#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2npb n ALA 2 N 0.00 -2.79 -3.76 3.04 0.00 -1.26 -4.93 120.51 110.81 2npb n ALA 2 Ca 0.00 0.30 -0.27 0.00 0.00 0.00 0.00 53.44 53.46 2npb n ALA 2 Cb 0.00 -0.93 -0.17 0.00 0.00 0.00 0.00 19.45 18.35 2npb n ALA 2 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2npb s LEU 3 N 0.00 1.53 -0.60 0.00 2.96 -1.16 -4.96 118.68 116.45 2npb s LEU 3 Ca 0.00 -0.37 -0.20 0.00 -0.22 0.00 0.00 54.13 53.34 2npb s LEU 3 Cb 0.00 -0.97 0.09 0.00 0.50 0.00 0.00 46.19 45.81 2npb s LEU 3 CO 0.00 -0.04 0.76 0.00 -1.32 0.00 0.00 176.35 175.75 2npb s ALA 4 N 1.23 3.34 0.07 5.97 0.00 -1.26 -0.65 121.76 130.46 2npb s ALA 4 Ca -0.03 -2.07 0.04 0.00 0.00 0.00 0.00 51.96 49.90 2npb s ALA 4 Cb -0.14 -3.58 -0.04 0.00 0.00 0.00 0.00 23.12 19.36 2npb s ALA 4 CO -0.04 -2.40 0.01 0.08 0.00 0.00 0.00 175.76 173.40 2npb s VAL 5 N 3.00 4.10 0.08 0.00 1.01 0.13 -0.74 120.40 127.97 2npb s VAL 5 Ca 0.15 -0.87 0.01 0.00 0.00 0.00 0.00 61.98 61.27 2npb s VAL 5 Cb -0.22 -2.92 -0.04 0.00 0.00 0.00 0.00 36.38 33.20 2npb s VAL 5 CO 0.08 0.19 -0.06 -0.60 0.00 0.00 0.00 175.10 174.71 2npb s ARG 6 N -2.12 0.71 -0.24 2.72 6.06 0.20 -0.63 118.95 125.66 2npb s ARG 6 Ca 0.24 -1.16 -0.04 0.00 -2.50 0.00 0.00 55.73 52.28 2npb s ARG 6 Cb -0.12 -0.15 0.10 0.00 0.06 0.00 0.00 34.95 34.84 2npb s ARG 6 CO 0.17 -0.02 0.17 0.08 -2.50 0.00 0.00 175.30 173.20 2npb s VAL 7 N -3.09 -0.20 -0.34 7.11 1.01 -1.02 -1.79 120.40 122.09 2npb s VAL 7 Ca 0.05 -0.41 -0.19 0.00 0.00 0.00 0.00 61.98 61.44 2npb s VAL 7 Cb 0.02 -0.81 -0.01 0.00 0.00 0.00 0.00 36.38 35.58 2npb s VAL 7 CO -0.04 -0.45 0.55 -0.69 0.00 0.00 0.00 175.10 174.47 2npb s VAL 8 N 2.21 4.99 0.08 2.92 1.01 -0.37 -0.49 120.40 130.75 2npb s VAL 8 Ca 0.07 0.51 0.02 0.00 0.00 0.00 0.00 61.98 62.58 2npb s VAL 8 Cb -0.16 -3.98 -0.03 0.00 0.00 0.00 0.00 36.38 32.22 2npb s VAL 8 CO -0.23 -0.19 -0.08 -0.47 0.00 0.00 0.00 175.10 174.12 2npb s TYR 9 N 2.47 0.88 -1.14 5.22 5.04 -1.19 -0.82 117.35 127.81 2npb s TYR 9 Ca 0.21 -0.70 -0.23 0.00 -2.44 0.00 0.00 57.07 53.90 2npb s TYR 9 Cb -0.15 -0.50 -0.09 0.00 0.35 0.00 0.00 41.96 41.57 2npb s TYR 9 CO 0.13 -0.08 1.95 -1.54 -1.34 0.00 0.00 175.55 174.67 2npb s SER 10 N -2.40 4.95 0.00 4.32 1.04 -1.19 -2.52 113.70 117.89 2npb s SER 10 Ca 0.03 -1.49 -0.01 0.00 0.48 0.00 0.00 55.95 54.95 2npb s SER 10 Cb -0.02 -2.59 -0.06 0.00 0.10 0.00 0.00 66.02 63.45 2npb s SER 10 CO -0.02 -3.14 1.82 0.61 0.98 0.00 0.00 173.24 173.50 2npb n GLY 11 N 5.96 2.06 2.85 7.32 0.00 -0.73 -4.80 105.19 117.86 2npb n GLY 11 Ca 0.44 -0.28 -0.23 0.00 0.00 0.00 0.00 46.02 45.95 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 1.98 3.39 -1.01 4.61 0.00 -1.26 -4.81 120.51 