#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pyb s LEU 6 N 0.00 0.11 -0.96 0.00 1.43 -1.26 -5.07 118.68 112.93 1pyb s LEU 6 Ca 0.00 0.19 -0.24 0.00 -1.03 0.00 0.00 54.13 53.05 1pyb s LEU 6 Cb 0.00 1.95 -0.02 0.00 0.03 0.00 0.00 46.19 48.15 1pyb s LEU 6 CO 0.00 -0.65 1.81 -0.63 0.23 0.00 0.00 176.35 177.11 1pyb s ILE 7 N -2.10 3.60 -0.33 -0.59 1.01 -1.26 -4.81 121.20 116.71 1pyb s ILE 7 Ca -0.07 -0.55 0.00 0.00 0.00 0.00 0.00 60.65 60.03 1pyb s ILE 7 Cb -0.01 -4.36 0.00 0.00 0.01 0.00 0.00 42.46 38.10 1pyb s ILE 7 CO 0.01 -1.25 0.70 0.61 0.00 0.00 0.00 174.94 175.01 1pyb n GLY 8 N 6.76 1.53 0.25 6.18 0.00 -1.26 -4.22 105.19 114.43 1pyb n GLY 8 Ca 0.39 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.31 1pyb n GLY 8 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1pyb h ILE 9 N 0.11 0.00 0.00 -0.61 2.04 -2.01 -2.47 117.51 114.57 1pyb h ILE 9 Ca 0.00 -0.06 -0.10 0.00 1.00 0.00 0.00 64.86 65.70 1pyb h ILE 9 Cb 0.70 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.76 1pyb h ILE 9 CO 0.00 0.00 -0.50 -0.33 0.00 0.00 0.00 178.15 177.32 1pyb h GLU 10 N -0.68 0.00 -0.20 2.37 5.08 -2.02 -3.20 114.58 115.94 1pyb h GLU 10 Ca -0.06 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.23 1pyb h GLU 10 Cb 0.47 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 1pyb h GLU 10 CO 0.10 0.50 -0.16 -0.44 -1.00 0.00 0.00 179.01 178.01 1pyb h ASP 11 N 0.00 0.32 -0.44 1.42 3.32 -1.77 -2.56 116.42 116.71 1pyb h ASP 11 Ca -0.00 -0.08 -0.03 0.00 0.02 0.00 0.00 57.03 56.94 1pyb h ASP 11 Cb 1.08 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 40.52 1pyb h ASP 11 CO 0.06 0.50 0.17 0.15 -1.72 0.00 0.00 179.24 178.41 1pyb h PHE 12 N 0.31 0.71 -0.49 4.55 3.57 -1.43 -1.09 116.94 123.07 1pyb h PHE 12 Ca 0.06 -0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.51 1pyb h PHE 12 Cb 0.46 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.96 1pyb h PHE 12 CO 0.01 0.57 0.28 -0.07 -2.23 0.00 0.00 178.31 176.87 1pyb h LEU 13 N 0.70 0.59 -1.19 0.59 3.38 -1.60 -0.38 115.31 117.41 1pyb h LEU 13 Ca 0.17 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1pyb h LEU 13 Cb 0.18 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1pyb h LEU 13 CO -0.01 0.48 0.00 0.11 0.09 0.00 0.00 178.44 179.10 1pyb h LYS 14 N 0.68 0.00 -2.92 1.13 1.57 -1.21 -3.32 116.57 112.50 1pyb h LYS 14 Ca 0.18 0.00 -0.73 0.00 -1.87 0.00 0.00 60.65 58.22 1pyb h LYS 14 Cb 0.01 0.00 -0.33 0.00 0.08 0.00 0.00 32.23 31.98 1pyb h LYS 14 CO -0.03 0.00 0.20 0.28 -0.57 0.00 0.00 179.45 179.33 1pyb n VAL 15 N -2.88 3.97 -1.85 0.50 0.31 -0.15 -4.90 118.33 113.33 1pyb n VAL 15 Ca 0.01 -5.50 -0.24 0.00 -0.01 0.00 0.00 64.34 58.59 1pyb n VAL 15 Cb 0.30 -2.22 -0.05 0.00 -0.91 0.00 0.00 33.84 30.96 1pyb n VAL 15 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 1pyb s ASP 16 N -1.20 4.68 -0.18 4.52 1.01 -1.25 -4.92 116.67 119.33 1pyb s ASP 16 Ca 0.32 -0.17 -0.25 0.00 0.71 0.00 0.00 52.55 53.16 1pyb s ASP 16 Cb 0.03 -2.55 -0.01 0.00 1.01 0.00 0.00 42.92 41.39 1pyb s ASP 16 CO -0.00 -3.09 0.82 -0.76 0.21 0.00 0.00 175.17 172.35 1pyb s LEU 17 N 11.70 4.16 0.01 1.23 1.43 -1.26 -1.15 118.68 134.80 1pyb s LEU 17 Ca 0.79 1.14 0.03 0.00 -1.03 0.00 0.00 54.13 55.07 1pyb s LEU 17 Cb -0.10 -3.22 -0.01 0.00 0.03 0.00 0.00 46.19 42.89 1pyb s LEU 17 CO 0.07 -0.41 -0.10 -0.13 0.23 0.00 0.00 176.35 176.01 1pyb s ARG 18 N 2.23 0.79 0.11 1.70 0.52 0.48 -2.10 118.95 122.68 1pyb s ARG 18 Ca 0.37 -0.47 -0.16 0.00 -0.52 0.00 0.00 55.73 54.95 1pyb s ARG 18 Cb -0.16 -0.75 -0.07 0.00 0.52 