#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 -3.61 -2.30 3.17 0.00 -1.26 -3.85 120.51 112.66 2npb n ALA 2 Ca 0.00 -0.97 -0.20 0.00 0.00 0.00 0.00 53.44 52.27 2npb n ALA 2 Cb 0.00 -1.60 0.01 0.00 0.00 0.00 0.00 19.45 17.86 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 -0.39 3.75 -0.08 0.00 1.98 -0.65 -4.96 118.68 118.32 2npb s LEU 3 Ca 0.55 -0.06 0.00 0.00 -2.89 0.00 0.00 54.13 51.73 2npb s LEU 3 Cb -0.15 -2.88 0.02 0.00 0.66 0.00 0.00 46.19 43.84 2npb s LEU 3 CO 0.68 -0.64 -0.06 0.00 -1.89 0.00 0.00 176.35 174.43 2npb s ALA 4 N -2.38 1.05 0.06 5.97 0.00 -1.26 -0.85 121.76 124.34 2npb s ALA 4 Ca 0.49 -0.34 0.05 0.00 0.00 0.00 0.00 51.96 52.16 2npb s ALA 4 Cb -0.10 -0.72 -0.03 0.00 0.00 0.00 0.00 23.12 22.27 2npb s ALA 4 CO 0.34 -0.26 -0.14 0.08 0.00 0.00 0.00 175.76 175.78 2npb s VAL 5 N 1.45 1.12 0.13 0.00 1.01 -0.23 -0.86 120.40 123.02 2npb s VAL 5 Ca -0.01 -1.15 0.04 0.00 0.00 0.00 0.00 61.98 60.86 2npb s VAL 5 Cb -0.13 -1.05 -0.04 0.00 0.00 0.00 0.00 36.38 35.16 2npb s VAL 5 CO -0.04 -0.10 -0.10 -0.60 0.00 0.00 0.00 175.10 174.25 2npb s ARG 6 N -1.43 1.00 -0.25 2.72 6.06 -0.11 -0.81 118.95 126.13 2npb s ARG 6 Ca -0.00 -1.36 -0.03 0.00 -2.50 0.00 0.00 55.73 51.83 2npb s ARG 6 Cb -0.09 -0.61 0.10 0.00 0.06 0.00 0.00 34.95 34.41 2npb s ARG 6 CO 0.02 0.08 0.18 0.08 -2.50 0.00 0.00 175.30 173.16 2npb s VAL 7 N -3.04 -0.19 0.30 7.11 1.01 -0.60 -1.41 120.40 123.57 2npb s VAL 7 Ca 0.13 -0.49 -0.29 0.00 0.00 0.00 0.00 61.98 61.34 2npb s VAL 7 Cb 0.01 -0.86 -0.10 0.00 0.00 0.00 0.00 36.38 35.43 2npb s VAL 7 CO 0.00 -0.50 1.27 -0.69 0.00 0.00 0.00 175.10 175.18 2npb s VAL 8 N 2.21 2.93 0.19 2.92 1.01 -0.58 -0.45 120.40 128.62 2npb s VAL 8 Ca 0.08 0.90 -0.22 0.00 0.00 0.00 0.00 61.98 62.74 2npb s VAL 8 Cb -0.15 -3.57 0.05 0.00 0.00 0.00 0.00 36.38 32.70 2npb s VAL 8 CO -0.27 0.20 0.60 -0.47 0.00 0.00 0.00 175.10 175.16 2npb s TYR 9 N -0.93 -0.40 -0.32 5.22 5.04 -1.21 -1.37 117.35 123.38 2npb s TYR 9 Ca 0.49 0.12 -0.29 0.00 -2.44 0.00 0.00 57.07 54.95 2npb s TYR 9 Cb -0.38 0.55 0.01 0.00 0.35 0.00 0.00 41.96 42.49 2npb s TYR 9 CO 0.48 -0.93 1.15 -1.54 -1.34 0.00 0.00 175.55 173.38 2npb s SER 10 N -2.80 6.84 0.00 4.32 1.04 -1.16 -0.46 113.70 121.47 2npb s SER 10 Ca 0.04 1.08 -0.02 0.00 0.48 0.00 0.00 55.95 57.54 2npb s SER 10 Cb -0.02 -2.54 -0.08 0.00 0.10 0.00 0.00 66.02 63.48 2npb s SER 10 CO -0.08 -0.96 1.59 0.61 0.98 0.00 0.00 173.24 175.38 2npb n GLY 11 N 4.05 1.77 1.83 7.32 0.00 -1.24 -4.77 105.19 114.15 2npb n GLY 11 Ca 0.13 -0.34 -0.02 0.00 0.00 0.00 0.00 46.02 45.80 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 2.31 3.20 -1.25 4.61 0.00 -1.26 -4.91 120.51 123.21 2npb n ALA 12 Ca 0.12 -0.24 0.17 