#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wnb s GLN 2 N 0.00 4.21 0.00 3.17 -1.52 -1.26 -4.88 119.66 119.38 1wnb s GLN 2 Ca 0.00 2.25 0.00 0.00 -1.95 0.00 0.00 55.36 55.66 1wnb s GLN 2 Cb 0.00 -3.69 0.00 0.00 -0.22 0.00 0.00 33.01 29.10 1wnb s GLN 2 CO 0.00 -0.74 0.18 -2.39 -0.25 0.00 0.00 175.29 172.10 1wnb n HIS 3 N 5.93 0.00 -3.33 0.91 1.44 -1.26 -4.69 115.22 114.21 1wnb n HIS 3 Ca 0.16 0.00 -0.33 0.00 -2.01 0.00 0.00 57.72 55.54 1wnb n HIS 3 Cb 0.42 0.00 -0.06 0.00 0.12 0.00 0.00 29.99 30.47 1wnb n HIS 3 CO 0.00 0.00 0.00 0.15 -2.81 0.00 0.00 176.34 173.68 1wnb s LYS 4 N -0.02 3.90 0.51 -1.40 1.02 -1.26 -4.73 119.74 117.76 1wnb s LYS 4 Ca 0.00 0.43 -0.16 0.00 0.02 0.00 0.00 55.97 56.26 1wnb s LYS 4 Cb 0.00 -2.68 -0.08 0.00 -0.52 0.00 0.00 37.83 34.55 1wnb s LYS 4 CO 0.00 0.33 0.97 -0.51 -0.92 0.00 0.00 175.35 175.22 1wnb s LEU 5 N -2.61 3.62 -0.37 3.17 1.43 0.12 -4.81 118.68 119.23 1wnb s LEU 5 Ca 0.46 1.54 -0.12 0.00 -1.03 0.00 0.00 54.13 54.98 1wnb s LEU 5 Cb -0.12 -4.48 0.02 0.00 0.03 0.00 0.00 46.19 41.64 1wnb s LEU 5 CO 0.20 -0.58 0.22 -0.22 0.23 0.00 0.00 176.35 176.20 1wnb s LEU 6 N -4.09 4.71 -0.07 1.79 0.20 -0.27 -1.20 118.68 119.74 1wnb s LEU 6 Ca 0.58 -0.86 0.00 0.00 0.69 0.00 0.00 54.13 54.55 1wnb s LEU 6 Cb -0.10 -2.06 0.02 0.00 -0.43 0.00 0.00 46.19 43.62 1wnb s LEU 6 CO 0.32 -0.36 -0.06 -0.63 -0.29 0.00 0.00 176.35 175.33 1wnb s ILE 7 N 1.60 0.77 -1.42 6.68 1.01 -0.47 -0.22 121.20 129.15 1wnb s ILE 7 Ca 0.03 -0.20 -0.08 0.00 0.00 0.00 0.00 60.65 60.41 1wnb s ILE 7 Cb -0.19 -0.79 0.01 0.00 0.01 0.00 0.00 42.46 41.50 1wnb s ILE 7 CO 0.08 0.30 0.31 -3.20 0.00 0.00 0.00 174.94 172.42 1wnb n ASN 8 N 4.43 -0.81 0.00 3.58 5.15 -1.26 -1.08 115.26 125.28 1wnb n ASN 8 Ca -0.18 -1.19 0.00 0.00 -0.60 0.00 0.00 54.58 52.62 1wnb n ASN 8 Cb 0.51 -2.17 0.00 0.00 -0.53 0.00 0.00 39.78 37.59 1wnb n ASN 8 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1wnb n GLY 9 N -2.26 0.92 3.34 8.20 0.00 -1.26 -4.56 105.19 109.57 1wnb n GLY 9 Ca -0.27 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.44 1wnb n GLY 9 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wnb s GLU 10 N -0.06 2.28 -0.39 1.61 0.41 -0.24 -4.92 118.70 117.40 1wnb s GLU 10 Ca 0.00 -0.87 -0.24 0.00 -0.41 0.00 0.00 54.97 53.45 1wnb s GLU 10 Cb 0.00 -2.14 0.01 0.00 -1.78 0.00 0.00 34.13 30.23 1wnb s GLU 10 CO 0.00 0.54 0.81 -0.51 -0.49 0.00 0.00 175.26 175.61 1wnb s LEU 11 N -0.55 4.13 0.03 1.80 1.43 -1.26 -1.36 118.68 122.90 1wnb s LEU 11 Ca 0.08 0.27 0.05 0.00 -1.03 0.00 0.00 54.13 53.50 1wnb s LEU 11 Cb -0.11 -3.05 -0.02 0.00 0.03 0.00 0.00 46.19 43.04 1wnb s LEU 11 CO 0.00 -0.80 -0.15 0.68 0.23 0.00 0.00 176.35 176.31 1wnb s VAL 12 N 3.22 1.23 0.32 -1.59 -7.23 -0.34 -4.92 120.40 111.08 1wnb s VAL 12 Ca 0.32 -0.97 -0.29 0.00 -1.81 0.00 0.00 61.98 59.23 1wnb s VAL 12 Cb -0.13 -1.09 -0.10 0.00 0.56 0.00 0.00 36.38 35.63 1wnb s VAL 12 CO 0.19 0.10 1.19 -0.44 -0.31 0.00 0.00 175.10 175.82 1wnb s SER 13 N -1.01 6.98 0.46 4.85 0.01 -1.26 0.11 113.70 123.84 1wnb s SER 13 Ca 0.03 2.43 -0.25 0.00 1.31 0.00 0.00 55.95 59.48 1wnb s SER 13 Cb -0.08 -2.63 -0.08 0.00 0.21 0.00 0.00 66.02 63.44 1wnb s SER 13 CO 0.01 -0.36 1.41 -0.83 0.41 0.00 0.00 173.24 173.88 1wnb s GLY 14 N -0.78 2.92 0.00 3.44 0.00 -1.25 -4.89 107.32 106.76 1wnb s GLY 14 Ca 0.48 1.44 0.12 0.00 0.00 0.00 0.00 44.72 46.76 1wnb s GLY 14 CO 0.45 2.04 0.97 1.18 0.00 0.00 0.00 173.10 177.74 1wnb n GLU 15 N -0.25 1.17 0.00 2.90 1.02 -1.04 -4.77 120.64 119.66 1wnb n GLU 15 Ca 0.05 -1.42 0.00 0.00 -0.02 0.00 0.00 57.16 55.78 1wnb n GLU 15 Cb 0.42 -1.24 0.00 0.00 -0.02 0.00 0.00 31.44 30.60 1wnb n GLU 15 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1wnb n GLY 16 N 0.66 0.45 3.73 0.62 0.00 0.08 -4.76 105.19 105.97 1wnb n GLY 16 Ca 0.08 -1.70 -0.41 0.00 0.00 0.00 0.00 46.02 43.99 1wnb n GLY 16 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1wnb s GLU 17 N 0.98 4.63 0.53 1.61 2.12 -1.26 -4.24 118.70 123.07 1wnb s GLU 17 Ca 0.00 1.54 -0.22 0.00 0.36 0.00 0.00 54.97 56.65 1wnb s GLU 17 Cb 0.00 -3.36 -0.05 0.00 0.26 0.00 0.00 34.13 30.97 1wnb s GLU 17 CO 0.00 0.10 1.38 0.15 -0.54 0.00 0.00 