0.00 0.00 34.95 34.49 1pyb s ARG 18 CO 0.12 0.20 0.54 0.08 0.02 0.00 0.00 175.30 176.26 1pyb s VAL 19 N -0.47 4.83 0.16 3.52 1.01 -0.79 -0.91 120.40 127.74 1pyb s VAL 19 Ca 0.02 0.97 -0.11 0.00 0.00 0.00 0.00 61.98 62.86 1pyb s VAL 19 Cb -0.05 -3.79 0.00 0.00 0.00 0.00 0.00 36.38 32.54 1pyb s VAL 19 CO 0.00 0.38 0.32 0.00 0.00 0.00 0.00 175.10 175.80 1pyb s ALA 20 N -1.31 -0.26 0.13 5.51 0.00 -0.30 0.05 121.76 125.58 1pyb s ALA 20 Ca 0.33 -0.67 0.06 0.00 0.00 0.00 0.00 51.96 51.68 1pyb s ALA 20 Cb -0.17 0.79 -0.04 0.00 0.00 0.00 0.00 23.12 23.71 1pyb s ALA 20 CO 0.19 -0.66 0.01 0.15 0.00 0.00 0.00 175.76 175.45 1pyb s LYS 21 N -3.92 2.52 -0.33 0.00 1.02 -1.24 -0.87 119.74 116.90 1pyb s LYS 21 Ca 0.13 -0.95 -0.17 0.00 0.02 0.00 0.00 55.97 54.99 1pyb s LYS 21 Cb 0.03 -2.48 -0.01 0.00 -0.52 0.00 0.00 37.83 34.85 1pyb s LYS 21 CO -0.03 0.50 0.48 0.08 -0.92 0.00 0.00 175.35 175.47 1pyb s VAL 22 N -1.52 5.05 -0.02 3.17 1.01 -1.18 -1.15 120.40 125.76 1pyb s VAL 22 Ca 0.27 0.38 -0.21 0.00 0.00 0.00 0.00 61.98 62.42 1pyb s VAL 22 Cb -0.11 -3.91 -0.27 0.00 0.00 0.00 0.00 36.38 32.09 1pyb s VAL 22 CO 0.19 -0.14 1.01 -0.07 0.00 0.00 0.00 175.10 176.09 1pyb h LEU 23 N 8.98 0.50 0.00 3.92 3.38 -1.46 -0.43 115.31 130.20 1pyb h LEU 23 Ca -0.28 -0.84 0.11 0.00 0.09 0.00 0.00 57.88 56.95 1pyb h LEU 23 Cb 1.13 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.70 1pyb h LEU 23 CO 0.75 1.29 0.45 -1.54 0.09 0.00 0.00 178.44 179.47 1pyb n SER 24 N -4.18 -1.46 -3.86 -0.43 3.41 -1.26 -4.83 113.62 101.01 1pyb n SER 24 Ca -0.12 -1.81 -0.15 0.00 -0.26 0.00 0.00 58.87 56.53 1pyb n SER 24 Cb 0.73 2.39 -0.15 0.00 -0.26 0.00 0.00 64.21 66.92 1pyb n SER 24 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1pyb s ALA 25 N -1.84 0.24 -0.06 7.33 0.00 -1.26 -1.01 121.76 125.17 1pyb s ALA 25 Ca 0.18 0.05 -0.15 0.00 0.00 0.00 0.00 51.96 52.04 1pyb s ALA 25 Cb -0.03 -0.19 -0.05 0.00 0.00 0.00 0.00 23.12 22.86 1pyb s ALA 25 CO 0.05 -0.02 0.40 -1.21 0.00 0.00 0.00 175.76 174.99 1pyb s GLU 26 N 0.52 4.07 0.13 0.00 2.02 -0.23 -4.90 118.70 120.31 1pyb s GLU 26 Ca -0.05 0.36 0.10 0.00 0.02 0.00 0.00 54.97 55.41 1pyb s GLU 26 Cb -0.08 -3.31 -0.04 0.00 0.10 0.00 0.00 34.13 30.80 1pyb s GLU 26 CO -0.01 0.48 -0.25 -0.98 0.02 0.00 0.00 175.26 174.53 1pyb s ARG 27 N -0.39 1.51 0.10 1.61 3.03 -1.26 -2.86 118.95 120.69 1pyb s ARG 27 Ca 0.23 -1.30 0.06 0.00 2.03 0.00 0.00 55.73 56.74 1pyb s ARG 27 Cb -0.16 -1.96 -0.04 0.00 -1.03 0.00 0.00 34.95 31.77 1pyb s ARG 27 CO 0.11 0.46 -0.02 0.08 -1.13 0.00 0.00 175.30 174.80 1pyb s VAL 28 N -1.08 3.85 -0.26 4.99 1.01 -1.26 -5.08 120.40 122.56 1pyb s VAL 28 Ca 0.15 -1.09 -0.29 0.00 0.00 0.00 0.00 61.98 60.75 1pyb s VAL 28 Cb -0.10 -2.84 -0.02 0.00 0.00 0.00 0.00 36.38 33.43 1pyb s VAL 28 CO 0.07 0.09 1.56 -1.61 0.00 0.00 0.00 175.10 175.21 1pyb s GLU 29 N -2.35 3.75 0.00 2.72 2.02 -1.26 -3.95 118.70 119.63 1pyb s GLU 29 Ca 0.25 1.50 0.00 0.00 0.02 0.00 0.00 54.97 56.74 1pyb s GLU 29 Cb -0.11 -4.02 0.00 0.00 0.10 0.00 0.00 34.13 30.10 1pyb s GLU 29 CO 0.17 -1.34 0.00 0.41 0.02 0.00 0.00 175.26 174.52 1pyb n GLY 30 N 4.71 2.38 3.69 -1.39 0.00 -1.26 -5.01 105.19 108.31 1pyb n GLY 30 Ca 0.18 -0.49 -0.42 0.00 0.00 0.00 0.00 46.02 45.29 1pyb n GLY 30 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1pyb s SER 31 N 0.00 6.51 0.80 1.61 1.04 -1.25 -4.99 113.70 117.42 1pyb s SER 31 Ca 0.00 2.63 -0.12 0.00 0.48 0.00 0.00 55.95 58.94 1pyb s SER 31 Cb 0.00 -2.57 0.07 0.00 0.10 0.00 0.00 66.02 63.63 1pyb s SER 31 CO 0.00 -0.94 1.14 -1.61 0.98 0.00 0.00 173.24 172.80 1pyb s GLU 32 N 2.60 2.05 -1.34 4.02 2.02 -1.26 -4.07 118.70 122.72 1pyb s GLU 32 Ca 0.77 0.31 -0.04 0.00 0.02 0.00 0.00 54.97 56.03 1pyb s GLU 32 Cb -0.43 -1.94 0.02 0.00 0.10 0.00 0.00 34.13 31.88 1pyb s GLU 32 CO 0.34 -1.57 0.88 1.63 0.02 0.00 0.00 175.26 176.56 1pyb n LYS 33 N -3.34 -5.78 -1.67 1.61 5.02 -1.26 -4.87 118.16 107.86 1pyb n LYS 33 Ca 0.07 0.69 -0.31 0.00 -2.02 0.00 0.00 58.31 56.74 1pyb n LYS 33 Cb 0.59 -5.47 -0.04 0.00 -0.02 0.00 0.00 35.03 30.09 1pyb n LYS 33 CO 0.00 0.00 0.00 1.47 -0.52 0.00 0.00 177.40 178.35 1pyb n LEU 34 N -4.43 6.92 -3.72 -0.35 -0.00 -1.26 -4.64 117.00 109.52 1pyb n LEU 34 Ca -0.19 -4.34 -0.42 0.00 -0.00 0.00 0.00 56.01 51.07 1pyb n LEU 34 Cb 0.63 -1.25 0.01 0.00 -0.00 0.00 0.00 43.42 42.81 1pyb n LEU 34 CO 0.68 1.82 1.86 0.18 -0.00 0.00 0.00 177.39 181.93 1pyb n LEU 35 N 0.94 7.21 -4.57 1.47 4.77 -1.21 -4.23 117.00 121.38 1pyb n LEU 35 Ca 0.52 -4.97 -0.42 0.00 -0.03 0.00 0.00 56.01 51.12 1pyb n LEU 35 Cb 0.45 -1.35 -0.01 0.00 -2.33 0.00 0.00 43.42 40.19 1pyb n LEU 35 CO 0.42 1.79 1.84 -0.54 -1.33 0.00 0.00 177.39 179.57 1pyb s LYS 36 N -1.55 3.84 0.09 3.23 1.02 -1.14 -0.26 119.74 124.98 1pyb s LYS 36 Ca 0.43 -1.75 -0.30 0.00 0.02 0.00 0.00 55.97 54.36 1pyb s LYS 36 Cb 0.13 -5.49 -0.06 0.00 -0.52 0.00 0.00 37.83 31.90 1pyb s LYS 36 CO -0.03 -2.30 1.19 -0.51 -0.92 0.00 0.00 175.35 172.78 1pyb s LEU 37 N 4.63 4.39 -0.78 3.17 1.43 0.09 -1.07 118.68 130.54 1pyb s LEU 37 Ca 0.53 2.06 -0.19 0.00 -1.03 0.00 0.00 54.13 55.49 1pyb s LEU 37 Cb 0.03 -3.59 0.12 0.00 0.03 0.00 0.00 46.19 42.78 1pyb s LEU 37 CO 0.04 -0.43 0.97 0.42 0.23 0.00 0.00 176.35 177.58 1pyb s THR 38 N 0.77 4.72 0.01 5.49 -4.23 -0.18 -1.20 115.64 121.01 1pyb s THR 38 Ca 0.57 -1.22 -0.29 0.00 -1.18 0.00 0.00 61.69 59.56 1pyb s THR 38 Cb -0.30 -4.67 -0.03 0.00 1.34 0.00 0.00 72.50 68.83 1pyb s THR 38 CO 0.31 -1.38 0.94 -0.76 -0.54 0.00 0.00 174.62 173.19 1pyb s LEU 39 N 2.83 4.38 -0.77 4.79 1.43 0.55 -1.11 118.68 130.78 1pyb s LEU 39 Ca 0.24 1.62 -0.11 0.00 -1.03 0.00 0.00 54.13 54.85 1pyb s LEU 39 Cb -0.12 -3.52 0.20 0.00 0.03 0.00 0.00 46.19 42.78 1pyb s LEU 39 CO -0.01 -0.22 0.68 -0.94 0.23 0.00 0.00 176.35 176.09 1pyb s SER 40 N 0.85 6.39 -1.39 2.29 1.04 -0.30 -0.70 113.70 121.89 1pyb s SER 40 Ca 0.50 -2.70 -0.14 0.00 0.48 0.00 0.00 55.95 54.09 1pyb s SER 40 Cb -0.21 -2.13 0.07 0.00 0.10 0.00 0.00 66.02 63.86 1pyb s SER 40 CO 0.27 -0.53 2.04 0.18 0.98 0.00 0.00 173.24 176.18 1pyb n LEU 41 N 3.90 6.41 0.00 2.42 4.77 0.94 -3.71 117.00 131.73 1pyb n LEU 41 Ca 0.11 -4.21 0.00 0.00 -0.03 0.00 0.00 56.01 51.88 1pyb n LEU 41 Cb 0.45 -1.64 0.00 0.00 -2.33 0.00 0.00 43.42 39.89 1pyb n LEU 41 CO 0.34 0.97 0.00 0.61 -1.33 0.00 0.00 177.39 177.98 1pyb n GLY 42 N 4.09 1.19 0.02 -0.72 0.00 -1.26 -1.65 105.19 106.86 1pyb n GLY 42 Ca 0.49 0.29 0.09 0.00 0.00 0.00 0.00 46.02 46.89 1pyb n GLY 42 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1pyb n ASP 43 N 6.95 0.17 -4.70 1.61 8.00 -1.26 -4.92 116.55 122.41 1pyb n ASP 43 Ca 0.00 0.00 -0.38 0.00 0.71 0.00 0.00 54.79 55.12 1pyb n ASP 43 Cb 0.00 1.88 -0.07 0.00 -0.02 0.00 0.00 41.12 42.92 1pyb n ASP 43 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1pyb s GLU 44 N -3.39 4.26 -0.31 -1.24 2.02 -0.66 -5.05 118.70 114.33 1pyb s GLU 44 Ca -0.08 0.33 -0.11 0.00 0.02 0.00 0.00 54.97 55.14 1pyb s GLU 44 Cb 0.13 -3.49 -0.02 0.00 0.10 0.00 0.00 34.13 30.85 1pyb s GLU 44 CO 0.87 0.06 0.19 -1.21 0.02 0.00 0.00 175.26 175.19 1pyb s GLU 45 N 0.98 3.54 -0.04 