0.00 0.00 0.00 0.00 53.44 53.49 2npb n ALA 12 Cb 0.36 -1.62 -0.04 0.00 0.00 0.00 0.00 19.45 18.15 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 -3.73 0.58 0.34 0.00 0.00 -1.26 -4.77 105.19 96.34 2npb n GLY 14 Ca 0.01 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.01 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 1.01 -0.14 1.61 -0.00 -1.93 -3.34 116.97 114.18 2npb h TYR 15 Ca 0.00 -0.02 0.05 0.00 -0.00 0.00 0.00 58.73 58.75 2npb h TYR 15 Cb 0.00 -0.32 -0.06 0.00 -0.00 0.00 0.00 36.73 36.34 2npb h TYR 15 CO 0.00 0.71 -0.33 -0.22 -0.00 0.00 0.00 178.16 178.32 2npb h LYS 16 N 1.03 -0.38 -0.38 0.10 3.11 -1.99 0.17 116.57 118.23 2npb h LYS 16 Ca 0.26 0.03 -0.08 0.00 -2.81 0.00 0.00 60.65 58.04 2npb h LYS 16 Cb 0.05 0.09 -0.02 0.00 -1.00 0.00 0.00 32.23 31.35 2npb h LYS 16 CO -0.04 -0.25 -0.11 -1.00 -2.81 0.00 0.00 179.45 175.24 2npb h PRO 17 N -0.40 0.66 -0.81 1.90 0.13 -1.99 -1.68 132.00 129.80 2npb h PRO 17 Ca 0.10 -0.20 -0.01 0.00 -0.87 0.00 0.00 66.00 65.02 2npb h PRO 17 Cb 0.55 -0.06 -0.04 0.00 0.13 0.00 0.00 31.00 31.58 2npb h PRO 17 CO -0.36 0.75 0.48 -0.22 -0.23 0.00 0.00 178.00 178.42 2npb h LYS 18 N 0.60 1.11 0.41 0.86 3.64 -1.45 -0.09 116.57 121.66 2npb h LYS 18 Ca 0.11 -0.11 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 2npb h LYS 18 Cb 0.54 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 32.11 2npb h LYS 18 CO 0.03 0.79 -0.30 1.88 -2.27 0.00 0.00 179.45 179.58 2npb h TYR 19 N 1.12 -0.81 -0.94 1.91 -1.99 -0.59 -3.04 116.97 112.63 2npb h TYR 19 Ca 0.29 -0.00 0.12 0.00 2.00 0.00 0.00 58.73 61.14 2npb h TYR 19 Cb -0.03 0.30 -0.08 0.00 2.00 0.00 0.00 36.73 38.91 2npb h TYR 19 CO -0.00 -0.45 0.57 -0.07 -0.00 0.00 0.00 178.16 178.20 2npb h LEU 20 N -0.71 0.80 -1.16 3.88 3.38 -1.04 -0.77 115.31 119.69 2npb h LEU 20 Ca -0.04 0.06 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 2npb h LEU 20 Cb 0.60 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.22 2npb h LEU 20 CO 0.01 0.41 0.46 -0.61 0.09 0.00 0.00 178.44 178.80 2npb h GLN 21 N 0.88 1.03 -0.01 1.13 4.15 -0.90 0.42 115.11 121.80 2npb h GLN 21 Ca 0.48 -0.09 -0.04 0.00 0.77 0.00 0.00 58.65 59.77 2npb h GLN 21 Cb 0.51 -0.22 0.00 0.00 0.21 0.00 0.00 27.48 27.99 2npb h GLN 21 CO -0.28 0.72 -0.13 1.25 -1.93 0.00 0.00 178.83 178.46 2npb h LEU 22 N 1.05 0.14 0.38 -2.39 5.85 -1.45 -3.37 115.31 115.52 2npb h LEU 22 Ca 0.28 -0.71 -0.02 0.00 0.84 0.00 0.00 57.88 58.26 2npb h LEU 22 Cb -0.05 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 40.95 2npb h LEU 22 CO -0.05 0.83 -0.18 0.11 -0.34 0.00 0.00 178.44 178.81 2npb h LYS 23 N -0.54 -0.49 -0.83 1.25 1.57 -0.41 -3.06 116.57 114.06 2npb h LYS 23 Ca -0.01 0.03 0.17 0.00 -1.87 0.00 