175.26 176.35 1wnb s LYS 18 N 0.16 3.23 -0.02 4.30 1.02 -1.26 -1.15 119.74 126.01 1wnb s LYS 18 Ca 0.49 2.28 -0.11 0.00 0.02 0.00 0.00 55.97 58.66 1wnb s LYS 18 Cb -0.25 -2.33 0.01 0.00 -0.52 0.00 0.00 37.83 34.75 1wnb s LYS 18 CO 0.31 -1.14 0.23 -0.65 -0.92 0.00 0.00 175.35 173.18 1wnb s GLN 19 N -2.83 0.54 0.19 1.68 -1.52 -0.65 -4.87 119.66 112.20 1wnb s GLN 19 Ca 0.70 -0.19 -0.29 0.00 -1.95 0.00 0.00 55.36 53.63 1wnb s GLN 19 Cb -0.41 0.23 -0.08 0.00 -0.22 0.00 0.00 33.01 32.53 1wnb s GLN 19 CO 0.50 -0.13 0.89 -1.25 -0.25 0.00 0.00 175.29 175.05 1wnb s PRO 20 N -1.13 4.75 -0.12 2.91 0.04 -1.26 -0.86 135.00 139.33 1wnb s PRO 20 Ca -0.12 1.38 -0.00 0.00 0.04 0.00 0.00 61.00 62.30 1wnb s PRO 20 Cb -0.06 -3.29 -0.02 0.00 0.04 0.00 0.00 34.50 31.17 1wnb s PRO 20 CO 0.03 0.48 -0.11 0.08 0.04 0.00 0.00 177.00 177.51 1wnb s VAL 21 N -0.95 3.25 0.18 -0.36 1.01 0.73 -4.93 120.40 119.33 1wnb s VAL 21 Ca 0.40 -0.60 0.07 0.00 0.00 0.00 0.00 61.98 61.85 1wnb s VAL 21 Cb -0.25 -2.36 -0.04 0.00 0.00 0.00 0.00 36.38 33.73 1wnb s VAL 21 CO 0.30 0.53 0.03 -0.31 0.00 0.00 0.00 175.10 175.65 1wnb s TYR 22 N 0.13 2.89 -0.42 5.22 1.51 -1.26 0.35 117.35 125.78 1wnb s TYR 22 Ca -0.05 -0.12 -0.22 0.00 -1.01 0.00 0.00 57.07 55.67 1wnb s TYR 22 Cb -0.15 -1.39 0.02 0.00 -0.11 0.00 0.00 41.96 40.33 1wnb s TYR 22 CO 0.04 0.52 0.72 1.21 -1.11 0.00 0.00 175.55 176.93 1wnb s ASN 23 N -3.04 6.41 0.41 2.29 3.04 0.81 -4.67 114.94 120.20 1wnb s ASN 23 Ca 0.28 -0.07 0.29 0.00 0.04 0.00 0.00 52.86 53.41 1wnb s ASN 23 Cb -0.09 -2.36 1.27 0.00 -1.54 0.00 0.00 41.25 38.53 1wnb s ASN 23 CO 0.20 -0.80 1.87 1.55 -3.04 0.00 0.00 177.10 176.88 1wnb h PRO 24 N 8.79 0.00 0.08 0.43 0.14 -1.79 0.46 132.00 140.12 1wnb h PRO 24 Ca -0.25 0.00 -0.25 0.00 0.14 0.00 0.00 66.00 65.64 1wnb h PRO 24 Cb 1.09 0.00 -0.01 0.00 0.14 0.00 0.00 31.00 32.23 1wnb h PRO 24 CO 0.91 0.00 -1.16 0.00 0.14 0.00 0.00 178.00 177.89 1wnb h ALA 25 N 2.12 0.18 0.00 -0.56 0.00 -1.90 -0.17 119.26 118.93 1wnb h ALA 25 Ca 0.00 -0.90 0.00 0.00 0.00 0.00 0.00 54.91 54.01 1wnb h ALA 25 Cb 0.37 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1wnb h ALA 25 CO 0.00 1.07 -1.32 0.25 0.00 0.00 0.00 179.25 179.25 1wnb n THR 26 N -3.47 0.00 -0.27 0.00 -2.24 -1.03 -3.91 114.28 103.36 1wnb n THR 26 Ca -0.06 -0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.49 1wnb n THR 26 Cb 1.00 0.37 0.00 0.00 -2.10 0.00 0.00 70.33 69.60 1wnb n THR 26 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wnb n GLY 27 N 1.84 2.25 3.76 3.38 0.00 0.16 -3.43 105.19 113.14 1wnb n GLY 27 Ca -0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 1wnb n GLY 27 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1wnb s ASP 28 N -3.60 5.27 0.03 1.61 1.01 -1.23 -4.76 116.67 114.99 1wnb s ASP 28 Ca 0.00 2.35 -0.30 0.00 0.71 0.00 0.00 52.55 55.30 1wnb s ASP 28 Cb 0.00 -2.60 -0.05 0.00 1.01 0.00 0.00 42.92 41.29 1wnb s ASP 28 CO 0.00 -1.54 1.19 -0.69 0.21 0.00 0.00 175.17 174.34 1wnb s VAL 29 N -1.64 4.14 -0.18 -1.27 1.01 -1.26 -0.13 120.40 121.07 1wnb s VAL 29 Ca 0.76 1.52 -0.22 0.00 0.00 0.00 0.00 61.98 64.04 1wnb s VAL 29 Cb -0.29 -3.98 -0.19 0.00 0.00 0.00 0.00 36.38 31.92 1wnb s VAL 29 CO 0.32 0.09 0.36 -0.07 0.00 0.00 0.00 175.10 175.80 1wnb h LEU 30 N 7.19 0.00 -7.93 3.92 3.38 -0.41 -3.46 115.31 118.00 1wnb h LEU 30 Ca -0.40 -0.61 0.11 0.00 0.09 0.00 0.00 57.88 57.07 1wnb h LEU 30 Cb 1.20 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.92 1wnb h LEU 30 CO 0.83 1.24 0.47 -1.48 0.09 0.00 0.00 178.44 179.59 1wnb s LEU 31 N -8.03 -0.03 -0.05 1.67 0.05 -1.16 -5.02 118.68 106.10 1wnb s LEU 31 Ca -0.24 -0.77 0.04 0.00 0.05 0.00 0.00 54.13 53.21 1wnb s LEU 31 Cb 0.03 2.33 -0.02 0.00 -2.05 0.00 0.00 46.19 46.48 1wnb s LEU 31 CO 0.57 -1.19 -0.16 -1.61 -0.55 0.00 0.00 176.35 173.41 1wnb s GLU 32 N -2.42 2.55 -0.04 1.48 2.02 -1.26 -0.19 118.70 120.83 1wnb s GLU 32 Ca 0.18 -0.74 0.03 0.00 0.02 0.00 0.00 54.97 54.46 1wnb s GLU 32 Cb -0.03 -2.35 0.01 0.00 0.10 0.00 0.00 34.13 31.86 1wnb s GLU 32 CO 0.07 0.56 -0.11 0.42 0.02 0.00 0.00 175.26 176.22 1wnb s ILE 33 N -0.57 0.95 -0.06 -1.63 1.01 -0.04 -4.86 121.20 116.01 1wnb s ILE 33 Ca 0.08 -0.42 -0.30 0.00 0.00 0.00 0.00 60.65 60.01 1wnb s ILE 33 Cb -0.11 -0.86 -0.03 0.00 0.01 0.00 0.00 42.46 41.47 1wnb s ILE 33 CO 0.01 0.30 1.24 0.00 0.00 0.00 0.00 174.94 176.49 1wnb s ALA 34 N 0.37 3.52 0.85 9.38 0.00 -1.26 -1.64 121.76 132.98 1wnb s ALA 34 Ca -0.07 0.65 -0.13 0.00 0.00 0.00 0.00 51.96 52.40 1wnb s ALA 34 Cb -0.12 -3.54 0.06 0.00 0.00 0.00 0.00 23.12 19.53 1wnb s ALA 34 CO 0.02 -0.83 0.88 0.39 0.00 0.00 0.00 175.76 176.22 1wnb n GLU 35 N 5.36 -0.01 -1.85 0.00 1.02 -0.30 -3.91 120.64 120.95 1wnb n GLU 35 Ca 0.12 0.06 -0.41 0.00 -0.02 0.00 0.00 57.16 56.91 1wnb n GLU 35 Cb 0.46 -2.18 -0.01 0.00 -0.02 0.00 0.00 31.44 29.69 1wnb n GLU 35 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1wnb s ALA 36 N -2.23 3.60 0.73 0.62 0.00 -0.07 -0.74 121.76 123.67 1wnb s ALA 36 Ca 0.67 1.53 -0.11 0.00 0.00 0.00 0.00 51.96 54.04 1wnb s ALA 36 Cb -0.27 -3.60 0.03 0.00 0.00 0.00 0.00 23.12 19.28 1wnb s ALA 36 CO 0.57 -0.98 1.09 -1.54 0.00 0.00 0.00 175.76 174.91 1wnb s SER 37 N -0.06 5.19 0.25 0.00 1.04 -1.26 -4.42 113.70 114.43 1wnb s SER 37 Ca 0.54 1.20 -0.05 0.00 0.48 0.00 0.00 55.95 58.13 1wnb s SER 37 Cb -0.46 -1.99 0.47 0.00 0.10 0.00 0.00 66.02 64.14 1wnb s SER 37 CO 0.59 -1.51 1.70 0.00 0.98 0.00 0.00 173.24 174.99 1wnb h ALA 38 N -0.77 0.99 -0.35 5.32 0.00 -1.96 0.53 119.26 123.03 1wnb h ALA 38 Ca -0.45 0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.58 1wnb h ALA 38 Cb 1.25 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 19.23 1wnb h ALA 38 CO 0.62 -0.31 0.10 0.93 0.00 0.00 0.00 179.25 180.59 1wnb h GLU 39 N 0.31 0.54 -0.56 0.00 5.08 -1.99 -1.75 114.58 116.21 1wnb h GLU 39 Ca 0.42 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.65 1wnb h GLU 39 Cb 0.70 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.85 1wnb h GLU 39 CO -0.49 0.58 0.31 1.96 -1.00 0.00 0.00 179.01 180.37 1wnb h GLN 40 N 0.41 0.77 -0.65 2.33 4.20 -1.79 0.28 115.11 120.66 1wnb h GLN 40 Ca 0.11 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.74 1wnb h GLN 40 Cb 0.26 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 27.86 1wnb h GLN 40 CO -0.00 0.56 0.36 0.28 -0.67 0.00 0.00 178.83 179.36 1wnb h VAL 41 N 0.78 1.20 -0.19 -0.54 2.07 -0.31 0.28 116.25 119.53 1wnb h VAL 41 Ca 0.20 -0.49 -0.21 0.00 0.82 0.00 0.00 66.70 67.02 1wnb h VAL 41 Cb 0.02 0.35 0.01 0.00 -1.52 0.00 0.00 31.29 30.14 1wnb h VAL 41 CO -0.03 0.22 -0.71 -0.78 0.02 0.00 0.00 177.57 176.28 1wnb h ASP 42 N 0.88 0.96 -0.84 0.57 3.58 -0.64 -2.66 116.42 118.26 1wnb h ASP 42 Ca 0.23 -0.60 0.04 0.00 0.42 0.00 0.00 57.03 57.11 1wnb h ASP 42 Cb 0.02 -0.28 -0.05 0.00 1.72 0.00 0.00 39.33 40.74 1wnb h ASP 42 CO -0.04 1.40 0.54 0.00 -2.88 0.00 0.00 179.24 178.26 1wnb h ALA 43 N 0.58 1.12 -0.28 -0.78 0.00 -0.37 -1.14 119.26 118.39 1wnb h ALA 43 Ca -0.03 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.85 1wnb h ALA 43 Cb 1.34 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 1wnb h ALA 43 CO 0.15 0.36 0.17 0.00 0.00 0.00 0.00 179.25 179.93 1wnb h ALA 44 N 1.36 0.35 -0.45 0.00 0.00 -0.64 0.71 119.26 120.58 1wnb h ALA 44 Ca 0.34 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 55.11 1wnb h ALA 44 Cb 0.03 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1wnb h ALA 44 CO -0.12 -0.20 -0.24 0.28 0.00 0.00 0.00 179.25 178.97 1wnb h VAL 45 N 0.36 1.27 -0.95 0.00 2.07 -1.39 -1.25 116.25 116.36 1wnb h VAL 45 Ca 0.11 -1.40 0.02 0.00 0.82 0.00 0.00 66.70 66.25 1wnb h VAL 45 Cb -0.02 1.17 -0.05 0.00 -1.52 0.00 0.00 31.29 30.87 1wnb h VAL 45 CO -0.04 0.48 0.62 0.03 0.02 0.00 0.00 177.57 178.69 1wnb h ARG 46 N 0.82 1.20 -0.54 1.57 3.08 -0.91 0.73 114.38 120.33 1wnb h ARG 46 Ca 0.10 -0.07 -0.11 0.00 0.07 0.00 0.00 59.98 59.96 1wnb h ARG 46 Cb 0.81 -0.27 -0.02 0.00 0.08 0.00 0.00 29.97 30.57 1wnb h ARG 46 CO 0.07 0.80 -0.11 0.00 -1.07 0.00 0.00 179.97 179.65 1wnb h ALA 47 N 1.43 0.74 -0.25 0.04 0.00 -0.16 -1.08 119.26 119.98 1wnb h ALA 47 Ca 0.36 -0.35 -0.18 0.00 0.00 0.00 0.00 54.91 54.74 1wnb h ALA 47 Cb -0.07 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 1wnb h ALA 47 CO -0.09 0.66 -0.56 0.00 0.00 0.00 0.00 179.25 179.25 1wnb h ALA 48 N 0.92 0.53 -0.70 0.00 0.00 -0.96 -0.47 119.26 118.58 1wnb h ALA 48 Ca 0.14 -0.52 0.01 0.00 0.00 0.00 0.00 54.91 54.54 1wnb h ALA 48 Cb 0.68 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.36 1wnb h ALA 48 CO 0.05 0.69 0.46 0.22 0.00 0.00 0.00 179.25 180.67 1wnb h ASP 49 N 0.59 0.79 0.25 0.00 3.58 -0.73 -1.56 116.42 119.34 1wnb h ASP 49 Ca 0.01 -0.02 -0.22 0.00 0.42 0.00 0.00 57.03 57.22 1wnb h ASP 49 Cb 1.16 -0.19 0.00 0.00 1.72 0.00 0.00 39.33 42.02 1wnb h ASP 49 CO 0.12 0.57 -0.89 0.00 -2.88 0.00 0.00 179.24 176.15 1wnb h ALA 50 N 1.27 0.39 0.00 -0.78 0.00 -0.91 -2.63 119.26 116.59 1wnb h ALA 50 Ca 0.26 -0.68 -0.01 0.00 0.00 0.00 0.00 54.91 54.48 1wnb h ALA 50 Cb -0.08 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 1wnb h ALA 50 CO -0.07 0.78 -0.05 0.00 0.00 0.00 0.00 179.25 179.92 1wnb h ALA 51 N 0.74 1.23 -0.27 0.00 0.00 -0.95 -3.19 119.26 116.82 1wnb h ALA 51 Ca -0.07 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 1wnb h ALA 51 Cb 1.52 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.29 1wnb h ALA 51 CO 0.16 0.06 -0.19 0.35 0.00 0.00 0.00 179.25 179.62 1wnb h PHE 52 N 0.00 0.53 -0.82 0.00 3.57 -0.89 -1.99 116.94 117.34 1wnb h PHE 52 Ca -0.00 -0.10 0.12 0.00 3.53 0.00 0.00 57.97 61.52 1wnb h PHE 52 Cb 0.18 -0.14 -0.13 0.00 2.79 0.00 0.00 35.95 38.65 1wnb h PHE 52 CO 0.00 0.65 -0.42 0.00 -2.23 0.00 0.00 178.31 176.31 1wnb h ALA 53 N 1.36 -0.10 0.15 2.41 0.00 -1.68 0.27 119.26 121.67 1wnb h ALA 53 Ca 0.07 0.19 -0.28 0.00 0.00 0.00 0.00 54.91 54.89 1wnb h ALA 53 Cb 0.59 1.02 0.01 0.00 0.00 0.00 0.00 17.79 19.40 1wnb h ALA 53 CO 0.04 -0.74 -1.38 0.93 0.00 0.00 0.00 179.25 178.10 1wnb h GLU 54 N -0.09 0.32 -0.23 0.00 5.08 -1.79 -3.39 114.58 114.48 1wnb h GLU 54 Ca 0.26 -0.54 -0.05 0.00 -1.00 0.00 0.00 59.36 58.02 1wnb h GLU 54 Cb 0.55 0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.99 1wnb h GLU 54 CO -0.85 1.26 -0.09 2.35 -1.00 0.00 0.00 179.01 180.68 1wnb h TRP 55 N -0.18 0.38 0.00 4.33 2.91 -1.16 -2.37 115.95 119.86 1wnb h TRP 55 Ca -0.28 -0.04 0.00 0.00 1.13 0.00 0.00 58.89 59.70 1wnb h TRP 55 Cb 1.85 -0.11 0.00 0.00 -0.51 0.00 0.00 29.16 30.39 1wnb h TRP 55 CO 0.13 0.46 0.00 0.41 -1.03 0.00 0.00 178.44 178.41 1wnb n GLY 56 N -0.84 -1.18 0.65 2.65 0.00 0.07 -2.49 105.19 104.05 1wnb n GLY 56 Ca 0.00 -0.03 0.07 0.00 0.00 0.00 0.00 46.02 46.06 1wnb n GLY 56 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1wnb n GLN 57 N -1.67 1.66 -1.30 1.61 6.02 -0.90 -4.80 117.38 117.99 1wnb n GLN 57 Ca 0.04 -1.65 -0.31 0.00 -0.01 0.00 0.00 57.00 55.07 1wnb n GLN 57 Cb 0.23 -1.29 0.09 0.00 1.02 0.00 0.00 30.24 30.28 1wnb n GLN 57 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1wnb s THR 58 N -1.10 3.41 0.55 5.09 -4.23 -1.04 -5.03 115.64 113.29 1wnb s THR 58 Ca 0.21 0.46 -0.17 0.00 -1.18 0.00 0.00 61.69 61.01 1wnb s THR 58 Cb 0.13 -2.98 -0.06 0.00 1.34 0.00 0.00 72.50 70.93 1wnb s THR 58 CO 0.18 -0.60 1.03 0.42 -0.54 0.00 0.00 174.62 175.11 1wnb s THR 59 N -2.93 4.05 0.24 3.99 -4.23 -1.26 -4.96 115.64 110.54 1wnb s THR 59 Ca 0.61 1.03 -0.06 0.00 -1.18 0.00 0.00 61.69 62.09 1wnb s THR 59 Cb -0.17 -3.50 0.24 0.00 1.34 0.00 0.00 72.50 70.41 1wnb s THR 59 CO 0.56 -0.51 1.67 -0.65 -0.54 0.00 0.00 174.62 175.15 1wnb h PRO 60 N 0.83 0.21 -0.51 3.99 0.11 -1.94 -2.46 132.00 132.23 1wnb h PRO 60 Ca -0.47 -0.01 0.07 0.00 0.11 0.00 0.00 66.00 65.69 1wnb h PRO 60 Cb 1.21 -0.05 -0.06 0.00 0.11 0.00 0.00 31.00 32.21 1wnb h PRO 60 CO 0.59 0.14 0.20 -0.22 -0.21 0.00 0.00 178.00 178.50 1wnb h LYS 61 N 0.22 0.37 -0.61 1.05 3.64 -1.94 -0.98 116.57 118.33 1wnb h LYS 61 Ca 0.41 -0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 59.68 1wnb h LYS 61 Cb 0.70 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.42 1wnb h LYS 61 CO -0.54 0.25 0.03 0.28 -2.27 0.00 0.00 179.45 177.19 1wnb h VAL 62 N 0.38 1.26 -0.37 2.00 2.07 -1.84 -1.37 116.25 118.39 1wnb h VAL 62 Ca 0.24 -1.11 -0.13 0.00 0.82 0.00 0.00 66.70 66.52 1wnb h VAL 62 Cb 0.25 0.76 -0.01 0.00 -1.52 0.00 0.00 31.29 30.78 1wnb h VAL 62 CO -0.24 0.41 -0.28 0.03 0.02 0.00 0.00 177.57 177.51 1wnb h ARG 63 N 0.96 0.84 -0.53 1.57 3.08 -1.19 -2.28 114.38 116.84 1wnb h ARG 63 Ca 0.18 -0.41 0.09 0.00 