 -0.01 -0.01 0.00 1.08 0.00 0.00 40.66 42.65 2npb h LEU 20 CO 0.18 0.25 -0.27 -0.61 -1.08 0.00 0.00 178.44 176.90 2npb h GLN 21 N 0.58 0.00 0.10 1.13 -0.00 -0.60 0.51 115.11 116.82 2npb h GLN 21 Ca 0.35 0.00 -0.00 0.00 -0.00 0.00 0.00 58.65 58.99 2npb h GLN 21 Cb 0.38 0.00 0.00 0.00 0.00 0.00 0.00 27.48 27.86 2npb h GLN 21 CO -0.28 0.27 -0.05 1.25 0.00 0.00 0.00 178.83 180.03 2npb h LEU 22 N 0.00 -0.11 0.28 -2.39 5.85 -1.08 -3.36 115.31 114.51 2npb h LEU 22 Ca -0.00 -0.44 -0.01 0.00 0.84 0.00 0.00 57.88 58.27 2npb h LEU 22 Cb 0.51 0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.57 2npb h LEU 22 CO 0.04 0.42 -0.14 0.50 -0.34 0.00 0.00 178.44 178.92 2npb h LYS 23 N -0.70 -0.37 -0.94 1.25 3.11 0.54 -3.03 116.57 116.44 2npb h LYS 23 Ca -0.01 0.02 0.23 0.00 -2.81 0.00 0.00 60.65 58.08 2npb h LYS 23 Cb 0.54 0.08 -0.17 0.00 -1.00 0.00 0.00 32.23 31.68 2npb h LYS 23 CO 0.02 -0.02 -0.03 1.49 -2.81 0.00 0.00 179.45 178.10 2npb h GLU 24 N -0.83 0.03 -0.54 1.90 4.22 -0.28 -1.55 114.58 117.52 2npb h GLU 24 Ca -0.04 -0.00 -0.03 0.00 0.08 0.00 0.00 59.36 59.37 2npb h GLU 24 Cb 0.51 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.73 2npb h GLU 24 CO 0.06 0.02 0.24 -0.22 -2.18 0.00 0.00 179.01 176.93 2npb h LYS 25 N 0.03 0.80 -0.16 1.92 1.63 -1.67 0.14 116.57 119.26 2npb h LYS 25 Ca 0.53 -0.13 -0.09 0.00 -0.85 0.00 0.00 60.65 60.10 2npb h LYS 25 Cb 1.01 -0.14 -0.00 0.00 -0.60 0.00 0.00 32.23 32.51 2npb h LYS 25 CO -0.88 0.68 -0.27 1.25 -3.45 0.00 0.00 179.45 176.78 2npb h LEU 26 N 0.73 0.51 -0.99 5.20 5.85 -1.30 -0.50 115.31 124.81 2npb h LEU 26 Ca 0.18 -0.54 -0.01 0.00 0.84 0.00 0.00 57.88 58.35 2npb h LEU 26 Cb 0.16 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 41.01 2npb h LEU 26 CO -0.02 0.95 0.50 -0.33 -0.34 0.00 0.00 178.44 179.19 2npb h GLU 27 N 0.08 1.20 -0.60 1.25 5.08 -1.27 -1.06 114.58 119.26 2npb h GLU 27 Ca 0.01 -0.13 -0.04 0.00 -1.00 0.00 0.00 59.36 58.20 2npb h GLU 27 Cb 0.85 -0.24 -0.03 0.00 0.50 0.00 0.00 28.75 29.83 2npb h GLU 27 CO 0.06 0.86 0.20 1.25 -1.00 0.00 0.00 179.01 180.39 2npb h HIS 28 N 1.21 0.96 -0.18 4.33 2.76 -0.67 -2.18 115.15 121.38 2npb h HIS 28 Ca 0.31 -0.09 -0.09 0.00 -2.20 0.00 0.00 60.37 58.30 2npb h HIS 28 Cb -0.00 -0.28 -0.01 0.00 1.55 0.00 0.00 27.41 28.66 2npb h HIS 28 CO 0.01 0.79 -0.29 0.93 -1.30 0.00 0.00 177.93 178.07 2npb h GLU 29 N 0.86 0.34 -2.05 5.26 5.08 -0.85 -3.38 114.58 119.84 2npb h GLU 29 Ca 0.20 -0.13 -0.54 