0.00 60.65 58.97 2npb h LYS 23 Cb 0.84 0.11 -0.16 0.00 0.08 0.00 0.00 32.23 33.10 2npb h LYS 23 CO 0.03 -0.22 -0.19 -1.91 -0.57 0.00 0.00 179.45 176.58 2npb n GLU 24 N -5.23 -0.07 0.09 3.15 0.00 0.14 -0.68 120.64 118.04 2npb n GLU 24 Ca -0.10 1.30 -0.13 0.00 0.00 0.00 0.00 57.16 58.22 2npb n GLU 24 Cb 0.26 -1.95 -0.07 0.00 0.00 0.00 0.00 31.44 29.68 2npb n GLU 24 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.13 176.91 2npb h LYS 25 N 0.00 -0.14 0.33 5.31 1.63 -1.70 0.14 116.57 122.14 2npb h LYS 25 Ca 0.41 0.01 -0.02 0.00 -0.85 0.00 0.00 60.65 60.20 2npb h LYS 25 Cb 0.64 0.03 0.00 0.00 -0.60 0.00 0.00 32.23 32.30 2npb h LYS 25 CO -0.85 -0.09 -0.16 -0.07 -3.45 0.00 0.00 179.45 174.83 2npb h LEU 26 N -0.15 -0.37 -1.95 5.20 -0.00 -1.16 -0.81 115.31 116.07 2npb h LEU 26 Ca -0.01 -0.11 -0.00 0.00 -0.00 0.00 0.00 57.88 57.75 2npb h LEU 26 Cb 0.11 0.10 -0.00 0.00 -0.00 0.00 0.00 40.66 40.87 2npb h LEU 26 CO 0.02 -0.10 0.02 -0.33 -0.00 0.00 0.00 178.44 178.06 2npb h GLU 27 N -0.65 0.06 -0.42 1.13 5.08 -0.94 0.56 114.58 119.40 2npb h GLU 27 Ca -0.05 -0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.18 2npb h GLU 27 Cb 0.46 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 2npb h GLU 27 CO 0.07 0.04 -0.26 1.25 -1.00 0.00 0.00 179.01 179.11 2npb h HIS 28 N 0.06 1.06 -0.19 4.33 2.76 -0.60 -2.29 115.15 120.29 2npb h HIS 28 Ca 0.02 -0.28 -0.07 0.00 -2.20 0.00 0.00 60.37 57.83 2npb h HIS 28 Cb 0.00 -0.24 -0.01 0.00 1.55 0.00 0.00 27.41 28.71 2npb h HIS 28 CO 0.00 1.09 -0.21 0.93 -1.30 0.00 0.00 177.93 178.44 2npb h GLU 29 N 0.74 0.32 -1.34 5.26 4.39 -0.38 -3.37 114.58 120.20 2npb h GLU 29 Ca 0.09 -0.10 -0.43 0.00 0.34 0.00 0.00 59.36 59.25 2npb h GLU 29 Cb 0.84 -0.03 -0.40 0.00 -0.10 0.00 0.00 28.75 29.05 2npb h GLU 29 CO 0.07 0.53 -1.09 1.19 -1.16 0.00 0.00 179.01 178.54 2npb n PHE 30 N -4.18 1.49 -2.00 4.33 3.72 0.12 -5.08 117.46 115.86 2npb n PHE 30 Ca -0.01 -3.10 -0.43 0.00 -0.05 0.00 0.00 57.45 53.87 2npb n PHE 30 Cb 0.35 -0.34 -0.03 0.00 -0.94 0.00 0.00 39.48 38.52 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 -3.08 3.74 0.00 -1.08 0.04 -0.86 -1.32 135.00 132.44 2npb s PRO 31 Ca 0.34 1.81 0.00 0.00 0.04 0.00 0.00 61.00 63.19 2npb s PRO 31 Cb 0.42 -4.10 0.00 0.00 0.04 0.00 0.00 34.50 30.87 2npb s PRO 31 CO -0.03 -1.37 0.00 0.41 0.04 0.00 0.00 177.00 176.05 2npb n GLY 32 N 4.80 0.00 0.09 0.56 0.00 -1.26 -4.74 105.19 104.63 2npb n GLY 32 Ca 0.20 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.32 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 2.39 -0.04 0.00 1.02 -0.89 -1.64 118.68 115.53 2npb s LEU 34 Ca 0.04 -0.79 -0.01 0.00 0.02 0.00 0.00 54.13 53.39 2npb s LEU 34 Cb 0.08 -0.11 -0.04 0.00 