0.07 0.00 0.00 59.98 59.91 1wnb h ARG 63 Cb 0.52 -0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.49 1wnb h ARG 63 CO 0.03 1.05 0.12 0.00 -1.07 0.00 0.00 179.97 180.10 1wnb h ALA 64 N 0.78 0.61 -0.86 0.04 0.00 -1.03 0.48 119.26 119.28 1wnb h ALA 64 Ca 0.07 0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.10 1wnb h ALA 64 Cb 0.85 0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.73 1wnb h ALA 64 CO 0.07 -0.29 0.57 0.93 0.00 0.00 0.00 179.25 180.54 1wnb h GLU 65 N 0.26 1.12 -0.31 0.00 5.08 -1.06 0.53 114.58 120.21 1wnb h GLU 65 Ca 0.27 -0.07 -0.10 0.00 -1.00 0.00 0.00 59.36 58.46 1wnb h GLU 65 Cb 0.36 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 1wnb h GLU 65 CO -0.33 0.74 -0.21 0.00 -1.00 0.00 0.00 179.01 178.21 1wnb h LEU 67 N 0.44 0.12 -0.71 0.00 3.38 -0.36 -1.51 115.31 116.68 1wnb h LEU 67 Ca 0.06 -0.02 -0.13 0.00 0.09 0.00 0.00 57.88 57.88 1wnb h LEU 67 Cb 0.76 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.47 1wnb h LEU 67 CO 0.06 0.25 -0.42 -0.07 0.09 0.00 0.00 178.44 178.35 1wnb h LEU 68 N 0.13 0.54 -0.55 1.67 3.38 -0.64 -1.92 115.31 117.92 1wnb h LEU 68 Ca 0.03 -0.24 -0.03 0.00 0.09 0.00 0.00 57.88 57.73 1wnb h LEU 68 Cb 0.28 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 1wnb h LEU 68 CO 0.02 0.89 0.23 0.11 0.09 0.00 0.00 178.44 179.78 1wnb h LYS 69 N 0.42 0.81 -0.19 1.13 1.79 -0.93 -1.21 116.57 118.39 1wnb h LYS 69 Ca 0.03 -0.14 -0.01 0.00 -2.18 0.00 0.00 60.65 58.35 1wnb h LYS 69 Cb 0.90 -0.13 -0.01 0.00 -1.58 0.00 0.00 32.23 31.41 1wnb h LYS 69 CO 0.08 0.70 0.08 1.25 -1.08 0.00 0.00 179.45 180.48 1wnb h LEU 70 N 0.75 0.26 -0.33 2.94 5.85 -1.21 -1.18 115.31 122.38 1wnb h LEU 70 Ca 0.18 -0.15 0.07 0.00 0.84 0.00 0.00 57.88 58.83 1wnb h LEU 70 Cb 0.18 -0.07 -0.07 0.00 0.37 0.00 0.00 40.66 41.07 1wnb h LEU 70 CO -0.02 0.33 -0.16 0.00 -0.34 0.00 0.00 178.44 178.26 1wnb h ALA 71 N 0.94 0.10 -0.37 1.25 0.00 -1.21 -0.85 119.26 119.12 1wnb h ALA 71 Ca 0.07 0.12 0.07 0.00 0.00 0.00 0.00 54.91 55.17 1wnb h ALA 71 Cb 0.15 0.39 -0.07 0.00 0.00 0.00 0.00 17.79 18.26 1wnb h ALA 71 CO -0.01 -0.54 -0.05 -0.44 0.00 0.00 0.00 179.25 178.21 1wnb h ASP 72 N -0.11 -0.26 -0.44 0.00 3.32 -0.86 -1.18 116.42 116.89 1wnb h ASP 72 Ca 0.17 0.10 -0.07 0.00 0.02 0.00 0.00 57.03 57.25 1wnb h ASP 72 Cb 0.37 0.20 -0.02 0.00 0.22 0.00 0.00 39.33 40.09 1wnb h ASP 72 CO -0.40 -0.09 0.04 0.58 -1.72 0.00 0.00 179.24 177.65 1wnb h VAL 73 N 0.04 1.24 -0.38 -1.35 2.07 -0.50 -0.77 116.25 116.59 1wnb h VAL 73 Ca 0.18 -0.95 -0.03 0.00 0.82 0.00 0.00 66.70 66.71 1wnb h VAL 73 Cb 0.26 0.81 -0.02 0.00 -1.52 0.00 0.00 31.29 30.83 1wnb h VAL 73 CO -0.35 0.34 0.12 0.40 0.02 0.00 0.00 177.57 178.10 1wnb h ILE 74 N 0.77 1.21 -0.56 4.57 2.04 -0.54 -2.73 117.51 122.28 1wnb h ILE 74 Ca 0.16 -0.70 -0.07 0.00 1.00 0.00 0.00 64.86 65.25 1wnb h ILE 74 Cb 0.41 0.95 -0.02 0.00 -0.74 0.00 0.00 36.82 37.41 1wnb h ILE 74 CO 0.01 0.24 0.09 -0.08 0.00 0.00 0.00 178.15 178.41 1wnb h GLU 75 N 0.47 0.89 0.00 2.37 4.81 -0.76 -1.75 114.58 120.62 1wnb h GLU 75 Ca 0.12 -0.22 -0.03 0.00 -0.13 0.00 0.00 59.36 59.11 1wnb h GLU 75 Cb 0.26 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.52 1wnb h GLU 75 CO -0.00 0.84 -0.13 0.93 -0.73 0.00 0.00 179.01 179.91 1wnb h GLU 76 N 0.85 0.00 -0.39 1.92 5.08 -1.13 -2.87 114.58 118.04 1wnb h GLU 76 Ca 0.17 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.43 1wnb h GLU 76 Cb 0.38 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.57 1wnb h GLU 76 CO 0.01 0.13 0.04 0.09 -1.00 0.00 0.00 179.01 178.28 1wnb n ASN 77 N -4.19 3.57 -0.20 1.42 4.13 -0.85 -4.79 115.26 114.34 1wnb n ASN 77 Ca -0.02 -3.32 0.00 0.00 1.68 0.00 0.00 54.58 52.92 1wnb n ASN 77 Cb 0.21 -0.62 0.24 0.00 -1.54 0.00 0.00 39.78 38.07 1wnb n ASN 77 CO 0.00 0.00 0.00 1.23 0.28 0.00 0.00 177.26 178.77 1wnb h GLY 78 N 1.64 1.03 0.69 7.41 0.00 -1.10 0.83 103.07 113.57 1wnb h GLY 78 Ca 0.13 -0.41 -0.02 0.00 0.00 0.00 0.00 47.33 47.03 1wnb h GLY 78 CO 0.39 0.40 -0.03 -1.61 0.00 0.00 0.00 176.54 175.68 1wnb h GLN 79 N 0.99 0.19 -0.15 4.80 5.75 -1.86 -0.11 115.11 124.72 1wnb h GLN 79 Ca 0.26 -0.08 0.00 0.00 -0.15 0.00 0.00 58.65 58.69 1wnb h GLN 79 Cb -0.06 -0.01 -0.01 0.00 1.07 0.00 0.00 27.48 28.47 1wnb h GLN 79 CO -0.05 0.53 0.10 0.28 -2.65 0.00 0.00 178.83 177.03 1wnb h VAL 80 N -0.16 1.04 -0.84 2.39 2.07 -1.85 -2.40 116.25 116.49 1wnb h VAL 80 Ca 0.02 -0.08 0.03 0.00 0.82 0.00 0.00 66.70 67.50 1wnb h VAL 80 Cb 0.47 0.83 -0.05 0.00 -1.52 0.00 0.00 31.29 31.01 1wnb h VAL 80 CO 0.01 0.04 0.54 -0.26 0.02 0.00 0.00 177.57 177.92 1wnb h PHE 81 N 0.20 1.01 0.00 1.57 0.04 -0.69 -0.99 116.94 118.08 1wnb h PHE 81 Ca 0.05 0.03 -0.06 0.00 2.80 0.00 0.00 57.97 60.79 1wnb h PHE 81 Cb -0.02 -0.33 -0.01 0.00 2.20 0.00 0.00 35.95 37.79 1wnb h PHE 81 CO -0.07 0.58 -0.30 0.00 -0.60 0.00 0.00 178.31 177.92 1wnb h ALA 82 N 1.35 1.30 0.01 2.45 0.00 -0.82 -1.69 119.26 121.86 1wnb h ALA 82 Ca 0.34 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 1wnb h ALA 82 Cb 0.02 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1wnb h ALA 82 CO -0.12 0.37 -0.21 0.93 0.00 0.00 0.00 179.25 180.22 1wnb h GLU 83 N 0.00 0.13 -0.37 0.00 5.08 -0.72 -1.74 114.58 116.96 1wnb h GLU 83 Ca -0.00 -0.15 0.04 0.00 -1.00 0.00 0.00 59.36 58.25 1wnb h GLU 83 Cb 0.60 0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.86 1wnb h GLU 83 CO 0.04 0.93 0.15 -0.07 -1.00 0.00 0.00 179.01 179.05 1wnb h LEU 84 N -0.61 0.18 -0.80 1.33 3.38 -1.12 -0.04 115.31 117.62 1wnb h LEU 84 Ca -0.03 0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 1wnb h LEU 84 Cb 1.01 0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.74 1wnb h LEU 84 CO 0.04 0.14 0.36 -0.08 0.09 0.00 0.00 178.44 178.99 1wnb h GLU 85 N 0.31 1.18 -0.05 1.13 4.57 -1.33 -1.65 114.58 118.73 1wnb h GLU 85 Ca 0.17 -0.19 -0.00 0.00 -1.18 0.00 0.00 59.36 58.16 1wnb h GLU 85 Cb 0.12 -0.20 -0.00 0.00 -0.16 0.00 0.00 28.75 28.51 1wnb h GLU 85 CO -0.15 0.93 0.03 1.03 -1.18 0.00 0.00 179.01 179.66 1wnb h SER 86 N 1.15 0.06 -0.68 1.04 0.87 -1.03 0.39 113.55 115.34 1wnb h SER 86 Ca 0.27 -0.04 -0.01 0.00 -1.23 0.00 0.00 61.79 60.79 1wnb h SER 86 Cb 0.16 -0.01 -0.03 0.00 -0.44 0.00 0.00 62.40 62.07 1wnb h SER 86 CO -0.03 0.08 0.40 0.03 -0.53 0.00 0.00 176.83 176.78 1wnb h ARG 87 N 0.03 0.94 0.00 2.24 3.08 -0.68 0.28 114.38 120.27 1wnb h ARG 87 Ca 0.02 -0.09 -0.10 0.00 0.07 0.00 0.00 59.98 59.88 1wnb h ARG 87 Cb 0.03 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 29.87 1wnb h ARG 87 CO -0.00 0.68 -0.62 -0.97 -1.07 0.00 0.00 179.97 177.98 1wnb h ASN 88 N 0.93 0.00 0.00 7.04 -0.73 -1.24 -3.37 115.58 118.22 1wnb h ASN 88 Ca 0.24 0.00 -0.00 0.00 1.87 0.00 0.00 56.30 58.41 1wnb h ASN 88 Cb -0.01 0.00 -0.00 0.00 0.27 0.00 0.00 38.32 38.58 1wnb h ASN 88 CO -0.04 0.43 -1.07 0.00 -0.37 0.00 0.00 177.43 176.37 1wnb n GLY 90 N 2.50 0.86 3.68 0.00 0.00 0.99 -4.77 105.19 108.45 1wnb n GLY 90 Ca -0.01 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.57 1wnb n GLY 90 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1wnb n LYS 91 N -2.05 2.11 -1.61 1.61 5.02 -1.25 -4.06 118.16 117.94 1wnb n LYS 91 Ca 0.00 0.75 -0.49 0.00 -2.02 0.00 0.00 58.31 56.55 1wnb n LYS 91 Cb 0.00 -2.42 -0.05 0.00 -0.02 0.00 0.00 35.03 32.54 1wnb n LYS 91 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 1wnb n PRO 92 N 2.07 1.40 -0.04 1.97 -0.02 -1.26 -4.52 135.00 134.60 1wnb n PRO 92 Ca 0.11 0.50 -0.08 0.00 -2.02 0.00 0.00 63.50 62.01 1wnb n PRO 92 Cb 0.32 -2.12 -0.03 0.00 -0.02 0.00 0.00 33.50 31.65 1wnb n PRO 92 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1wnb h LEU 93 N 4.35 -0.19 -1.40 2.45 5.85 -1.39 -1.72 115.31 123.25 1wnb h LEU 93 Ca -0.46 0.06 0.12 0.00 0.84 0.00 0.00 57.88 58.45 1wnb h LEU 93 Cb 1.32 0.12 -0.06 0.00 0.37 0.00 0.00 40.66 42.41 1wnb h LEU 93 CO 0.77 -0.07 0.53 1.12 -0.34 0.00 0.00 178.44 180.45 1wnb h HIS 94 N -0.00 0.70 -0.06 1.25 2.07 -1.90 0.24 115.15 117.45 1wnb h HIS 94 Ca 0.09 0.02 -0.03 0.00 -2.85 0.00 0.00 60.37 57.61 1wnb h HIS 94 Cb 0.15 -0.22 -0.00 0.00 2.57 0.00 0.00 27.41 29.90 1wnb h HIS 94 CO -0.22 0.29 -0.07 0.77 -3.07 0.00 0.00 177.93 175.63 1wnb h SER 95 N 0.62 0.17 -0.44 3.10 0.02 -1.82 0.11 113.55 115.31 1wnb h SER 95 Ca 0.39 -0.51 -0.02 0.00 -0.84 0.00 0.00 61.79 60.81 1wnb h SER 95 Cb 0.64 -0.05 -0.02 0.00 0.14 0.00 0.00 62.40 63.11 1wnb h