1.61 2.02 -1.26 -0.04 118.70 125.51 1pyb s GLU 45 Ca 0.23 -0.60 0.05 0.00 0.02 0.00 0.00 54.97 54.67 1pyb s GLU 45 Cb -0.15 -3.66 -0.01 0.00 0.10 0.00 0.00 34.13 30.41 1pyb s GLU 45 CO 0.09 -0.37 -0.19 1.03 0.02 0.00 0.00 175.26 175.84 1pyb s ARG 46 N 1.68 1.88 -0.21 1.61 0.52 0.12 -5.00 118.95 119.55 1pyb s ARG 46 Ca 0.06 -0.69 -0.11 0.00 -0.52 0.00 0.00 55.73 54.47 1pyb s ARG 46 Cb -0.17 -1.66 -0.05 0.00 0.52 0.00 0.00 34.95 33.59 1pyb s ARG 46 CO 0.09 0.32 0.17 0.95 0.02 0.00 0.00 175.30 176.85 1pyb s THR 47 N -0.13 5.37 -0.04 0.02 -4.23 -1.26 -0.33 115.64 115.04 1pyb s THR 47 Ca -0.01 0.25 0.02 0.00 -1.18 0.00 0.00 61.69 60.77 1pyb s THR 47 Cb -0.11 -3.51 0.01 0.00 1.34 0.00 0.00 72.50 70.23 1pyb s THR 47 CO 0.02 0.38 -0.08 -0.69 -0.54 0.00 0.00 174.62 173.71 1pyb s VAL 48 N 0.74 0.74 -0.19 2.29 1.01 -0.34 -2.50 120.40 122.14 1pyb s VAL 48 Ca 0.09 -0.29 -0.23 0.00 0.00 0.00 0.00 61.98 61.55 1pyb s VAL 48 Cb -0.13 -0.69 -0.02 0.00 0.00 0.00 0.00 36.38 35.54 1pyb s VAL 48 CO 0.02 0.25 0.75 -0.69 0.00 0.00 0.00 175.10 175.43 1pyb s VAL 49 N 0.53 4.93 -0.03 2.92 1.01 0.92 -0.73 120.40 129.94 1pyb s VAL 49 Ca -0.08 1.44 0.01 0.00 0.00 0.00 0.00 61.98 63.35 1pyb s VAL 49 Cb -0.12 -4.06 -0.03 0.00 0.00 0.00 0.00 36.38 32.17 1pyb s VAL 49 CO 0.01 0.04 -0.03 0.00 0.00 0.00 0.00 175.10 175.13 1pyb s ALA 50 N 2.17 3.17 0.00 5.51 0.00 0.64 -4.96 121.76 128.29 1pyb s ALA 50 Ca 0.34 -0.92 0.00 0.00 0.00 0.00 0.00 51.96 51.38 1pyb s ALA 50 Cb -0.16 -1.31 0.00 0.00 0.00 0.00 0.00 23.12 21.65 1pyb s ALA 50 CO 0.11 0.61 0.00 0.41 0.00 0.00 0.00 175.76 176.89 1pyb n GLY 51 N 1.76 1.06 2.45 0.00 0.00 -1.26 -3.32 105.19 105.88 1pyb n GLY 51 Ca -0.16 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.84 1pyb n GLY 51 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1pyb n ILE 52 N 0.00-12.94 -1.56 -0.61 5.41 -1.26 -4.63 119.36 103.77 1pyb n ILE 52 Ca 0.00 2.97 -0.41 0.00 1.00 0.00 0.00 62.75 66.30 1pyb n ILE 52 Cb 0.00 -6.15 -0.03 0.00 -0.71 0.00 0.00 39.64 32.74 1pyb n ILE 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1pyb n ALA 53 N 1.83 3.99 -0.51 -1.39 0.00 -1.26 -4.45 120.51 118.72 1pyb n ALA 53 Ca -0.16 -3.53 0.00 0.00 0.00 0.00 0.00 53.44 49.75 1pyb n ALA 53 Cb 0.24 -3.59 0.00 0.00 0.00 0.00 0.00 19.45 16.10 1pyb n ALA 53 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1pyb n LYS 54 N 6.92 -0.36 0.10 0.00 5.02 -1.26 -4.76 118.16 123.82 1pyb n LYS 54 Ca 0.50 0.08 0.05 0.00 -2.02 0.00 0.00 58.31 56.91 1pyb n LYS 54 Cb 0.41 -4.16 0.47 0.00 -0.02 0.00 0.00 35.03 31.74 1pyb n LYS 54 CO 0.00 0.00 0.00 -0.92 -0.52 0.00 0.00 177.40 175.96 1pyb h TYR 55 N 0.00 0.31 -3.21 2.13 3.20 -1.92 -3.38 116.97 114.10 1pyb h TYR 55 Ca 0.00 -0.00 -0.56 0.00 3.14 0.00 0.00 58.73 61.31 1pyb h TYR 55 Cb 0.15 -0.10 -0.37 0.00 1.54 0.00 0.00 36.73 37.96 1pyb h TYR 55 CO 0.10 0.25 -0.81 0.71 -1.64 0.00 0.00 178.16 176.77 1pyb s TYR 56 N -5.19 1.80 0.37 -3.82 1.51 -1.26 -5.11 117.35 105.65 1pyb s TYR 56 Ca -0.07 -1.01 -0.27 0.00 -1.01 0.00 0.00 57.07 54.71 1pyb s TYR 56 Cb 0.17 -1.39 -0.09 0.00 -0.11 0.00 0.00 41.96 40.54 1pyb s TYR 56 CO 0.72 -0.60 1.27 0.95 -1.11 0.00 0.00 175.55 176.77 1pyb s THR 57 N 1.60 2.81 0.54 -0.71 -4.23 -1.26 -4.90 115.64 109.49 1pyb s THR 57 Ca 0.04 0.75 0.28 0.00 -1.18 0.00 0.00 61.69 61.58 1pyb s THR 57 Cb -0.13 -3.45 0.42 0.00 1.34 0.00 0.00 72.50 70.67 1pyb s THR 57 CO -0.09 0.13 1.95 1.55 -0.54 0.00 0.00 174.62 177.63 1pyb h PRO 58 N 2.99 0.00 0.56 3.99 0.13 -1.99 -1.98 132.00 135.69 1pyb h PRO 58 Ca -0.49 