0.02 0.00 0.00 46.19 46.15 2npb s LEU 34 CO 0.31 -0.34 0.06 -0.62 0.02 0.00 0.00 176.35 175.77 2npb s ASP 35 N -2.35 5.57 -0.05 2.29 2.15 -0.03 -4.91 116.67 119.34 2npb s ASP 35 Ca 0.01 0.17 -0.02 0.00 0.43 0.00 0.00 52.55 53.14 2npb s ASP 35 Cb -0.02 -1.60 0.04 0.00 -0.30 0.00 0.00 42.92 41.03 2npb s ASP 35 CO -0.02 0.32 0.10 -0.63 -0.17 0.00 0.00 175.17 174.77 2npb s ILE 36 N -1.07 -0.09 0.34 4.11 1.01 -1.26 -1.07 121.20 123.17 2npb s ILE 36 Ca 0.19 0.25 0.03 0.00 0.00 0.00 0.00 60.65 61.12 2npb s ILE 36 Cb -0.12 -0.19 -0.01 0.00 0.01 0.00 0.00 42.46 42.15 2npb s ILE 36 CO 0.09 0.10 0.12 0.00 0.00 0.00 0.00 174.94 175.25 2npb s GLY 38 N -3.09 1.63 -0.53 0.00 0.00 -1.26 -1.56 107.32 102.51 2npb s GLY 38 Ca 0.18 -1.80 0.06 0.00 0.00 0.00 0.00 44.72 43.15 2npb s GLY 38 CO 0.12 -1.69 0.51 1.18 0.00 0.00 0.00 173.10 173.22 2npb n GLU 39 N -0.46 1.22 -2.45 2.90 -0.58 0.41 -4.79 120.64 116.89 2npb n GLU 39 Ca -0.05 -3.82 -0.42 0.00 -0.42 0.00 0.00 57.16 52.45 2npb n GLU 39 Cb 0.64 -1.82 -0.02 0.00 -0.57 0.00 0.00 31.44 29.66 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 -1.18 1.01 0.60 0.62 0.00 -1.26 -3.30 107.32 103.81 2npb s GLY 40 Ca 0.33 -0.61 -0.18 0.00 0.00 0.00 0.00 44.72 44.26 2npb s GLY 40 CO -0.13 2.69 1.16 -0.51 0.00 0.00 0.00 173.10 176.32 2npb s THR 41 N 5.56 2.91 -1.09 0.90 -4.23 0.39 -4.74 115.64 115.34 2npb s THR 41 Ca 0.51 0.53 -0.18 0.00 -1.18 0.00 0.00 61.69 61.37 2npb s THR 41 Cb -0.10 -3.16 -0.07 0.00 1.34 0.00 0.00 72.50 70.52 2npb s THR 41 CO 0.27 -0.16 2.08 -0.81 -0.54 0.00 0.00 174.62 175.46 2npb n PRO 42 N -1.74 2.15 0.00 3.99 -0.04 -1.26 -3.63 135.00 134.47 2npb n PRO 42 Ca 0.12 -2.18 0.00 0.00 -0.04 0.00 0.00 63.50 61.40 2npb n PRO 42 Cb 0.51 -3.07 0.00 0.00 -0.04 0.00 0.00 33.50 30.89 2npb n PRO 42 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 2npb n GLN 43 N 6.49 0.00 -1.72 0.54 7.27 -1.26 -4.94 117.38 123.76 2npb n GLN 43 Ca 0.51 0.00 -0.39 0.00 0.07 0.00 0.00 57.00 57.19 2npb n GLN 43 Cb 0.39 -1.92 0.03 0.00 2.41 0.00 0.00 30.24 31.15 2npb n GLN 43 CO 0.00 0.00 0.00 1.55 0.07 0.00 0.00 177.06 178.68 2npb n VAL 44 N -0.04 3.35 -4.10 1.69 3.14 -1.26 -4.06 118.33 117.04 2npb n VAL 44 Ca 0.00 -0.50 -0.31 0.00 -2.96 0.00 0.00 64.34 60.57 2npb n VAL 44 Cb 0.00 -1.63 -0.06 0.00 -1.06 0.00 0.00 33.84 31.09 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 -0.76 -1.23 0.42 1.55 -2.24 -1.26 -4.77 114.28 105.98 2npb n THR 45 Ca 0.09 -0.46 0.00 0.00 -2.27 0.00 0.00 64.05 61.41 2npb n THR 45 Cb 0.43 -1.15 0.00 0.00 -2.10 0.00 0.00 70.33 67.51 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 -2.31 0.72 3.74 3.38 0.00 -1.26 -4.78 105.19 104.68 2npb n GLY 46 Ca -0.25 