123.40 2npb n ALA 12 Ca 0.10 -1.91 0.07 0.00 0.00 0.00 0.00 53.44 51.70 2npb n ALA 12 Cb 0.45 -3.08 -0.02 0.00 0.00 0.00 0.00 19.45 16.80 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 -1.43 0.43 0.20 0.00 0.00 -1.26 -4.76 105.19 98.37 2npb n GLY 14 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.04 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 0.10 0.26 1.61 -0.00 -1.89 -3.28 116.97 113.77 2npb h TYR 15 Ca 0.00 -0.02 -0.00 0.00 0.00 0.00 0.00 58.73 58.70 2npb h TYR 15 Cb 0.00 -0.03 -0.02 0.00 0.00 0.00 0.00 36.73 36.69 2npb h TYR 15 CO 0.00 0.43 -0.33 0.87 -0.00 0.00 0.00 178.16 179.13 2npb h LYS 16 N 0.08 -0.59 -0.15 0.10 1.79 -1.97 0.27 116.57 116.10 2npb h LYS 16 Ca 0.01 0.04 -0.07 0.00 -2.18 0.00 0.00 60.65 58.44 2npb h LYS 16 Cb 0.65 0.13 -0.01 0.00 -1.58 0.00 0.00 32.23 31.42 2npb h LYS 16 CO 0.05 -0.39 -0.24 -1.00 -1.08 0.00 0.00 179.45 176.78 2npb h PRO 17 N -0.61 0.27 -0.20 3.15 0.13 -1.99 -0.40 132.00 132.35 2npb h PRO 17 Ca -0.03 -0.09 0.02 0.00 -0.87 0.00 0.00 66.00 65.03 2npb h PRO 17 Cb 0.55 -0.02 -0.02 0.00 0.13 0.00 0.00 31.00 31.63 2npb h PRO 17 CO -0.08 0.50 0.06 -0.22 -0.23 0.00 0.00 178.00 178.03 2npb h LYS 18 N 0.24 0.15 0.41 0.86 3.64 -1.57 0.26 116.57 120.55 2npb h LYS 18 Ca 0.04 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.40 2npb h LYS 18 Cb 0.57 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.35 2npb h LYS 18 CO 0.04 0.10 -0.25 1.88 -2.27 0.00 0.00 179.45 178.95 2npb h TYR 19 N 0.15 -0.64 -0.95 1.91 -1.99 -0.32 -3.12 116.97 112.01 2npb h TYR 19 Ca 0.09 -0.01 0.03 0.00 2.00 0.00 0.00 58.73 60.83 2npb h TYR 19 Cb 0.06 0.23 -0.05 0.00 2.00 0.00 0.00 36.73 38.97 2npb h TYR 19 CO -0.12 -0.38 0.63 -0.07 -0.00 0.00 0.00 178.16 178.21 2npb h LEU 20 N -0.62 1.05 -0.30 3.88 3.38 -0.75 0.98 115.31 122.93 2npb h LEU 20 Ca -0.05 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.84 2npb h LEU 20 Cb 0.51 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 2npb h LEU 20 CO 0.05 0.74 -0.08 -0.61 0.09 0.00 0.00 178.44 178.62 2npb h GLN 21 N 1.23 0.58 -0.24 1.13 -0.00 -1.01 0.35 115.11 117.15 2npb h GLN 21 Ca 0.37 -0.23 -0.01 0.00 -0.00 0.00 0.00 58.65 58.78 2npb h GLN 21 Cb -0.05 -0.03 -0.01 0.00 0.00 0.00 0.00 27.48 27.39 2npb h GLN 21 CO -0.10 0.78 0.13 1.25 0.00 0.00 0.00 178.83 180.89 2npb h LEU 22 N 0.34 0.30 0.80 -2.39 7.12 -1.45 -3.17 115.31 116.87 2npb h LEU 22 Ca 0.07 -0.09 -0.04 0.00 0.13 0.00 0.00 57.88 57.95 2npb h LEU 22 Cb 0.57 -0.08 0.00 0.00 -0.53 0.00 0.00 40.66 40.63 2npb h LEU 22 CO 0.03 0.31 -0.42 0.11 -0.13 0.00 0.00 178.44 178.34 2npb h LYS 23 N 0.27 -1.08 -0.96 1.25 1.79 -0.65 -3.12 116.57 114.06 2npb h LYS 23 Ca 0.08 0.07 0.30 0.00 -2.18 0.00 0.00 60.65 