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.61 1pyb h PRO 58 Cb 1.23 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.37 1pyb h PRO 58 CO 0.64 0.00 -0.27 0.93 -0.23 0.00 0.00 178.00 179.07 1pyb h GLU 59 N 0.00 -0.73 -0.52 0.86 5.08 -1.96 -3.08 114.58 114.23 1pyb h GLU 59 Ca 0.30 0.05 0.15 0.00 -1.00 0.00 0.00 59.36 58.86 1pyb h GLU 59 Cb 1.23 0.16 -0.02 0.00 0.50 0.00 0.00 28.75 30.63 1pyb h GLU 59 CO -0.00 -0.42 0.38 1.49 -1.00 0.00 0.00 179.01 179.46 1pyb h GLU 60 N -1.05 0.00 0.00 2.33 4.57 -1.76 0.18 114.58 118.84 1pyb h GLU 60 Ca -0.08 0.00 -0.05 0.00 -1.18 0.00 0.00 59.36 58.05 1pyb h GLU 60 Cb 0.64 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.22 1pyb h GLU 60 CO 0.13 0.00 -0.25 -0.07 -1.18 0.00 0.00 179.01 177.64 1pyb h LEU 61 N 0.00 0.00 -9.67 1.64 3.38 -1.32 -3.39 115.31 105.96 1pyb h LEU 61 Ca 0.25 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.69 1pyb h LEU 61 Cb 1.00 0.00 0.04 0.00 0.09 0.00 0.00 40.66 41.79 1pyb h LEU 61 CO -0.00 0.25 0.72 -0.69 0.09 0.00 0.00 178.44 178.80 1pyb s VAL 62 N -3.94 3.00 0.00 1.22 1.01 0.63 -2.22 120.40 120.10 1pyb s VAL 62 Ca -0.01 0.80 0.00 0.00 0.00 0.00 0.00 61.98 62.77 1pyb s VAL 62 Cb 0.12 -3.51 0.00 0.00 0.00 0.00 0.00 36.38 32.99 1pyb s VAL 62 CO 0.65 0.11 0.00 0.61 0.00 0.00 0.00 175.10 176.46 1pyb n GLY 63 N 2.63 2.93 3.72 4.51 0.00 -0.17 -4.94 105.19 113.88 1pyb n GLY 63 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 1pyb n GLY 63 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1pyb s LYS 64 N -0.20 4.38 -0.42 1.61 2.20 -0.94 -4.74 119.74 121.63 1pyb s LYS 64 Ca 0.00 1.96 -0.22 0.00 -0.36 0.00 0.00 55.97 57.35 1pyb s LYS 64 Cb 0.00 -3.26 0.02 0.00 -1.51 0.00 0.00 37.83 33.08 1pyb s LYS 64 CO 0.00 -0.31 0.73 0.15 -0.36 0.00 0.00 175.35 175.56 1pyb s LYS 65 N 0.70 3.46 0.25 4.03 1.02 -1.26 -3.12 119.74 124.81 1pyb s LYS 65 Ca 0.60 -0.09 0.09 0.00 0.02 0.00 0.00 55.97 56.59 1pyb s LYS 65 Cb -0.34 -3.91 -0.04 0.00 -0.52 0.00 0.00 37.83 33.02 1pyb s LYS 65 CO 0.32 -1.01 0.02 0.42 -0.92 0.00 0.00 175.35 174.19 1pyb s ILE 66 N 3.09 3.63 -0.35 2.17 1.01 -0.05 -4.06 121.20 126.63 1pyb s ILE 66 Ca 0.28 -1.77 -0.13 0.00 0.00 0.00 0.00 60.65 59.03 1pyb s ILE 66 Cb -0.13 -2.93 -0.01 0.00 0.01 0.00 0.00 42.46 39.41 1pyb s ILE 66 CO 0.20 -0.33 0.24 -0.69 0.00 0.00 0.00 174.94 174.36 1pyb s VAL 67 N -2.21 5.19 0.01 2.92 1.01 -1.14 -1.15 120.40 125.03 1pyb s VAL 67 Ca 0.31 -0.34 0.08 0.00 0.00 0.00 0.00 61.98 62.03 1pyb s VAL 67 Cb -0.07 -3.71 -0.02 0.00 0.00 0.00 0.00 36.38 32.58 1pyb s VAL 67 CO 0.20 -0.06 -0.23 -0.63 0.00 0.00 0.00 175.10 174.38 1pyb s ILE 68 N 1.70 1.85 -0.75 2.22 1.09 -0.09 -3.33 121.20 123.89 1pyb s ILE 68 Ca 0.06 -1.13 -0.25 0.00 -1.10 0.00 0.00 60.65 58.22 1pyb s ILE 68 Cb -0.18 -1.57 0.04 0.00 -1.06 0.00 0.00 42.46 39.70 1pyb s ILE 68 CO 0.10 0.40 1.22 -0.69 -0.10 0.00 0.00 174.94 175.87 1pyb s VAL 69 N -0.66 3.91 0.11 2.92 1.01 -0.73 -0.39 120.40 126.57 1pyb s VAL 69 Ca 0.09 0.05 -0.31 0.00 0.00 0.00 0.00 61.98 61.81 1pyb s VAL 69 Cb -0.09 -4.87 -0.11 0.00 0.00 0.00 0.00 36.38 31.30 1pyb s VAL 69 CO 0.00 -1.76 1.51 0.00 0.00 0.00 0.00 175.10 174.85 1pyb h ALA 70 N 9.86 -0.82 -0.08 5.51 0.00 -1.44 -2.85 119.26 129.45 1pyb h ALA 70 Ca -0.22 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1pyb h ALA 70 Cb 1.05 1.03 0.00 0.00 0.00 0.00 0.00 17.79 19.87 1pyb h ALA 70 CO 1.27 -1.03 0.00 0.27 0.00 0.00 0.00 179.25 179.76 1pyb n ASN 71 N -5.20 0.85 0.05 0.00 6.94 -1.26 -4.08 115.26 112.56 1pyb n ASN 71 Ca -0.05 -2.04 -0.02 0.00 -0.02 0.00 0.00 54.58 52.45 1pyb n ASN 71 Cb 0.34 -0.22 -0.01 0.00 -2.36 0.00 0.00 39.78 37.53 1pyb n ASN 71 CO 0.00 0.00 0.00 0.25 -1.03 0.00 0.00 177.26 176.48 1pyb h LEU 72 N 0.50 -0.14 -7.30 -4.53 7.12 -1.84 -3.46 115.31 105.67 1pyb h LEU 72 Ca 0.00 0.01 -0.12 0.00 0.13 0.00 0.00 57.88 57.90 1pyb h LEU 72 Cb 0.31 0.04 -0.24 0.00 -0.53 0.00 0.00 40.66 40.24 1pyb h LEU 72 CO 0.02 -0.08 -0.23 -0.54 -0.13 0.00 0.00 178.44 177.48 1pyb s LYS 73 N -3.32 0.48 0.16 1.25 1.02 -1.26 -5.00 119.74 113.07 1pyb s LYS 73 Ca -0.02 0.60 -0.02 0.00 0.02 0.00 0.00 55.97 56.55 1pyb s LYS 73 Cb 0.00 0.22 -0.01 0.00 -0.52 0.00 0.00 37.83 37.52 1pyb s LYS 73 CO 0.07 -0.07 1.38 -1.00 -0.92 0.00 0.00 175.35 174.81 1pyb h PRO 74 N 5.62 0.37 -3.79 -1.68 0.13 -1.90 -0.68 132.00 130.07 1pyb h PRO 74 Ca -0.28 -0.35 -0.09 0.00 -0.87 0.00 0.00 66.00 64.42 1pyb h PRO 74 Cb 1.18 0.09 -0.11 0.00 0.13 0.00 0.00 31.00 32.29 1pyb h PRO 74 CO 0.25 1.01 -0.24 1.03 -0.23 0.00 0.00 178.00 179.82 1pyb s ARG 75 N -3.42 1.29 0.35 0.86 0.52 -1.25 -2.97 118.95 114.34 1pyb s ARG 75 Ca -0.05 -1.18 0.07 0.00 -0.52 0.00 0.00 55.73 54.05 1pyb s ARG 75 Cb 0.10 0.41 -0.02 0.00 0.52 0.00 0.00 34.95 35.97 1pyb s ARG 75 CO 0.85 -0.50 0.40 0.15 0.02 0.00 0.00 175.30 176.22 1pyb s LYS 76 N -3.98 2.88 0.31 3.54 1.02 -0.13 -4.93 119.74 118.46 1pyb s LYS 76 Ca 0.19 -1.19 0.06 0.00 0.02 0.00 0.00 55.97 55.04 1pyb s LYS 76 Cb 0.02 -2.64 0.72 0.00 -0.52 0.00 0.00 37.83 35.41 1pyb s LYS 76 CO 0.03 0.02 1.81 -0.84 -0.92 0.00 0.00 175.35 175.45 1pyb h ILE 77 N 1.03 0.79 -2.30 2.17 -2.65 -2.02 -2.36 117.51 112.16 1pyb h ILE 77 Ca -0.44 -0.27 -0.80 0.00 1.03 0.00 0.00 64.86 64.37 1pyb h ILE 77 Cb 1.26 -0.08 -0.27 0.00 -2.05 0.00 0.00 36.82 35.67 1pyb h ILE 77 CO 0.55 0.15 0.98 0.49 0.03 0.00 0.00 178.15 180.34 1pyb n PHE 78 N -4.67 2.76 0.00 0.16 0.99 -1.26 -4.98 117.46 110.46 1pyb n PHE 78 Ca 0.21 -2.60 0.00 0.00 -0.00 0.00 0.00 57.45 55.06 1pyb n PHE 78 Cb 0.50 -1.18 0.00 0.00 -1.00 0.00 0.00 39.48 37.80 1pyb n PHE 78 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1pyb n GLY 79 N 0.04 0.94 2.78 1.37 0.00 -0.89 -4.93 105.19 104.50 1pyb n GLY 79 Ca 0.45 0.48 -0.03 0.00 0.00 0.00 0.00 46.02 46.92 1pyb n GLY 79 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1pyb n ILE 80 N 0.00 -7.12 -1.55 -0.61 5.41 -1.26 -0.96 119.36 113.27 1pyb n ILE 80 Ca 0.00 1.46 -0.18 0.00 1.00 0.00 0.00 62.75 65.03 1pyb n ILE 80 Cb 0.00 -4.52 -0.07 0.00 -0.71 0.00 0.00 39.64 34.34 1pyb n ILE 80 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1pyb n GLU 81 N 2.11 0.63 -3.34 0.38 1.02 -1.26 -3.39 120.64 116.79 1pyb n GLU 81 Ca -0.20 -0.64 -0.26 0.00 -0.02 0.00 0.00 57.16 56.04 1pyb n GLU 81 Cb 0.31 -3.51 -0.09 0.00 -0.02 0.00 0.00 31.44 28.13 1pyb n GLU 81 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1pyb n SER 82 N 17.55 -0.13 -3.97 1.62 3.41 -1.20 -0.06 113.62 130.84 1pyb n SER 82 Ca 0.46 -2.51 -0.42 0.00 -0.26 0.00 0.00 58.87 56.13 1pyb n SER 82 Cb 0.44 -0.59 0.00 0.00 -0.26 0.00 0.00 64.21 63.80 1pyb n SER 82 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1pyb n GLN 83 N 2.31 2.99 0.00 4.33 6.02 -1.04 -3.83 117.38 128.16 1pyb n GLN 83 Ca 0.27 -2.84 0.00 0.00 -0.01 0.00 0.00 57.00 54.41 1pyb n GLN 83 Cb 0.49 -3.32 0.00 0.00 1.02 0.00 0.00 30.24 28.43 1pyb n GLN 83 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1pyb n GLY 84 N 4.38 3.22 3.64 1.08 0.00 -0.26 -4.83 105.19 112.43 1pyb n GLY 84 Ca 0.50 -1.53 -0.39 0.00 0.00 0.00 0.00 46.02 44.60 1pyb n GLY 84 