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.36 2npb n GLY 46 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2npb n PHE 47 N 0.50 2.66 -2.99 1.61 3.72 -1.26 -3.00 117.46 118.69 2npb n PHE 47 Ca 0.00 0.48 -0.44 0.00 -0.05 0.00 0.00 57.45 57.43 2npb n PHE 47 Cb 0.15 -2.49 -0.03 0.00 -0.94 0.00 0.00 39.48 36.17 2npb n PHE 47 CO 0.00 0.00 0.00 0.12 -0.05 0.00 0.00 176.76 176.83 2npb s PHE 48 N -0.99 3.11 -0.21 1.38 2.19 -1.25 -3.41 117.98 118.80 2npb s PHE 48 Ca 0.55 -1.27 0.02 0.00 0.33 0.00 0.00 56.93 56.56 2npb s PHE 48 Cb -0.52 -4.19 0.04 0.00 -1.31 0.00 0.00 43.02 37.04 2npb s PHE 48 CO 0.62 -1.42 -0.15 -1.21 1.83 0.00 0.00 175.22 174.89 2npb s GLU 49 N 2.59 2.51 -0.18 10.12 0.41 -0.47 -1.28 118.70 132.39 2npb s GLU 49 Ca 0.26 -0.99 -0.04 0.00 -0.41 0.00 0.00 54.97 53.78 2npb s GLU 49 Cb -0.10 -2.63 -0.02 0.00 -1.78 0.00 0.00 34.13 29.60 2npb s GLU 49 CO -0.04 -0.38 -0.03 0.08 -0.49 0.00 0.00 175.26 174.41 2npb s VAL 50 N 1.26 3.82 -0.04 2.63 1.01 -0.30 -1.53 120.40 127.24 2npb s VAL 50 Ca -0.01 -0.37 0.04 0.00 0.00 0.00 0.00 61.98 61.64 2npb s VAL 50 Cb -0.16 -2.70 0.00 0.00 0.00 0.00 0.00 36.38 33.52 2npb s VAL 50 CO -0.09 0.46 -0.15 0.42 0.00 0.00 0.00 175.10 175.73 2npb s THR 51 N 0.78 1.29 -0.18 3.92 -4.23 -0.50 -0.85 115.64 115.87 2npb s THR 51 Ca -0.01 -0.63 0.01 0.00 -1.18 0.00 0.00 61.69 59.88 2npb s THR 51 Cb -0.14 -1.12 0.02 0.00 1.34 0.00 0.00 72.50 72.59 2npb s THR 51 CO 0.02 0.38 -0.20 0.54 -0.54 0.00 0.00 174.62 174.82 2npb s VAL 52 N 0.16 2.07 -1.00 2.29 0.11 0.00 -0.93 120.40 123.09 2npb s VAL 52 Ca -0.05 -0.95 0.00 0.00 -2.93 0.00 0.00 61.98 58.05 2npb s VAL 52 Cb -0.12 -1.87 0.00 0.00 -1.53 0.00 0.00 36.38 32.86 2npb s VAL 52 CO 0.02 0.53 0.00 0.00 -3.33 0.00 0.00 175.10 172.32 2npb n ALA 53 N 4.62 -0.18 0.00 1.54 0.00 -0.04 -0.57 120.51 125.87 2npb n ALA 53 Ca -0.21 0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2npb n ALA 53 Cb 0.50 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.86 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 -0.21 0.27 3.59 0.00 0.00 -1.26 -5.07 105.19 102.51 2npb n GLY 54 Ca -0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.49 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 -0.90 3.67 0.26 1.61 -0.14 0.26 -5.01 119.74 119.49 2npb s LYS 55 Ca 0.00 0.45 -0.30 0.00 -1.36 0.00 0.00 55.97 54.76 2npb s LYS 55 Cb 0.00 -3.92 -0.10 0.00 -1.68 0.00 0.00 37.83 32.13 2npb s LYS 55 CO 0.00 -1.35 1.50 -1.17 -0.76 0.00 0.00 175.35 173.57 2npb s LEU 56 N 4.29 4.37 -0.00 3.17 0.20 -1.26 -0.82 118.68 128.63 2npb s LEU 56 Ca 0.45 2.76 0.00 0.00 0.69 0.00 0.00 54.13 58.03 2npb s LEU 56 Cb -0.08 -3.62 -0.00 0.00 -0.43 0.00 0.00 46.19 42.06 2npb s LEU 56 CO 0.30 -0.78 