58.93 2npb h LYS 23 Cb 0.08 0.25 -0.16 0.00 -1.58 0.00 0.00 32.23 30.82 2npb h LYS 23 CO -0.01 -0.72 0.37 1.49 -1.08 0.00 0.00 179.45 179.49 2npb h GLU 24 N -1.13 0.17 0.00 3.15 4.22 -0.38 0.73 114.58 121.35 2npb h GLU 24 Ca -0.11 -0.01 -0.02 0.00 0.08 0.00 0.00 59.36 59.30 2npb h GLU 24 Cb 0.88 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 30.09 2npb h GLU 24 CO 0.16 0.12 -0.09 -0.22 -2.18 0.00 0.00 179.01 176.79 2npb h LYS 25 N 0.18 0.00 0.03 1.92 1.63 -1.51 0.15 116.57 118.97 2npb h LYS 25 Ca 0.67 0.00 -0.33 0.00 -0.85 0.00 0.00 60.65 60.15 2npb h LYS 25 Cb 1.52 0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 33.11 2npb h LYS 25 CO -0.70 0.09 -1.81 -0.11 -3.45 0.00 0.00 179.45 173.47 2npb n LEU 26 N -3.21 2.16 0.23 5.20 7.94 0.04 -3.64 117.00 125.73 2npb n LEU 26 Ca 0.01 0.31 0.06 0.00 -1.11 0.00 0.00 56.01 55.27 2npb n LEU 26 Cb 0.38 -0.97 0.53 0.00 0.53 0.00 0.00 43.42 43.90 2npb n LEU 26 CO 0.30 0.53 0.93 -0.33 -1.11 0.00 0.00 177.39 177.71 2npb h GLU 27 N -0.66 0.00 -0.22 1.96 5.08 -1.02 -0.48 114.58 119.24 2npb h GLU 27 Ca -0.46 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 57.95 2npb h GLU 27 Cb 1.59 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.80 2npb h GLU 27 CO -0.17 0.16 -0.09 1.25 -1.00 0.00 0.00 179.01 179.16 2npb h HIS 28 N 0.00 -0.20 -0.15 4.33 -0.00 -0.88 -2.61 115.15 115.64 2npb h HIS 28 Ca -0.00 0.02 -0.17 0.00 -0.00 0.00 0.00 60.37 60.23 2npb h HIS 28 Cb 0.28 0.12 -0.01 0.00 -0.00 0.00 0.00 27.41 27.81 2npb h HIS 28 CO 0.00 -0.14 -0.60 1.49 -0.00 0.00 0.00 177.93 178.68 2npb h GLU 29 N -0.05 0.49 -0.78 5.26 4.57 -1.40 -3.38 114.58 119.30 2npb h GLU 29 Ca 0.11 -0.33 -0.41 0.00 -1.18 0.00 0.00 59.36 57.55 2npb h GLU 29 Cb 0.22 0.05 -0.41 0.00 -0.16 0.00 0.00 28.75 28.45 2npb h GLU 29 CO -0.25 0.95 -0.98 1.19 -1.18 0.00 0.00 179.01 178.74 2npb n PHE 30 N -3.92 2.04 -1.82 0.92 3.72 -0.27 -5.07 117.46 113.05 2npb n PHE 30 Ca -0.03 -2.41 -0.42 0.00 -0.05 0.00 0.00 57.45 54.54 2npb n PHE 30 Cb 0.63 -0.27 -0.03 0.00 -0.94 0.00 0.00 39.48 38.87 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 -3.59 4.16 0.00 -1.08 0.04 -0.99 -1.22 135.00 132.33 2npb s PRO 31 Ca 0.38 2.43 0.00 0.00 0.04 0.00 0.00 61.00 63.84 2npb s PRO 31 Cb 0.38 -4.03 0.00 0.00 0.04 0.00 0.00 34.50 30.89 2npb s PRO 31 CO -0.02 -0.89 0.00 0.41 0.04 0.00 0.00 177.00 176.54 2npb n GLY 32 N 4.33 0.00 0.07 0.56 0.00 -1.26 -4.72 105.19 104.17 2npb n GLY 32 Ca 0.18 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.30 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 -3.77 2.45 -0.06 0.00 1.02 -0.99 -2.99 118.68 114.33 2npb s LEU 34 Ca 0.05 -0.90 0.01 0.00 0.02 0.00 0.00 54.13 53.31 2npb s LEU 34 Cb 0.09 -0.01 -0.03 0.00 0.02 0.00 0.00 46.19 46.26 2npb s LEU 34 CO 0.33 -0.45 -0.06 -0.62 0.02 0.00 0.00 176.35 175.57 2npb s ASP 35 N -2.68 4.73 -0.05 2.29 2.15 0.17 -4.82 116.67 118.47 2npb s ASP 35 Ca 0.05 -0.01 -0.00 0.00 0.43 0.00 0.00 52.55 53.02 2npb s ASP 35 Cb 0.03 -1.21 0.03 0.00 -0.30 0.00 0.00 42.92 41.47 2npb s ASP 35 CO -0.05 0.36 -0.00 -0.63 -0.17 0.00 0.00 175.17 174.68 2npb s ILE 36 N -0.84 0.30 0.51 4.11 1.09 -1.26 -0.70 121.20 124.42 2npb s ILE 36 Ca 0.13 0.09 0.00 0.00 -1.10 0.00 0.00 60.65 59.78 2npb s ILE 36 Cb -0.11 -0.42 -0.00 0.00 -1.06 0.00 0.00 42.46 40.87 2npb s ILE 36 CO 0.02 0.21 0.01 0.00 -0.10 0.00 0.00 174.94 175.08 2npb s GLY 38 N -3.83 -0.56 -0.47 0.00 0.00 -1.26 -2.43 107.32 98.77 2npb s GLY 38 Ca 0.02 0.78 0.04 0.00 0.00 0.00 0.00 44.72 45.55 2npb s GLY 38 CO 0.01 0.45 0.35 -0.54 0.00 0.00 0.00 173.10 173.36 2npb s GLU 39 N -2.62 1.27 0.00 2.90 2.02 0.36 -4.86 118.70 117.77 2npb s GLU 39 Ca -0.04 -2.29 0.00 0.00 0.02 0.00 0.00 54.97 52.66 2npb s GLU 39 Cb -0.01 -1.98 0.00 0.00 0.10 0.00 0.00 34.13 32.24 2npb s GLU 39 CO -0.03 -1.31 1.29 0.41 0.02 0.00 0.00 175.26 175.63 2npb n GLY 40 N 2.88 1.93 3.52 -1.39 0.00 -1.26 -3.19 105.19 107.67 2npb n GLY 40 Ca 0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 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 1.16 0.06 -2.53 2.61 -1.04 -1.05 -1.77 114.28 111.71 2npb n THR 41 Ca 0.00 -0.47 -0.43 0.00 -2.04 0.00 0.00 64.05 61.11 2npb n THR 41 Cb 0.41 -2.03 0.00 0.00 -1.82 0.00 0.00 70.33 66.89 2npb n THR 41 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 2npb n PRO 42 N 8.67 3.38 0.00 -2.82 -0.04 -1.26 -4.36 135.00 138.56 2npb n PRO 42 Ca 0.43 -3.51 0.00 0.00 -0.04 0.00 0.00 63.50 60.38 2npb n PRO 42 Cb 0.35 -3.09 0.00 0.00 -0.04 0.00 0.00 33.50 30.73 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 5.40 2.32 -3.58 0.54 1.13 -1.26 -4.91 117.38 117.02 2npb n GLN 43 Ca 0.41 0.00 -0.29 0.00 -1.94 0.00 0.00 57.00 55.18 2npb n GLN 43 Cb 0.40 -0.81 -0.15 0.00 0.11 0.00 0.00 30.24 29.79 2npb n GLN 43 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 2npb s VAL 44 N -1.32 0.09 0.00 5.09 1.01 -1.26 -5.07 120.40 118.93 2npb s VAL 44 Ca 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 61.98 61.16 2npb s VAL 44 Cb 0.00 -1.06 0.00 0.00 0.00 0.00 0.00 36.38 35.32 2npb s VAL 44 CO 0.00 -0.68 0.00 0.41 0.00 0.00 0.00 175.10 174.83 2npb n THR 45 N 5.18 0.00 0.00 3.92 -1.04 -1.26 -3.55 114.28 117.53 2npb n THR 45 Ca -0.06 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.95 2npb n THR 45 Cb 0.43 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.94 2npb n THR 45 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2npb n GLY 46 N 0.00 0.00 