0.00 -1.00 0.00 0.00 59.36 57.89 2npb h GLU 29 Cb 0.27 -0.02 -0.40 0.00 0.50 0.00 0.00 28.75 29.10 2npb h GLU 29 CO -0.01 0.61 -1.03 1.19 -1.00 0.00 0.00 179.01 178.77 2npb n PHE 30 N -4.11 0.74 -2.01 4.33 3.72 -0.42 -5.08 117.46 114.63 2npb n PHE 30 Ca -0.01 -3.77 -0.41 0.00 -0.05 0.00 0.00 57.45 53.21 2npb n PHE 30 Cb 0.41 -0.41 -0.02 0.00 -0.94 0.00 0.00 39.48 38.51 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 -1.99 4.26 0.00 -1.08 0.04 -0.83 -3.53 135.00 131.87 2npb s PRO 31 Ca 0.39 2.30 0.00 0.00 0.04 0.00 0.00 61.00 63.73 2npb s PRO 31 Cb 0.24 -3.12 0.00 0.00 0.04 0.00 0.00 34.50 31.66 2npb s PRO 31 CO -0.09 -0.44 0.00 0.41 0.04 0.00 0.00 177.00 176.92 2npb n GLY 32 N 2.34 0.67 0.00 0.56 0.00 -1.26 -4.56 105.19 102.94 2npb n GLY 32 Ca 0.07 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.19 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 -2.83 1.28 0.10 0.00 1.43 -1.23 -1.35 118.68 116.08 2npb s LEU 34 Ca 0.13 -0.50 0.08 0.00 -1.03 0.00 0.00 54.13 52.81 2npb s LEU 34 Cb 0.12 1.10 -0.04 0.00 0.03 0.00 0.00 46.19 47.41 2npb s LEU 34 CO 0.32 -0.68 -0.22 -0.62 0.23 0.00 0.00 176.35 175.39 2npb s ASP 35 N -2.55 2.62 -0.04 2.29 2.15 -0.78 -4.89 116.67 115.46 2npb s ASP 35 Ca 0.01 -0.69 -0.00 0.00 0.43 0.00 0.00 52.55 52.30 2npb s ASP 35 Cb 0.02 -0.15 0.03 0.00 -0.30 0.00 0.00 42.92 42.52 2npb s ASP 35 CO -0.08 0.07 0.01 -0.63 -0.17 0.00 0.00 175.17 174.37 2npb s ILE 36 N -1.14 0.13 0.44 4.11 1.09 -1.26 -0.61 121.20 123.96 2npb s ILE 36 Ca 0.07 0.16 0.06 0.00 -1.10 0.00 0.00 60.65 59.84 2npb s ILE 36 Cb -0.10 -0.27 -0.06 0.00 -1.06 0.00 0.00 42.46 40.97 2npb s ILE 36 CO 0.04 0.16 0.04 0.00 -0.10 0.00 0.00 174.94 175.09 2npb s GLY 38 N -3.79 -0.21 -0.34 0.00 0.00 -1.26 -1.64 107.32 100.07 2npb s GLY 38 Ca 0.29 0.83 -0.00 0.00 0.00 0.00 0.00 44.72 45.83 2npb s GLY 38 CO 0.15 0.73 0.22 -0.54 0.00 0.00 0.00 173.10 173.66 2npb s GLU 39 N 0.21 0.50 -0.22 2.90 2.02 -1.20 -4.97 118.70 117.93 2npb s GLU 39 Ca -0.00 -1.12 -0.04 0.00 0.02 0.00 0.00 54.97 53.83 2npb s GLU 39 Cb -0.02 -1.19 -0.05 0.00 0.10 0.00 0.00 34.13 32.98 2npb s GLU 39 CO -0.00 -1.18 2.90 0.41 0.02 0.00 0.00 175.26 177.42 2npb n GLY 40 N 4.28 3.62 2.86 -1.39 0.00 -1.26 -4.36 105.19 108.94 2npb n GLY 40 Ca 0.09 -1.33 -0.28 0.00 0.00 0.00 0.00 46.02 44.50 2npb n GLY 40 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2npb n THR 41 N 1.46 3.16 -2.55 2.61 -1.04 -1.25 -4.52 114.28 112.16 2npb