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1pyb s MET 85 N -5.02 4.10 -0.36 1.61 1.75 -1.12 -4.84 119.30 115.43 1pyb s MET 85 Ca 0.00 0.19 -0.26 0.00 -1.25 0.00 0.00 55.69 54.37 1pyb s MET 85 Cb 0.00 -3.60 0.01 0.00 2.84 0.00 0.00 34.83 34.09 1pyb s MET 85 CO 0.00 -0.18 0.94 0.42 -0.65 0.00 0.00 175.02 175.55 1pyb s ILE 86 N 1.78 4.58 0.07 10.11 1.01 -1.26 -1.78 121.20 135.71 1pyb s ILE 86 Ca 0.19 1.28 -0.31 0.00 0.00 0.00 0.00 60.65 61.81 1pyb s ILE 86 Cb -0.15 -4.34 -0.07 0.00 0.01 0.00 0.00 42.46 37.91 1pyb s ILE 86 CO 0.09 -0.51 1.35 -0.76 0.00 0.00 0.00 174.94 175.11 1pyb s LEU 87 N 3.48 4.36 -0.06 2.97 1.43 -1.21 -5.03 118.68 124.62 1pyb s LEU 87 Ca 0.39 2.20 0.02 0.00 -1.03 0.00 0.00 54.13 55.71 1pyb s LEU 87 Cb -0.12 -3.58 0.01 0.00 0.03 0.00 0.00 46.19 42.54 1pyb s LEU 87 CO 0.18 -0.63 -0.11 0.00 0.23 0.00 0.00 176.35 176.02 1pyb s ALA 88 N 1.41 1.17 -0.47 4.21 0.00 -1.26 -3.83 121.76 123.00 1pyb s ALA 88 Ca 0.63 -0.36 -0.28 0.00 0.00 0.00 0.00 51.96 51.95 1pyb s ALA 88 Cb -0.34 -0.54 0.00 0.00 0.00 0.00 0.00 23.12 22.25 1pyb s ALA 88 CO 0.29 0.10 1.50 0.00 0.00 0.00 0.00 175.76 177.66 1pyb s ALA 89 N 0.67 2.87 -0.40 0.00 0.00 0.62 -4.83 121.76 120.68 1pyb s ALA 89 Ca -0.14 -0.32 -0.29 0.00 0.00 0.00 0.00 51.96 51.22 1pyb s ALA 89 Cb -0.15 -4.04 0.00 0.00 0.00 0.00 0.00 23.12 18.93 1pyb s ALA 89 CO 0.03 -2.74 1.51 -1.54 0.00 0.00 0.00 175.76 173.03 1pyb s SER 90 N 4.74 6.20 0.13 0.00 1.04 -1.26 -1.67 113.70 122.88 1pyb s SER 90 Ca 0.61 0.91 0.00 0.00 0.48 0.00 0.00 55.95 57.95 1pyb s SER 90 Cb -0.14 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.45 1pyb s SER 90 CO 0.29 -1.53 0.00 0.47 0.98 0.00 0.00 173.24 173.45 1pyb n ASP 91 N 9.29 0.00 -0.33 7.02 8.00 0.52 -4.94 116.55 136.10 1pyb n ASP 91 Ca 0.18 -0.22 0.06 0.00 0.71 0.00 0.00 54.79 55.53 1pyb n ASP 91 Cb 0.48 0.00 0.22 0.00 -0.02 0.00 0.00 41.12 41.80 1pyb n ASP 91 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 1pyb h GLY 92 N 0.00 1.49 0.00 0.44 0.00 -2.05 -3.38 103.07 99.57 1pyb h GLY 92 Ca 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 46.98 1pyb h GLY 92 CO 0.00 0.09 0.00 -1.84 0.00 0.00 0.00 176.54 174.79 1pyb n GLU 93 N -4.72 0.46 -3.90 4.80 -0.00 -1.26 -5.12 120.64 110.90 1pyb n GLU 93 Ca 0.17 0.00 -0.23 0.00 -0.00 0.00 0.00 57.16 57.10 1pyb n GLU 93 Cb 0.36 -0.04 -0.02 0.00 -0.00 0.00 0.00 31.44 31.74 1pyb n GLU 93 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.13 176.33 1pyb s ASN 94 N 0.00 6.33 -0.28 -1.84 0.01 -1.26 -5.03 114.94 112.86 1pyb s ASN 94 Ca 0.00 0.15 -0.02 0.00 -0.71 0.00 0.00 52.86 52.29 1pyb s ASN 94 Cb 0.00 -1.90 0.04 0.00 0.41 0.00 0.00 41.25 39.80 1pyb s ASN 94 CO 0.00 -0.05 -0.02 -0.76 -1.51 0.00 0.00 177.10 174.76 1pyb s LEU 95 N -3.72 3.66 0.17 0.60 1.43 -1.26 -0.36 118.68 119.20 1pyb s LEU 95 Ca 0.35 -1.15 -0.03 0.00 -1.03 0.00 0.00 54.13 52.27 1pyb s LEU 95 Cb -0.10 -1.69 -0.05 0.00 0.03 0.00 0.00 46.19 44.38 1pyb s LEU 95 CO 0.29 -0.22 0.38 -0.94 0.23 0.00 0.00 176.35 176.10 1pyb s SER 96 N 1.27 6.44 0.01 2.29 1.04 -0.67 -4.86 113.70 119.22 1pyb s SER 96 Ca -0.04 0.50 -0.16 0.00 0.48 0.00 0.00 55.95 56.72 1pyb s SER 96 Cb -0.19 -2.05 -0.06 0.00 0.10 0.00 0.00 66.02 63.82 1pyb s SER 96 CO -0.02 0.00 0.47 -0.69 0.98 0.00 0.00 173.24 173.98 1pyb s VAL 97 N -1.76 4.95 -0.26 5.02 1.01 -1.26 -0.28 120.40 127.81 1pyb s VAL 97 Ca 0.40 0.97 -0.26 0.00 0.00 0.00 0.00 61.98 63.09 1pyb s VAL 97 Cb -0.12 -3.78 0.00 0.00 0.00 0.00 0.00 36.38 32.48 1pyb s VAL 97 CO 0.27 0.55 0.88 -0.63 0.00 0.00 0.00 175.10 