3.75 3.41 0.00 -1.26 -4.97 105.19 106.12 2npb n GLY 46 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 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 0.00 2.42 -0.42 1.61 0.08 -1.23 -4.67 117.98 115.77 2npb s PHE 47 Ca 0.00 1.59 0.04 0.00 0.12 0.00 0.00 56.93 58.68 2npb s PHE 47 Cb 0.00 -3.18 0.19 0.00 -0.57 0.00 0.00 43.02 39.45 2npb s PHE 47 CO 0.00 -1.98 0.74 0.12 -0.10 0.00 0.00 175.22 174.00 2npb s PHE 48 N -2.54 -1.43 -0.23 0.36 2.19 -1.21 -3.20 117.98 111.91 2npb s PHE 48 Ca 0.66 0.02 0.00 0.00 0.33 0.00 0.00 56.93 57.94 2npb s PHE 48 Cb -0.21 0.27 0.03 0.00 -1.31 0.00 0.00 43.02 41.80 2npb s PHE 48 CO 0.49 -1.01 -0.11 -1.21 1.83 0.00 0.00 175.22 175.21 2npb s GLU 49 N 1.60 2.75 -0.15 10.12 0.41 0.00 -1.84 118.70 131.60 2npb s GLU 49 Ca 0.19 -1.02 -0.05 0.00 -0.41 0.00 0.00 54.97 53.69 2npb s GLU 49 Cb -0.01 -2.86 -0.03 0.00 -1.78 0.00 0.00 34.13 29.45 2npb s GLU 49 CO -0.08 -0.39 0.01 0.54 -0.49 0.00 0.00 175.26 174.86 2npb s VAL 50 N 1.27 4.35 -0.01 2.63 0.11 -0.78 -1.24 120.40 126.72 2npb s VAL 50 Ca -0.01 -0.20 0.01 0.00 -2.93 0.00 0.00 61.98 58.85 2npb s VAL 50 Cb -0.16 -2.91 0.01 0.00 -1.53 0.00 0.00 36.38 31.79 2npb s VAL 50 CO -0.07 0.51 -0.03 -0.89 -3.33 0.00 0.00 175.10 171.30 2npb s THR 51 N 0.02 0.28 -0.16 5.04 2.01 -0.74 -1.46 115.64 120.63 2npb s THR 51 Ca 0.03 -0.09 0.01 0.00 0.31 0.00 0.00 61.69 61.96 2npb s THR 51 Cb -0.13 -0.29 0.02 0.00 0.01 0.00 0.00 72.50 72.12 2npb s THR 51 CO 0.02 0.11 -0.19 0.54 -0.69 0.00 0.00 174.62 174.41 2npb s VAL 52 N 0.32 1.92 -1.16 3.82 0.11 -0.39 -0.63 120.40 124.39 2npb s VAL 52 Ca -0.03 -0.86 -0.13 0.00 -2.93 0.00 0.00 61.98 58.02 2npb s VAL 52 Cb -0.06 -1.74 0.13 0.00 -1.53 0.00 0.00 36.38 33.18 2npb s VAL 52 CO -0.01 0.52 0.39 0.00 -3.33 0.00 0.00 175.10 172.67 2npb n ALA 53 N 4.52 -1.12 -1.91 1.54 0.00 0.08 -0.80 120.51 122.82 2npb n ALA 53 Ca -0.20 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.16 2npb n ALA 53 Cb 0.50 -1.94 0.00 0.00 0.00 0.00 0.00 19.45 18.02 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 -0.91 0.66 2.74 0.00 0.00 -1.26 -5.03 105.19 101.39 2npb n GLY 54 Ca 0.06 -0.74 -0.29 0.00 0.00 0.00 0.00 46.02 45.05 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 -3.90 0.72 0.19 1.61 -0.14 0.02 -5.13 119.74 113.12 2npb s LYS 55 Ca 0.00 -0.68 -0.31 0.00 -1.36 0.00 0.00 55.97 53.62 2npb s LYS 55 Cb 0.00 -2.05 -0.09 0.00 -1.68 0.00 0.00 37.83 34.00 2npb s LYS 55 CO 0.00 -0.77 1.42 -1.17 -0.76 0.00 0.00 175.35 174.07 2npb s LEU 56 N 1.76 4.39 -0.00 3.17 0.20 -1.26 -1.27 118.68 125.67 2npb s LEU 56 Ca 0.03 2.52 0.01 0.00 0.69 0.00 0.00 54.13 57.38 2npb s LEU 56 Cb -0.17 -3.61 -0.01 0.00 -0.43 0.00 0.00 46.19 41.97 2npb s LEU 56 