n THR 41 Ca 0.39 -5.50 -0.41 0.00 -2.04 0.00 0.00 64.05 56.49 2npb n THR 41 Cb 0.69 -1.39 -0.03 0.00 -1.82 0.00 0.00 70.33 67.78 2npb n THR 41 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2npb s PRO 42 N -3.54 3.45 0.00 -2.82 0.04 -1.26 -4.90 135.00 125.97 2npb s PRO 42 Ca 0.48 -0.83 0.00 0.00 0.04 0.00 0.00 61.00 60.69 2npb s PRO 42 Cb 0.29 -4.99 0.00 0.00 0.04 0.00 0.00 34.50 29.85 2npb s PRO 42 CO -0.15 -2.21 0.25 0.94 0.04 0.00 0.00 177.00 175.87 2npb n GLN 43 N 9.04 0.21 0.01 4.56 7.27 -1.26 -3.09 117.38 134.12 2npb n GLN 43 Ca 0.24 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.31 2npb n GLN 43 Cb 0.50 -1.40 0.00 0.00 2.41 0.00 0.00 30.24 31.76 2npb n GLN 43 CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 177.06 177.41 2npb n VAL 44 N 1.12 0.03 0.08 1.69 0.31 -1.26 -5.11 118.33 115.19 2npb n VAL 44 Ca 0.00 0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.34 2npb n VAL 44 Cb 0.10 -0.31 0.00 0.00 -0.91 0.00 0.00 33.84 32.72 2npb n VAL 44 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2npb n THR 45 N -2.59 0.00 0.00 2.52 -2.24 -1.18 -5.10 114.28 105.69 2npb n THR 45 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2npb n THR 45 Cb 0.00 -0.11 0.00 0.00 -2.10 0.00 0.00 70.33 68.12 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 0.09 -1.79 3.74 3.38 0.00 -1.26 -4.74 105.19 104.61 2npb n GLY 46 Ca 0.00 0.84 -0.37 0.00 0.00 0.00 0.00 46.02 46.49 2npb n GLY 46 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2npb s PHE 47 N 0.00 2.22 -0.36 1.61 -0.12 -1.26 -4.79 117.98 115.28 2npb s PHE 47 Ca 0.00 1.47 0.03 0.00 -0.05 0.00 0.00 56.93 58.39 2npb s PHE 47 Cb 0.00 -3.65 0.11 0.00 -0.63 0.00 0.00 43.02 38.85 2npb s PHE 47 CO 0.00 -2.69 0.09 0.12 -0.05 0.00 0.00 175.22 172.69 2npb s PHE 48 N -1.44 3.28 -0.21 3.49 2.19 -1.25 -4.01 117.98 120.04 2npb s PHE 48 Ca 0.79 -2.79 0.01 0.00 0.33 0.00 0.00 56.93 55.26 2npb s PHE 48 Cb -0.36 -2.67 0.05 0.00 -1.31 0.00 0.00 43.02 38.73 2npb s PHE 48 CO 0.39 -0.90 -0.07 -1.21 1.83 0.00 0.00 175.22 175.25 2npb s GLU 49 N 0.85 1.76 -0.17 10.12 0.41 -0.04 -1.48 118.70 130.14 2npb s GLU 49 Ca 0.12 -0.84 -0.08 0.00 -0.41 0.00 0.00 54.97 53.76 2npb s GLU 49 Cb -0.20 -2.41 -0.04 0.00 -1.78 0.00 0.00 34.13 29.70 2npb s GLU 49 CO -0.10 -0.49 0.08 0.08 -0.49 0.00 0.00 175.26 174.34 2npb s VAL 50 N 1.44 4.98 0.03 2.63 1.01 -0.89 -1.68 120.40 127.93 2npb s VAL 50 Ca -0.03 0.03 0.05 0.00 0.00 0.00 0.00 61.98 