0.00 0.52 -0.29 0.00 0.00 176.35 176.10 2npb n VAL 57 N 2.41 0.01 -4.12 1.68 0.31 -0.03 -4.95 118.33 113.63 2npb n VAL 57 Ca 0.08 -0.00 -0.15 0.00 -0.01 0.00 0.00 64.34 64.25 2npb n VAL 57 Cb 0.39 -0.61 -0.12 0.00 -0.91 0.00 0.00 33.84 32.59 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 -2.00 0.87 -0.30 3.52 5.65 -1.13 -5.00 115.29 116.90 2npb s HIS 58 Ca -0.00 -0.46 -0.03 0.00 0.25 0.00 0.00 55.06 54.83 2npb s HIS 58 Cb 0.00 -0.51 0.19 0.00 -1.18 0.00 0.00 32.58 31.08 2npb s HIS 58 CO 0.00 -0.03 0.66 0.45 -0.65 0.00 0.00 174.74 175.17 2npb s SER 59 N -1.53 -1.27 0.40 9.88 0.15 -1.25 -1.15 113.70 118.93 2npb s SER 59 Ca -0.06 0.81 0.10 0.00 0.70 0.00 0.00 55.95 57.49 2npb s SER 59 Cb -0.09 2.07 0.84 0.00 -1.71 0.00 0.00 66.02 67.13 2npb s SER 59 CO 0.01 -0.24 1.96 0.11 1.20 0.00 0.00 173.24 176.28 2npb h LYS 60 N 8.00 0.25 0.00 5.44 1.79 -1.40 -1.43 116.57 129.22 2npb h LYS 60 Ca -0.22 -0.05 -0.15 0.00 -2.18 0.00 0.00 60.65 58.05 2npb h LYS 60 Cb 1.16 -0.04 -0.02 0.00 -1.58 0.00 0.00 32.23 31.75 2npb h LYS 60 CO 0.21 0.34 -0.71 1.57 -1.08 0.00 0.00 179.45 179.78 2npb h LYS 61 N 0.25 0.00 0.00 3.15 5.09 -1.94 -3.05 116.57 120.06 2npb h LYS 61 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.79 2npb h LYS 61 Cb 0.28 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.61 2npb h LYS 61 CO 0.01 0.71 0.00 0.07 -2.09 0.00 0.00 179.45 178.16 2npb h ARG 62 N 0.00 0.00 0.00 0.07 -0.00 -1.95 -3.47 114.38 109.03 2npb h ARG 62 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.97 2npb h ARG 62 Cb 1.37 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 31.34 2npb h ARG 62 CO 0.09 0.00 0.00 0.41 -0.00 0.00 0.00 179.97 180.47 2npb n GLY 63 N 0.38 1.54 0.20 0.08 0.00 -1.14 -5.01 105.19 101.24 2npb n GLY 63 Ca 0.02 -0.09 0.04 0.00 0.00 0.00 0.00 46.02 46.00 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 0.00 1.61 3.58 -1.48 -3.50 116.42 116.64 2npb h ASP 64 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2npb h ASP 64 Cb 0.06 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.11 2npb h ASP 64 CO 0.00 0.30 0.00 0.61 -2.88 0.00 0.00 179.24 177.27 2npb n GLY 65 N -0.62 -1.13 0.00 -0.78 0.00 -1.26 -4.98 105.19 96.42 2npb n GLY 65 Ca -0.02 -2.06 0.00 0.00 0.00 0.00 0.00 46.02 43.94 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 0.00 -0.01 -1.69 1.61 4.01 -1.26 -4.41 117.16 115.40 2npb n TYR 66 Ca 0.00 0.00 -0.39 0.00 -0.16 0.00 0.00 57.90 57.35 2npb n TYR 66 Cb 0.00 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 38.99 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 -0.00 2.46 1.05 -0.72 0.24 -1.26 -4.69 118.33 115.40 2npb n VAL 67 Ca 0.00 -2.32 0.14 0.00 -2.04 0.00 0.00 64.34 60.12 2npb