CO -0.15 -0.68 0.02 0.52 -0.29 0.00 0.00 176.35 175.77 2npb n VAL 57 N 3.07 0.01 -3.88 1.68 0.31 -0.54 -4.98 118.33 114.01 2npb n VAL 57 Ca 0.09 -0.02 -0.10 0.00 -0.01 0.00 0.00 64.34 64.30 2npb n VAL 57 Cb 0.41 0.26 -0.09 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 -2.05 0.13 -0.30 3.52 5.65 -1.20 -5.00 115.29 116.04 2npb s HIS 58 Ca -0.00 -0.43 -0.05 0.00 0.25 0.00 0.00 55.06 54.83 2npb s HIS 58 Cb 0.00 -0.08 0.18 0.00 -1.18 0.00 0.00 32.58 31.51 2npb s HIS 58 CO 0.03 -0.43 0.72 0.45 -0.65 0.00 0.00 174.74 174.86 2npb s SER 59 N -2.27 -1.14 0.45 9.88 0.15 -1.25 -1.87 113.70 117.65 2npb s SER 59 Ca -0.03 0.77 0.12 0.00 0.70 0.00 0.00 55.95 57.51 2npb s SER 59 Cb 0.00 1.98 1.02 0.00 -1.71 0.00 0.00 66.02 67.32 2npb s SER 59 CO -0.06 -0.21 2.05 0.11 1.20 0.00 0.00 173.24 176.33 2npb h LYS 60 N 7.99 0.18 -0.19 5.44 1.79 -1.68 -1.18 116.57 128.92 2npb h LYS 60 Ca -0.20 -0.02 0.03 0.00 -2.18 0.00 0.00 60.65 58.27 2npb h LYS 60 Cb 1.16 -0.04 -0.03 0.00 -1.58 0.00 0.00 32.23 31.75 2npb h LYS 60 CO 0.17 0.20 0.02 -0.22 -1.08 0.00 0.00 179.45 178.53 2npb h LYS 61 N 0.19 0.08 0.00 3.15 3.64 -1.84 -2.80 116.57 118.98 2npb h LYS 61 Ca 0.05 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 2npb h LYS 61 Cb 0.12 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 2npb h LYS 61 CO 0.00 0.05 0.00 2.89 -2.27 0.00 0.00 179.45 180.12 2npb n ARG 62 N -5.11 0.12 -0.65 1.90 -4.01 -1.19 -4.90 116.66 102.82 2npb n ARG 62 Ca -0.03 0.24 0.00 0.00 -1.04 0.00 0.00 57.85 57.02 2npb n ARG 62 Cb 0.10 -1.68 0.00 0.00 -3.04 0.00 0.00 32.46 27.84 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 0.62 1.36 0.22 2.89 0.00 -1.06 -5.01 105.19 104.22 2npb n GLY 63 Ca 0.04 -0.31 -0.07 0.00 0.00 0.00 0.00 46.02 45.68 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 0.56 -3.91 1.61 3.58 -1.42 -3.50 116.42 113.34 2npb h ASP 64 Ca 0.00 -0.25 0.03 0.00 0.42 0.00 0.00 57.03 57.23 2npb h ASP 64 Cb 0.30 -0.16 -0.02 0.00 1.72 0.00 0.00 39.33 41.18 2npb h ASP 64 CO 0.00 0.90 -0.53 0.61 -2.88 0.00 0.00 179.24 177.34 2npb n GLY 65 N -0.05 -3.40 0.00 -0.78 0.00 -1.26 -5.03 105.19 94.68 2npb n GLY 65 Ca -0.02 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 44.91 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 -2.25 -2.21 -1.43 1.61 4.01 -1.26 -4.78 117.16 110.85 2npb n TYR 66 Ca -0.01 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.33 2npb n TYR 66 Cb 0.27 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.28 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 -2.77 3.16 0.33 -0.72 0.24 -1.26 -4.62 118.33 112.69 2npb n VAL 67 Ca 0.00 -2.47 0.11 0.00 -2.04 0.00 0.00 64.34 59.94 2npb n VAL 67 Cb 0.00 -2.50 0.50 0.00 -1.47 0.00 0.00 