62.04 2npb s VAL 50 Cb -0.17 -3.23 -0.02 0.00 0.00 0.00 0.00 36.38 32.96 2npb s VAL 50 CO -0.07 0.49 -0.15 0.42 0.00 0.00 0.00 175.10 175.78 2npb s THR 51 N 0.11 1.20 -0.11 3.92 -4.23 -0.45 -0.82 115.64 115.26 2npb s THR 51 Ca 0.06 -0.98 -0.00 0.00 -1.18 0.00 0.00 61.69 59.59 2npb s THR 51 Cb -0.12 -1.07 0.02 0.00 1.34 0.00 0.00 72.50 72.68 2npb s THR 51 CO 0.00 0.07 -0.08 0.54 -0.54 0.00 0.00 174.62 174.61 2npb s VAL 52 N -0.78 1.04 -0.82 2.29 0.11 0.00 -0.21 120.40 122.02 2npb s VAL 52 Ca 0.03 -0.31 -0.03 0.00 -2.93 0.00 0.00 61.98 58.74 2npb s VAL 52 Cb -0.08 -1.05 0.03 0.00 -1.53 0.00 0.00 36.38 33.76 2npb s VAL 52 CO 0.01 0.37 0.15 0.00 -3.33 0.00 0.00 175.10 172.29 2npb n ALA 53 N 4.85 -0.94 -0.75 1.54 0.00 -0.21 -0.39 120.51 124.60 2npb n ALA 53 Ca -0.13 0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.36 2npb n ALA 53 Cb 0.50 -1.54 0.00 0.00 0.00 0.00 0.00 19.45 18.41 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 -0.81 0.64 3.38 0.00 0.00 -1.26 -5.04 105.19 102.10 2npb n GLY 54 Ca -0.06 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.52 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 -0.25 3.03 0.15 1.61 -0.14 0.47 -5.06 119.74 119.56 2npb s LYS 55 Ca 0.00 -1.32 -0.31 0.00 -1.36 0.00 0.00 55.97 52.98 2npb s LYS 55 Cb 0.00 -4.20 -0.11 0.00 -1.68 0.00 0.00 37.83 31.84 2npb s LYS 55 CO 0.00 -1.29 1.79 -1.17 -0.76 0.00 0.00 175.35 173.92 2npb s LEU 56 N 2.15 4.39 -0.08 3.17 2.96 -1.26 -0.82 118.68 129.19 2npb s LEU 56 Ca 0.08 2.79 0.13 0.00 -0.22 0.00 0.00 54.13 56.91 2npb s LEU 56 Cb -0.24 -3.58 -0.19 0.00 0.50 0.00 0.00 46.19 42.68 2npb s LEU 56 CO 0.07 -0.99 0.16 0.52 -1.32 0.00 0.00 176.35 174.79 2npb n VAL 57 N 4.49 0.51 -3.71 1.68 0.31 -0.00 -4.97 118.33 116.64 2npb n VAL 57 Ca 0.17 -0.46 -0.14 0.00 -0.01 0.00 0.00 64.34 63.90 2npb n VAL 57 Cb 0.37 -0.29 -0.08 0.00 -0.91 0.00 0.00 33.84 32.93 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 -2.61 -0.29 -0.30 3.52 5.65 -1.20 -5.01 115.29 115.05 2npb s HIS 58 Ca -0.06 0.49 0.02 0.00 0.25 0.00 0.00 55.06 55.75 2npb s HIS 58 Cb 0.06 0.16 0.19 0.00 -1.18 0.00 0.00 32.58 31.82 2npb s HIS 58 CO 0.57 -0.42 0.72 0.45 -0.65 0.00 0.00 174.74 175.40 2npb s SER 59 N -1.19 -1.30 0.37 9.88 0.15 -1.25 -2.10 113.70 118.25 2npb s SER 59 Ca -0.12 0.07 0.14 0.00 0.70 0.00 0.00 55.95 56.74 2npb s SER 59 Cb -0.04 1.80 1.00 0.00 -1.71 0.00 0.00 66.02 67.07 2npb s SER 59 CO 0.05 -0.23 1.77 0.11 1.20 