n VAL 67 Cb 0.00 -2.34 0.62 0.00 -1.47 0.00 0.00 33.84 30.65 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 9.06 0.02 -3.57 -1.34 8.00 -1.26 -4.81 116.55 122.66 2npb n ASP 68 Ca 0.49 0.40 -0.11 0.00 0.71 0.00 0.00 54.79 56.28 2npb n ASP 68 Cb 0.42 -0.45 -0.02 0.00 -0.02 0.00 0.00 41.12 41.05 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 -2.95 0.01 0.34 -3.53 2.01 -1.26 -5.01 115.64 105.24 2npb s THR 69 Ca 0.15 -0.36 0.01 0.00 0.31 0.00 0.00 61.69 61.81 2npb s THR 69 Cb 0.19 -1.29 0.24 0.00 0.01 0.00 0.00 72.50 71.65 2npb s THR 69 CO 0.53 -0.04 1.97 -0.33 -0.69 0.00 0.00 174.62 176.06 2npb h GLU 70 N 2.06 0.84 0.00 4.92 4.39 -2.00 -1.31 114.58 123.49 2npb h GLU 70 Ca -0.30 -0.07 -0.05 0.00 0.34 0.00 0.00 59.36 59.28 2npb h GLU 70 Cb 1.29 -0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 29.75 2npb h GLU 70 CO 0.36 0.60 -0.22 1.03 -1.16 0.00 0.00 179.01 179.62 2npb h SER 71 N 0.86 0.00 0.38 1.42 0.87 -1.98 0.15 113.55 115.25 2npb h SER 71 Ca 0.22 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.77 2npb h SER 71 Cb -0.03 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.94 2npb h SER 71 CO -0.04 0.22 -0.18 0.50 -0.53 0.00 0.00 176.83 176.80 2npb h LYS 72 N 0.00 -0.49 -0.09 2.24 1.63 -1.65 -2.95 116.57 115.26 2npb h LYS 72 Ca -0.00 0.03 0.02 0.00 -0.85 0.00 0.00 60.65 59.85 2npb h LYS 72 Cb 0.44 0.11 -0.02 0.00 -0.60 0.00 0.00 32.23 32.16 2npb h LYS 72 CO 0.03 -0.20 -0.06 0.35 -3.45 0.00 0.00 179.45 176.12 2npb h PHE 73 N -0.75 -0.14 0.00 1.91 3.57 -0.80 -2.80 116.94 117.94 2npb h PHE 73 Ca -0.05 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.46 2npb h PHE 73 Cb 0.51 0.08 -0.00 0.00 2.79 0.00 0.00 35.95 39.33 2npb h PHE 73 CO 0.00 -0.09 -0.01 -0.09 -2.23 0.00 0.00 178.31 175.89 2npb h ARG 74 N -0.06 0.00 -0.42 1.11 2.43 -0.83 -0.66 114.38 115.94 2npb h ARG 74 Ca 0.06 0.00 0.07 0.00 -0.81 0.00 0.00 59.98 59.29 2npb h ARG 74 Cb 0.14 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 29.64 2npb h ARG 74 CO -0.13 0.01 0.09 -0.22 -1.51 0.00 0.00 179.97 178.21 2npb h LYS 75 N 0.00 0.21 -0.00 0.20 1.63 -1.31 0.41 116.57 117.72 2npb h LYS 75 Ca -0.00 -0.01 -0.15 0.00 -0.85 0.00 0.00 60.65 59.64 2npb h LYS 75 Cb 0.02 -0.05 0.01 0.00 -0.60 0.00 0.00 32.23 31.61 2npb h LYS 75 CO 0.00 0.14 -0.58 1.25 -3.45 0.00 0.00 179.45 176.81 2npb h LEU 76 N 0.22 0.52 -0.55 5.20 6.46 -1.24 -2.53 115.31 123.39 2npb h LEU 76 Ca 0.21 -0.76 0.09 0.00 -0.12 0.00 0.00 57.88 57.30 2npb h LEU 76 Cb 0.25 -0.16 -0.07 0.00 -0.73 0.00 0.00 40.66 39.95 2npb h LEU 76 CO -0.27 1.21 0.15 0.58 -0.62 0.00 0.00 178.44 179.49 2npb h VAL 77 N -0.12 0.72 -0.72 1.05 2.07 -1.25 0.49 116.25 118.49 2npb h VAL 77 Ca -0.07 -0.10 -0.05 