SER 95 CO -0.15 0.64 0.21 0.00 -1.14 0.00 0.00 176.83 176.39 1wnb h ALA 96 N 0.53 0.56 -0.41 3.77 0.00 -0.76 0.10 119.26 123.06 1wnb h ALA 96 Ca 0.01 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 1wnb h ALA 96 Cb 0.60 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1wnb h ALA 96 CO 0.02 0.13 -0.01 0.35 0.00 0.00 0.00 179.25 179.73 1wnb h PHE 97 N 0.56 0.80 0.00 0.00 3.57 -1.01 -1.88 116.94 118.98 1wnb h PHE 97 Ca 0.15 -0.14 -0.13 0.00 3.53 0.00 0.00 57.97 61.38 1wnb h PHE 97 Cb 0.13 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 38.64 1wnb h PHE 97 CO -0.01 0.81 -1.34 0.09 -2.23 0.00 0.00 178.31 175.63 1wnb n ASN 98 N -4.42 0.82 -0.10 0.41 3.02 0.37 -4.09 115.26 111.27 1wnb n ASN 98 Ca -0.01 0.35 -0.21 0.00 -0.03 0.00 0.00 54.58 54.68 1wnb n ASN 98 Cb 0.30 0.29 -0.08 0.00 -0.61 0.00 0.00 39.78 39.68 1wnb n ASN 98 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1wnb n ASP 99 N -2.82 1.65 -0.04 6.41 8.00 0.35 -4.73 116.55 125.37 1wnb n ASP 99 Ca -0.08 0.19 -0.13 0.00 0.71 0.00 0.00 54.79 55.49 1wnb n ASP 99 Cb 0.77 -0.56 -0.11 0.00 -0.02 0.00 0.00 41.12 41.19 1wnb n ASP 99 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1wnb h GLU 100 N -0.62 -0.02 -0.23 -1.24 5.08 -1.25 -3.29 114.58 113.00 1wnb h GLU 100 Ca -0.52 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 57.90 1wnb h GLU 100 Cb 1.50 0.01 -0.07 0.00 0.50 0.00 0.00 28.75 30.69 1wnb h GLU 100 CO -0.28 0.73 -0.21 0.82 -1.00 0.00 0.00 179.01 179.07 1wnb h ILE 101 N -0.87 0.44 -0.88 3.13 1.08 -1.51 -1.51 117.51 117.39 1wnb h ILE 101 Ca -0.00 0.00 0.03 0.00 -0.39 0.00 0.00 64.86 64.49 1wnb h ILE 101 Cb 0.77 0.44 -0.05 0.00 -3.07 0.00 0.00 36.82 34.91 1wnb h ILE 101 CO 0.00 0.00 0.58 -0.65 -0.69 0.00 0.00 178.15 177.40 1wnb h PRO 102 N -0.22 1.10 -0.43 2.37 0.11 -1.77 -1.46 132.00 131.70 1wnb h PRO 102 Ca 0.13 -0.07 -0.07 0.00 0.11 0.00 0.00 66.00 66.11 1wnb h PRO 102 Cb 0.43 -0.25 -0.02 0.00 0.11 0.00 0.00 31.00 31.27 1wnb h PRO 102 CO -0.36 0.73 -0.03 0.00 -0.21 0.00 0.00 178.00 178.12 1wnb h ALA 103 N 1.47 1.15 -0.34 -0.75 0.00 -1.52 0.13 119.26 119.40 1wnb h ALA 103 Ca 0.34 -0.26 -0.14 0.00 0.00 0.00 0.00 54.91 54.85 1wnb h ALA 103 Cb -0.03 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1wnb h ALA 103 CO -0.09 0.55 -0.36 0.82 0.00 0.00 0.00 179.25 180.16 1wnb h ILE 104 N 0.66 1.28 -0.32 0.00 2.04 -0.38 -0.46 117.51 120.33 1wnb h ILE 104 Ca 0.13 -1.53 -0.15 0.00 1.00 0.00 0.00 64.86 64.31 1wnb h ILE 104 Cb 0.46 1.41 -0.01 0.00 -0.74 0.00 0.00 36.82 37.94 1wnb h ILE 104 CO 0.02 0.50 -0.41 0.58 0.00 0.00 0.00 178.15 178.85 1wnb h VAL 105 N 0.65 1.28 -0.04 1.67 2.07 -0.79 -2.88 116.25 118.21 1wnb h VAL 105 Ca 0.06 -1.58 -0.18 0.00 0.82 0.00 0.00 66.70 65.81 1wnb h VAL 105 Cb 0.92 1.47 -0.01 0.00 -1.52 0.00 0.00 31.29 32.15 1wnb h VAL 105 CO 0.08 0.52 -0.77 -0.78 0.02 0.00 0.00 177.57 176.64 1wnb h ASP 106 N 0.64 0.37 -0.52 0.57 1.82 -0.33 -2.42 116.42 116.54 1wnb h ASP 106 Ca 0.05 -0.26 0.10 0.00 -0.39 0.00 0.00 57.03 56.53 1wnb h ASP 106 Cb 0.97 -0.11 -0.08 0.00 0.68 0.00 0.00 39.33 40.78 1wnb h ASP 106 CO 0.09 1.00 0.01 0.58 -1.61 0.00 0.00 179.24 179.32 1wnb h VAL 107 N 0.20 0.60 -0.50 2.25 2.07 -0.88 0.52 116.25 120.51 1wnb h VAL 107 Ca -0.03 -0.04 -0.06 0.00 0.82 0.00 0.00 66.70 67.38 1wnb h VAL 107 Cb 1.35 0.46 -0.02 0.00 -1.52 0.00 0.00 31.29 31.56 1wnb h VAL 107 CO 0.12 0.02 0.07 -0.26 0.02 0.00 0.00 177.57 177.55 1wnb h PHE 108 N 0.13 0.89 -0.40 1.57 -1.00 -1.40 -1.61 116.94 115.12 1wnb h PHE 108 Ca 0.26 -0.13 -0.09 0.00 2.81 0.00 0.00 57.97 60.82 1wnb h PHE 108 Cb 0.40 -0.24 -0.01 0.00 3.61 0.00 0.00 35.95 39.70 1wnb h PHE 108 CO -0.31 0.82 -0.11 0.00 -1.61 0.00 0.00 178.31 177.09 1wnb h ARG 109 N 0.71 0.78 -0.06 1.51 3.08 -0.93 -1.05 114.38 118.43 1wnb h ARG 109 Ca 0.15 -0.31 0.04 0.00 0.07 0.00 0.00 59.98 59.93 1wnb h ARG 109 Cb 0.41 -0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.38 1wnb h ARG 109 CO 0.01 0.92 -0.20 0.35 -1.07 0.00 0.00 179.97 179.99 1wnb h PHE 110 N 0.59 -0.52 -0.32 3.04 3.57 0.16 -2.60 116.94 120.87 1wnb h PHE 110 Ca 0.10 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.54 1wnb h PHE 110 Cb 0.64 