0.00 0.00 173.24 176.14 2npb h LYS 60 N 7.67 0.48 0.00 5.44 1.79 -1.35 -0.23 116.57 130.37 2npb h LYS 60 Ca -0.03 -0.03 -0.07 0.00 -2.18 0.00 0.00 60.65 58.35 2npb h LYS 60 Cb 1.19 -0.11 -0.01 0.00 -1.58 0.00 0.00 32.23 31.72 2npb h LYS 60 CO 0.08 0.32 -0.33 1.57 -1.08 0.00 0.00 179.45 180.01 2npb h LYS 61 N 0.50 0.00 0.00 3.15 5.09 -1.93 -2.90 116.57 120.47 2npb h LYS 61 Ca 0.60 0.00 0.00 0.00 0.09 0.00 0.00 60.65 61.34 2npb h LYS 61 Cb 1.33 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.66 2npb h LYS 61 CO -0.34 0.33 0.00 2.89 -2.09 0.00 0.00 179.45 180.23 2npb n ARG 62 N -3.24 0.12 0.00 0.07 -4.01 -1.00 -4.92 116.66 103.68 2npb n ARG 62 Ca 0.02 0.17 0.00 0.00 -1.04 0.00 0.00 57.85 57.00 2npb n ARG 62 Cb 0.62 -1.66 0.00 0.00 -3.04 0.00 0.00 32.46 28.38 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 0.99 1.16 0.24 2.89 0.00 -1.09 -5.03 105.19 104.36 2npb n GLY 63 Ca 0.05 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.21 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 0.00 -2.81 1.61 3.58 -1.20 -3.49 116.42 114.11 2npb h ASP 64 Ca 0.00 0.00 0.14 0.00 0.42 0.00 0.00 57.03 57.59 2npb h ASP 64 Cb 0.00 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 41.01 2npb h ASP 64 CO 0.00 0.01 -0.19 0.61 -2.88 0.00 0.00 179.24 176.80 2npb n GLY 65 N 0.73 -1.70 3.92 -0.78 0.00 -1.26 -4.87 105.19 101.24 2npb n GLY 65 Ca 0.03 -1.21 -0.30 0.00 0.00 0.00 0.00 46.02 44.54 2npb n GLY 65 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2npb s TYR 66 N -0.97 1.61 -0.53 1.61 2.02 -1.26 -3.78 117.35 116.05 2npb s TYR 66 Ca 0.00 0.33 -0.28 0.00 -0.37 0.00 0.00 57.07 56.75 2npb s TYR 66 Cb 0.00 -4.09 0.01 0.00 -0.40 0.00 0.00 41.96 37.48 2npb s TYR 66 CO 0.00 -2.66 1.41 0.14 -1.57 0.00 0.00 175.55 172.88 2npb s VAL 67 N -3.87 3.81 0.00 0.71 -7.23 -1.26 -4.77 120.40 107.79 2npb s VAL 67 Ca 0.74 0.73 0.00 0.00 -1.81 0.00 0.00 61.98 61.63 2npb s VAL 67 Cb -0.04 -4.39 0.00 0.00 0.56 0.00 0.00 36.38 32.51 2npb s VAL 67 CO 0.53 -1.08 0.17 0.47 -0.31 0.00 0.00 175.10 174.88 2npb n ASP 68 N 9.44 0.33 -3.99 4.85 8.00 -1.26 -4.91 116.55 129.01 2npb n ASP 68 Ca 0.13 -0.65 -0.08 0.00 0.71 0.00 0.00 54.79 54.90 2npb n ASP 68 Cb 0.49 0.40 -0.10 0.00 -0.02 0.00 0.00 41.12 41.90 2npb n ASP 68 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2npb s THR 69 N -0.40 0.17 0.16 -3.53 2.01 -1.26 -5.04 115.64 107.74 2npb s THR 69 Ca 0.00 -1.36 -0.18 0.00 0.31 0.00 0.00 61.69 60.45 