176.18 1pyb s ILE 98 N -0.95 4.76 0.00 2.22 1.01 -1.25 -4.90 121.20 122.09 1pyb s ILE 98 Ca 0.26 1.58 0.01 0.00 0.00 0.00 0.00 60.65 62.49 1pyb s ILE 98 Cb -0.17 -4.19 -0.00 0.00 0.01 0.00 0.00 42.46 38.10 1pyb s ILE 98 CO 0.15 -0.18 -0.02 -0.69 0.00 0.00 0.00 174.94 174.20 1pyb s VAL 99 N 3.03 0.16 0.57 2.92 1.01 -1.26 -2.91 120.40 123.92 1pyb s VAL 99 Ca 0.37 -0.17 -0.16 0.00 0.00 0.00 0.00 61.98 62.02 1pyb s VAL 99 Cb -0.15 -0.16 -0.05 0.00 0.00 0.00 0.00 36.38 36.02 1pyb s VAL 99 CO 0.09 -0.01 1.03 -2.16 0.00 0.00 0.00 175.10 174.06 1pyb s PRO 100 N -0.19 3.53 0.00 2.72 0.04 -1.26 -5.04 135.00 134.80 1pyb s PRO 100 Ca -0.01 1.12 0.00 0.00 0.04 0.00 0.00 61.00 62.15 1pyb s PRO 100 Cb -0.02 -2.07 0.00 0.00 0.04 0.00 0.00 34.50 32.46 1pyb s PRO 100 CO -0.00 -0.63 0.63 -0.25 0.04 0.00 0.00 177.00 176.79 1pyb n ASP 101 N -1.89 0.00 -4.54 6.66 9.92 -1.26 -4.91 116.55 120.53 1pyb n ASP 101 Ca 0.08 0.73 -0.26 0.00 -0.53 0.00 0.00 54.79 54.81 1pyb n ASP 101 Cb 0.53 -0.36 0.13 0.00 -0.64 0.00 0.00 41.12 40.78 1pyb n ASP 101 CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 1pyb s ARG 102 N -1.98 1.44 -0.04 -1.24 0.52 -1.26 -4.98 118.95 111.41 1pyb s ARG 102 Ca 0.00 -0.74 -0.30 0.00 -0.52 0.00 0.00 55.73 54.17 1pyb s ARG 102 Cb 0.00 -2.15 -0.09 0.00 0.52 0.00 0.00 34.95 33.24 1pyb s ARG 102 CO 0.00 -1.72 2.03 -0.25 0.02 0.00 0.00 175.30 175.38 1pyb n ASP 103 N -3.14 3.87 -4.40 0.23 9.92 -1.26 -4.99 116.55 116.78 1pyb n ASP 103 Ca 0.14 0.75 -0.31 0.00 -0.53 0.00 0.00 54.79 54.84 1pyb n ASP 103 Cb 0.60 -1.51 -0.14 0.00 -0.64 0.00 0.00 41.12 39.43 1pyb n ASP 103 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1pyb s VAL 104 N 5.31 2.51 0.47 2.53 1.01 -1.26 -5.14 120.40 125.83 1pyb s VAL 104 Ca 0.92 -1.23 -0.04 0.00 0.00 0.00 0.00 61.98 61.64 1pyb s VAL 104 Cb -0.45 -2.01 -0.03 0.00 0.00 0.00 0.00 36.38 33.89 1pyb s VAL 104 CO 0.42 0.39 0.75 -0.54 0.00 0.00 0.00 175.10 176.12 1pyb s LYS 105 N -1.25 3.48 0.66 2.72 1.02 -1.26 -5.06 119.74 120.05 1pyb s LYS 105 Ca 0.13 0.08 -0.16 0.00 0.02 0.00 0.00 55.97 56.04 1pyb s LYS 105 Cb -0.10 -2.42 -0.00 0.00 -0.52 0.00 0.00 37.83 34.79 1pyb s LYS 105 CO 0.03 -0.18 1.18 -1.21 -0.92 0.00 0.00 175.35 174.24 1pyb s GLU 106 N -4.69 2.65 -1.63 1.68 2.02 -1.26 -3.11 118.70 114.36 1pyb s GLU 106 Ca 0.47 1.67 0.00 0.00 0.02 0.00 0.00 54.97 57.13 1pyb s GLU 106 Cb -0.10 -1.90 0.00 0.00 0.10 0.00 0.00 34.13 32.22 1pyb s GLU 106 CO 0.43 -1.42 0.00 0.41 0.02 0.00 0.00 175.26 174.70 1pyb n GLY 107 N 0.17 1.21 3.63 -1.39 0.00 0.11 -4.50 105.19 104.42 1pyb n GLY 107 Ca 0.13 -0.25 -0.43 0.00 0.00 0.00 0.00 46.02 45.47 1pyb n GLY 107 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pyb s ALA 108 N -2.64 3.22 -0.46 4.61 0.00 -1.18 -4.73 121.76 120.58 1pyb s ALA 108 Ca 0.00 0.95 -0.29 0.00 0.00 0.00 0.00 51.96 52.62 1pyb s ALA 108 Cb 0.00 -3.93 0.03 0.00 0.00 0.00 0.00 23.12 19.22 1pyb s ALA 108 CO 0.00 -2.08 1.19 0.15 0.00 0.00 0.00 175.76 175.02 1pyb s LYS 109 N 5.16 3.71 0.17 0.00 1.02 -1.26 -1.89 119.74 126.64 1pyb s LYS 109 Ca 0.89 0.64 -0.30 0.00 0.02 0.00 0.00 55.97 57.22 1pyb s LYS 109 Cb -0.35 -3.92 -0.08 0.00 -0.52 0.00 0.00 37.83 32.95 1pyb s LYS 109 CO 0.36 -1.40 1.22 -0.51 -0.92 0.00 0.00 175.35 174.10 1pyb s LEU 110 N 4.61 4.43 0.00 3.17 1.43 -0.89 -5.05 118.68 126.38 1pyb s LEU 110 Ca 0.50 2.23 0.00 0.00 -1.03 0.00 0.00 54.13 55.84 1pyb s LEU 110 Cb -0.08 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.53 1pyb s LEU 110 CO 0.32 -0.42 0.00 -1.54 0.23 0.00 0.00 176.35 174.93