33.84 30.37 2npb n VAL 67 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 2npb n ASP 68 N 5.75 0.61 -3.71 -1.34 8.00 -1.26 -4.75 116.55 119.86 2npb n ASP 68 Ca 0.56 0.68 -0.10 0.00 0.71 0.00 0.00 54.79 56.64 2npb n ASP 68 Cb 0.34 -0.80 -0.04 0.00 -0.02 0.00 0.00 41.12 40.60 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 -3.36 0.03 0.24 -3.53 2.01 -1.26 -5.02 115.64 104.74 2npb s THR 69 Ca 0.02 -0.70 -0.05 0.00 0.31 0.00 0.00 61.69 61.27 2npb s THR 69 Cb 0.08 -1.50 0.20 0.00 0.01 0.00 0.00 72.50 71.29 2npb s THR 69 CO 0.33 -0.13 1.76 -0.33 -0.69 0.00 0.00 174.62 175.57 2npb h GLU 70 N 2.20 0.55 0.00 4.92 4.39 -2.00 -0.99 114.58 123.65 2npb h GLU 70 Ca -0.30 -0.03 -0.04 0.00 0.34 0.00 0.00 59.36 59.33 2npb h GLU 70 Cb 1.26 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 29.78 2npb h GLU 70 CO 0.38 0.37 -0.20 1.03 -1.16 0.00 0.00 179.01 179.43 2npb h SER 71 N 0.57 0.00 0.18 1.42 0.87 -1.98 0.13 113.55 114.74 2npb h SER 71 Ca 0.38 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.94 2npb h SER 71 Cb 0.48 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.44 2npb h SER 71 CO -0.32 0.20 -0.09 0.50 -0.53 0.00 0.00 176.83 176.60 2npb h LYS 72 N 0.00 -0.23 -0.45 2.24 1.63 -1.60 -2.94 116.57 115.22 2npb h LYS 72 Ca -0.00 0.02 0.02 0.00 -0.85 0.00 0.00 60.65 59.83 2npb h LYS 72 Cb 0.36 0.05 -0.03 0.00 -0.60 0.00 0.00 32.23 32.01 2npb h LYS 72 CO 0.03 0.10 0.27 0.35 -3.45 0.00 0.00 179.45 176.75 2npb h PHE 73 N -0.59 0.50 -0.27 1.91 3.57 -0.81 -2.57 116.94 118.68 2npb h PHE 73 Ca -0.02 0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.57 2npb h PHE 73 Cb 0.44 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 39.00 2npb h PHE 73 CO 0.03 0.29 0.20 -0.09 -2.23 0.00 0.00 178.31 176.52 2npb h ARG 74 N 0.54 0.00 -0.53 1.11 2.43 -0.82 -0.68 114.38 116.44 2npb h ARG 74 Ca 0.18 0.00 0.09 0.00 -0.81 0.00 0.00 59.98 59.44 2npb h ARG 74 Cb 0.01 0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 29.49 2npb h ARG 74 CO -0.08 0.00 0.12 -0.22 -1.51 0.00 0.00 179.97 178.28 2npb h LYS 75 N 0.00 0.26 -0.01 0.20 1.63 -1.26 0.19 116.57 117.57 2npb h LYS 75 Ca 0.13 -0.02 -0.02 0.00 -0.85 0.00 0.00 60.65 59.89 2npb h LYS 75 Cb 0.54 -0.06 0.00 0.00 -0.60 0.00 0.00 32.23 32.11 2npb h LYS 75 CO -0.00 0.17 -0.07 1.25 -3.45 0.00 0.00 179.45 177.35 2npb h LEU 76 N 0.27 0.08 -0.79 5.20 5.85 -1.25 -2.33 115.31 122.35 2npb h LEU 76 Ca 0.26 -0.66 0.05 0.00 0.84 0.00 0.00 57.88 58.37 2npb h LEU 76 Cb 0.35 -0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.30 2npb h LEU 76 CO -0.33 0.73 0.48 0.58 -0.34 0.00 0.00 178.44 179.56 2npb h VAL 77 N -0.56 1.06 -0.45 1.05 2.07 -1.21 -0.16 116.25 118.06 2npb h VAL 77 Ca -0.00 -0.31 -0.04 