2npb s THR 69 Cb 0.00 -1.11 0.07 0.00 0.01 0.00 0.00 72.50 71.47 2npb s THR 69 CO 0.00 -0.75 1.66 -0.08 -0.69 0.00 0.00 174.62 174.76 2npb h GLU 70 N 3.48 -0.06 0.00 4.92 4.22 -1.98 0.20 114.58 125.36 2npb h GLU 70 Ca -0.33 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.11 2npb h GLU 70 Cb 1.17 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.43 2npb h GLU 70 CO 0.56 -0.04 0.00 1.03 -2.18 0.00 0.00 179.01 178.38 2npb h SER 71 N -0.06 0.00 0.04 1.04 0.87 -1.99 0.94 113.55 114.39 2npb h SER 71 Ca 0.17 0.00 -0.16 0.00 -1.23 0.00 0.00 61.79 60.57 2npb h SER 71 Cb 0.32 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.27 2npb h SER 71 CO -0.39 0.00 -0.84 0.50 -0.53 0.00 0.00 176.83 175.57 2npb h LYS 72 N 0.00 0.09 -0.62 2.24 3.64 -1.58 -3.38 116.57 116.96 2npb h LYS 72 Ca 0.00 -0.16 0.09 0.00 -1.27 0.00 0.00 60.65 59.32 2npb h LYS 72 Cb 0.24 0.06 -0.07 0.00 -0.41 0.00 0.00 32.23 32.04 2npb h LYS 72 CO 0.00 1.07 0.25 0.35 -2.27 0.00 0.00 179.45 178.86 2npb h PHE 73 N -0.76 0.44 0.00 1.91 3.57 0.28 -2.40 116.94 119.99 2npb h PHE 73 Ca -0.20 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.31 2npb h PHE 73 Cb 1.35 -0.11 -0.00 0.00 2.79 0.00 0.00 35.95 39.99 2npb h PHE 73 CO 0.17 0.13 -0.07 -0.09 -2.23 0.00 0.00 178.31 176.23 2npb h ARG 74 N 0.45 0.00 -0.57 1.11 9.65 -1.06 -0.23 114.38 123.73 2npb h ARG 74 Ca 0.31 0.00 -0.00 0.00 -1.10 0.00 0.00 59.98 59.19 2npb h ARG 74 Cb 0.36 0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 28.92 2npb h ARG 74 CO -0.29 0.07 0.35 0.87 2.80 0.00 0.00 179.97 183.76 2npb h LYS 75 N 0.00 0.76 0.02 0.20 1.79 -1.60 0.03 116.57 117.77 2npb h LYS 75 Ca -0.00 -0.06 -0.06 0.00 -2.18 0.00 0.00 60.65 58.34 2npb h LYS 75 Cb 0.19 -0.16 0.01 0.00 -1.58 0.00 0.00 32.23 30.68 2npb h LYS 75 CO 0.01 0.54 -0.26 1.25 -1.08 0.00 0.00 179.45 179.91 2npb h LEU 76 N 0.76 0.20 -0.57 2.94 5.85 -1.22 -2.28 115.31 121.00 2npb h LEU 76 Ca 0.20 -0.83 0.10 0.00 0.84 0.00 0.00 57.88 58.19 2npb h LEU 76 Cb -0.03 -0.06 -0.08 0.00 0.37 0.00 0.00 40.66 40.86 2npb h LEU 76 CO -0.04 1.01 0.15 0.58 -0.34 0.00 0.00 178.44 179.80 2npb h VAL 77 N -0.59 0.71 -0.35 1.05 2.07 -1.13 0.89 116.25 118.90 2npb h VAL 77 Ca -0.04 -0.10 -0.12 0.00 0.82 0.00 0.00 66.70 67.26 2npb h VAL 77 Cb 1.07 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 31.21 2npb h VAL 77 CO 0.05 0.05 -0.28 0.74 0.02 0.00 0.00 177.57 178.15 2npb h THR 78 N 0.30 1.28 0.00 2.57 2.02 -1.05 -1.90 