0.00 0.82 0.00 0.00 66.70 67.30 2npb h VAL 77 Cb 1.29 0.40 -0.03 0.00 -1.52 0.00 0.00 31.29 31.43 2npb h VAL 77 CO 0.11 0.05 0.25 0.74 0.02 0.00 0.00 177.57 178.75 2npb h THR 78 N 0.30 1.25 0.01 2.57 2.02 -0.92 -0.55 112.91 117.58 2npb h THR 78 Ca 0.28 -0.85 -0.19 0.00 0.77 0.00 0.00 66.41 66.42 2npb h THR 78 Cb 0.37 0.43 -0.02 0.00 -1.74 0.00 0.00 68.15 67.19 2npb h THR 78 CO -0.33 0.34 -0.89 0.00 0.37 0.00 0.00 175.52 175.00 2npb h ALA 79 N 1.21 0.53 -0.09 6.16 0.00 -0.85 -1.81 119.26 124.40 2npb h ALA 79 Ca 0.24 -0.78 -0.21 0.00 0.00 0.00 0.00 54.91 54.15 2npb h ALA 79 Cb 0.26 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2npb h ALA 79 CO -0.01 1.04 -0.81 0.82 0.00 0.00 0.00 179.25 180.29 2npb h ILE 80 N 0.03 1.33 -0.61 0.00 1.08 -0.83 -0.90 117.51 117.61 2npb h ILE 80 Ca -0.02 -2.12 -0.04 0.00 -0.39 0.00 0.00 64.86 62.29 2npb h ILE 80 Cb 1.56 2.12 -0.03 0.00 -3.07 0.00 0.00 36.82 37.40 2npb h ILE 80 CO 0.12 0.65 0.24 0.50 -0.69 0.00 0.00 178.15 178.98 2npb h LYS 81 N 0.39 0.91 -0.21 2.37 3.64 -0.95 0.14 116.57 122.86 2npb h LYS 81 Ca -0.06 -0.17 -0.07 0.00 -1.27 0.00 0.00 60.65 59.09 2npb h LYS 81 Cb 1.42 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 33.09 2npb h LYS 81 CO 0.15 0.77 -0.13 0.00 -2.27 0.00 0.00 179.45 177.98 2npb h ALA 82 N 1.09 0.30 -0.84 5.00 0.00 -1.35 -2.22 119.26 121.24 2npb h ALA 82 Ca 0.20 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 2npb h ALA 82 Cb 0.20 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 2npb h ALA 82 CO -0.02 0.16 0.49 0.00 0.00 0.00 0.00 179.25 179.89 2npb h ALA 83 N 0.69 1.28 0.56 0.00 0.00 -0.96 -2.89 119.26 117.94 2npb h ALA 83 Ca 0.04 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 2npb h ALA 83 Cb 0.64 -0.34 0.01 0.00 0.00 0.00 0.00 17.79 18.09 2npb h ALA 83 CO 0.04 0.60 -0.27 1.25 0.00 0.00 0.00 179.25 180.87 2npb h LEU 84 N 1.16 -0.63 -2.73 0.00 7.12 -0.69 -1.26 115.31 118.28 2npb h LEU 84 Ca 0.30 -0.03 -0.00 0.00 0.13 0.00 0.00 57.88 58.28 2npb h LEU 84 Cb -0.02 0.16 -0.00 0.00 -0.53 0.00 0.00 40.66 40.27 2npb h LEU 84 CO -0.05 -0.35 -0.00 0.00 -0.13 0.00 0.00 178.44 177.91 2npb h ALA 85 N -0.55 1.27 0.04 1.25 0.00 -1.39 0.48 119.26 120.35 2npb h ALA 85 Ca -0.08 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 2npb h ALA 85 Cb 0.63 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.42 2npb h ALA 85 CO 0.13 0.00 -0.02 0.37 0.00 0.00 0.00 179.25 179.73 2npb h GLN 86 N 0.00 -0.05 0.00 0.00 4.15 -1.36 -3.32 115.11 114.53 2npb h GLN 86 Ca -0.00 0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.42 2npb h GLN 86 Cb 0.00 0.01 -0.00 0.00 0.21 0.00 0.00 27.48 27.70 2npb h GLN 86 CO 0.00 0.56 -0.02 0.00 -1.93 0.00 0.00 178.83 177.44