0.00 0.82 0.00 0.00 66.70 67.16 2npb h VAL 77 Cb 0.73 0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 2npb h VAL 77 CO 0.01 0.17 0.12 0.74 0.02 0.00 0.00 177.57 178.63 2npb h THR 78 N 0.91 1.23 -0.00 2.57 2.02 -0.68 -1.72 112.91 117.23 2npb h THR 78 Ca 0.33 -0.79 -0.18 0.00 0.77 0.00 0.00 66.41 66.54 2npb h THR 78 Cb 0.11 0.90 -0.02 0.00 -1.74 0.00 0.00 68.15 67.41 2npb h THR 78 CO -0.15 0.28 -0.81 0.00 0.37 0.00 0.00 175.52 175.21 2npb h ALA 79 N 0.97 0.64 0.00 6.16 0.00 -0.75 -2.07 119.26 124.21 2npb h ALA 79 Ca 0.14 -0.70 -0.17 0.00 0.00 0.00 0.00 54.91 54.18 2npb h ALA 79 Cb 0.31 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 2npb h ALA 79 CO 0.00 0.93 -0.99 0.82 0.00 0.00 0.00 179.25 180.01 2npb h ILE 80 N 0.06 1.03 -0.09 0.00 1.08 -1.07 -1.92 117.51 116.61 2npb h ILE 80 Ca -0.02 -2.58 -0.20 0.00 -0.39 0.00 0.00 64.86 61.66 2npb h ILE 80 Cb 1.41 2.46 0.00 0.00 -3.07 0.00 0.00 36.82 37.63 2npb h ILE 80 CO 0.11 0.59 -0.78 0.50 -0.69 0.00 0.00 178.15 177.88 2npb h LYS 81 N 0.00 0.52 0.23 2.37 3.64 -1.25 0.21 116.57 122.29 2npb h LYS 81 Ca -0.07 -0.44 -0.01 0.00 -1.27 0.00 0.00 60.65 58.85 2npb h LYS 81 Cb 1.62 0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 33.53 2npb h LYS 81 CO 0.08 1.08 -0.14 0.00 -2.27 0.00 0.00 179.45 178.20 2npb h ALA 82 N 0.79 -0.34 0.00 5.00 0.00 -1.40 -2.73 119.26 120.59 2npb h ALA 82 Ca -0.05 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 2npb h ALA 82 Cb 1.38 0.16 -0.00 0.00 0.00 0.00 0.00 17.79 19.33 2npb h ALA 82 CO 0.14 -0.70 -0.08 0.00 0.00 0.00 0.00 179.25 178.61 2npb h ALA 83 N 0.42 1.18 0.91 0.00 0.00 -1.17 -2.45 119.26 118.15 2npb h ALA 83 Ca -0.02 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 2npb h ALA 83 Cb 0.29 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.07 2npb h ALA 83 CO 0.03 0.10 -0.44 1.25 0.00 0.00 0.00 179.25 180.19 2npb h LEU 84 N 0.00 -1.03 -2.94 0.00 6.46 -0.83 -0.98 115.31 115.99 2npb h LEU 84 Ca -0.00 0.03 0.00 0.00 -0.12 0.00 0.00 57.88 57.79 2npb h LEU 84 Cb 0.32 0.27 -0.00 0.00 -0.73 0.00 0.00 40.66 40.52 2npb h LEU 84 CO 0.01 -0.71 0.00 0.00 -0.62 0.00 0.00 178.44 177.12 2npb h ALA 85 N -1.21 1.05 0.16 1.25 0.00 -1.14 0.02 119.26 119.39 2npb h ALA 85 Ca -0.12 -0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.49 2npb h ALA 85 Cb 0.94 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.74 2npb h ALA 85 CO 0.20 -0.00 -1.46 0.37 0.00 0.00 0.00 179.25 178.37 2npb h GLN 86 N 0.00 0.34 0.00 0.00 4.15 -1.38 -3.29 115.11 114.93 2npb h GLN 86 Ca 0.00 -0.59 -0.02 0.00 0.77 0.00 0.00 58.65 58.81 2npb h GLN 86 Cb 0.00 0.22 -0.00 0.00 0.21 0.00 0.00 27.48 27.91 2npb h GLN 86 CO -0.00 1.28 -0.10 0.00 -1.93 0.00 0.00 178.83 178.08