112.91 116.12 2npb h THR 78 Ca 0.29 -1.41 -0.18 0.00 0.77 0.00 0.00 66.41 65.89 2npb h THR 78 Cb 0.39 1.31 -0.02 0.00 -1.74 0.00 0.00 68.15 68.09 2npb h THR 78 CO -0.35 0.46 -0.82 0.00 0.37 0.00 0.00 175.52 175.19 2npb h ALA 79 N 1.05 0.64 0.00 6.16 0.00 -0.72 -1.90 119.26 124.50 2npb h ALA 79 Ca 0.08 -0.73 -0.22 0.00 0.00 0.00 0.00 54.91 54.04 2npb h ALA 79 Cb 0.79 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 2npb h ALA 79 CO 0.07 0.98 -1.05 0.82 0.00 0.00 0.00 179.25 180.07 2npb h ILE 80 N 0.03 1.65 -0.38 0.00 1.08 -0.85 -1.39 117.51 117.64 2npb h ILE 80 Ca -0.02 -3.37 -0.05 0.00 -0.39 0.00 0.00 64.86 61.03 2npb h ILE 80 Cb 1.44 2.82 -0.01 0.00 -3.07 0.00 0.00 36.82 38.00 2npb h ILE 80 CO 0.11 0.94 0.04 0.50 -0.69 0.00 0.00 178.15 179.05 2npb h LYS 81 N 0.00 0.65 -0.02 2.37 3.64 -1.23 0.39 116.57 122.37 2npb h LYS 81 Ca -0.03 -0.19 -0.00 0.00 -1.27 0.00 0.00 60.65 59.16 2npb h LYS 81 Cb 1.79 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 33.54 2npb h LYS 81 CO 0.13 0.72 0.01 0.00 -2.27 0.00 0.00 179.45 178.04 2npb h ALA 82 N 0.90 0.02 -0.90 5.00 0.00 -1.37 -1.00 119.26 121.91 2npb h ALA 82 Ca 0.11 -0.10 0.10 0.00 0.00 0.00 0.00 54.91 55.02 2npb h ALA 82 Cb 0.41 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.12 2npb h ALA 82 CO 0.01 -0.38 0.54 0.00 0.00 0.00 0.00 179.25 179.42 2npb h ALA 83 N 0.82 1.30 0.21 0.00 0.00 -1.12 -1.65 119.26 118.83 2npb h ALA 83 Ca 0.01 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 2npb h ALA 83 Cb 0.19 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2npb h ALA 83 CO -0.00 0.19 -0.10 1.25 0.00 0.00 0.00 179.25 180.58 2npb h LEU 84 N 0.91 -0.24 -1.75 0.00 7.12 -0.76 0.22 115.31 120.80 2npb h LEU 84 Ca 0.43 -0.23 0.00 0.00 0.13 0.00 0.00 57.88 58.21 2npb h LEU 84 Cb 0.37 0.06 0.00 0.00 -0.53 0.00 0.00 40.66 40.56 2npb h LEU 84 CO -0.24 0.12 0.00 0.00 -0.13 0.00 0.00 178.44 178.19 2npb h ALA 85 N 0.07 1.00 0.07 1.25 0.00 -1.03 0.14 119.26 120.76 2npb h ALA 85 Ca -0.03 0.00 -0.23 0.00 0.00 0.00 0.00 54.91 54.65 2npb h ALA 85 Cb 0.45 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2npb h ALA 85 CO 0.05 0.00 -1.23 0.37 0.00 0.00 0.00 179.25 178.44 2npb h GLN 86 N 0.00 0.14 -0.89 0.00 4.15 -1.18 -3.36 115.11 113.97 2npb h GLN 86 Ca 0.00 -0.25 0.06 0.00 0.77 0.00 0.00 58.65 59.24 2npb h GLN 86 Cb 0.20 0.09 -0.06 0.00 0.21 0.00 0.00 27.48 27.93 2npb h GLN 86 CO 0.00 1.12 0.58 0.00 -1.93 0.00 0.00 178.83 178.60