0.24 -0.02 0.00 2.79 0.00 0.00 35.95 39.61 1wnb h PHE 110 CO 0.05 -0.28 -0.12 0.74 -2.23 0.00 0.00 178.31 176.47 1wnb h PHE 111 N -0.28 0.60 -0.54 0.41 -1.00 -1.25 0.12 116.94 115.00 1wnb h PHE 111 Ca 0.08 -0.10 0.11 0.00 2.81 0.00 0.00 57.97 60.87 1wnb h PHE 111 Cb 0.39 -0.16 -0.09 0.00 3.61 0.00 0.00 35.95 39.70 1wnb h PHE 111 CO -0.27 0.66 -0.02 0.00 -1.61 0.00 0.00 178.31 177.06 1wnb h ALA 112 N 1.36 0.49 -0.05 2.45 0.00 -1.12 -0.93 119.26 121.46 1wnb h ALA 112 Ca 0.09 0.17 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 1wnb h ALA 112 Cb 0.52 0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 1wnb h ALA 112 CO 0.03 -0.40 0.01 0.78 0.00 0.00 0.00 179.25 179.67 1wnb h GLY 113 N 0.09 0.10 2.00 0.00 0.00 -0.88 -3.11 103.07 101.28 1wnb h GLY 113 Ca 0.27 -0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.54 1wnb h GLY 113 CO -0.47 0.06 0.00 0.00 0.00 0.00 0.00 176.54 176.13 1wnb h ALA 114 N 0.76 1.00 0.00 3.60 0.00 -0.69 -2.45 119.26 121.48 1wnb h ALA 114 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1wnb h ALA 114 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1wnb h ALA 114 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.25 1wnb h ALA 115 N 2.09 1.00 -0.02 0.00 0.00 -1.09 -2.57 119.26 118.67 1wnb h ALA 115 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1wnb h ALA 115 Cb 0.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1wnb h ALA 115 CO 0.00 0.00 -0.02 0.54 0.00 0.00 0.00 179.25 179.77 1wnb n ARG 116 N -2.70 1.01 -1.18 0.00 1.74 -0.92 -4.55 116.66 110.07 1wnb n ARG 116 Ca -0.01 -1.28 -0.05 0.00 -0.77 0.00 0.00 57.85 55.74 1wnb n ARG 116 Cb 0.12 -1.26 0.13 0.00 -1.02 0.00 0.00 32.46 30.44 1wnb n ARG 116 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1wnb s LEU 118 N -3.27 4.39 0.58 0.00 1.43 -1.26 -5.03 118.68 115.53 1wnb s LEU 118 Ca 0.42 1.57 -0.10 0.00 -1.03 0.00 0.00 54.13 54.99 1wnb s LEU 118 Cb 0.38 -3.44 -0.04 0.00 0.03 0.00 0.00 46.19 43.12 1wnb s LEU 118 CO -0.03 -0.17 0.98 0.20 0.23 0.00 0.00 176.35 177.56 1wnb s ASN 119 N 0.67 6.27 0.00 2.29 0.01 -1.26 -5.09 114.94 117.83 1wnb s ASN 119 Ca 0.47 1.34 0.00 0.00 -0.71 0.00 0.00 52.86 53.96 1wnb s ASN 119 Cb -0.21 -2.43 0.00 0.00 0.41 0.00 0.00 41.25 39.02 1wnb s ASN 119 CO 0.26 -0.79 0.00 0.61 -1.51 0.00 0.00 177.10 175.67 1wnb n GLY 120 N -2.55 2.66 3.85 0.66 0.00 -1.26 -4.94 105.19 103.60 1wnb n GLY 120 Ca 0.05 -1.21 -0.37 0.00 0.00 0.00 0.00 46.02 44.49 1wnb n GLY 120 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wnb s LEU 121 N 0.00 4.26 -0.24 0.99 1.43 -1.26 -5.05 118.68 118.81 1wnb s LEU 121 Ca 0.00 0.41 -0.40 0.00 -1.03 0.00 0.00 54.13 53.12 1wnb s LEU 121 Cb 0.00 -2.03 -0.16 0.00 0.03 0.00 0.00 46.19 44.03 1wnb s LEU 121 CO 0.00 0.40 1.71 0.00 0.23 0.00 0.00 176.35 178.69 1wnb n ALA 122 N 2.05 -0.23 -1.76 4.21 0.00 -1.26 -4.43 120.51 119.09 1wnb n ALA 122 Ca -0.20 0.40 -0.36 0.00 0.00 0.00 0.00 53.44 53.28 1wnb n ALA 122 Cb 0.55 -2.22 0.02 0.00 0.00 0.00 0.00 19.45 17.80 1wnb n ALA 122 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wnb s ALA 123 N 3.27 2.61 0.00 0.00 0.00 -1.26 -4.93 121.76 121.45 1wnb s ALA 123 Ca 0.97 0.97 0.00 0.00 0.00 0.00 0.00 51.96 53.90 1wnb s ALA 123 Cb -1.05 -3.43 0.00 0.00 0.00 0.00 0.00 23.12 18.65 1wnb s ALA 123 CO 0.63 -1.04 0.00 0.41 0.00 0.00 0.00 175.76 175.76 1wnb n GLY 124 N 0.43 -1.50 3.35 0.00 0.00 -0.03 -4.98 105.19 102.45 1wnb n GLY 124 Ca 0.13 -1.15 -0.45 0.00 0.00 0.00 0.00 46.02 44.55 1wnb n GLY 124 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1wnb n GLU 125 N -0.09 3.54 0.21 1.61 4.71 -1.26 0.26 120.64 129.62 1wnb n GLU 125 Ca 0.00 -4.37 0.07 0.00 -0.01 0.00 0.00 57.16 52.85 1wnb n GLU 125 Cb 0.00 -2.62 0.45 0.00 -1.01 0.00 0.00 31.44 28.26 1wnb n GLU 125 CO 0.00 0.00 0.00 1.88 0.09 0.00 0.00 177.13 179.10 1wnb h TYR 126 N 6.68 0.00 -3.35 -0.32 -1.99 -1.93 -3.40 116.97 112.66 1wnb h TYR 126 Ca 0.20 0.00 -0.61 0.00 2.00 0.00 0.00 58.73 60.32 1wnb h TYR 126 Cb 0.86 0.00 -0.33 0.00 2.00 0.00 0.00 36.73 39.26 1wnb h TYR 126 CO 0.81 0.30 -0.85 -1.17 -0.00 0.00 0.00 178.16 177.25 1wnb s LEU 127 N -7.37 1.90 0.07 3.88 2.96 -1.26 -5.10 118.68 113.76 1wnb s LEU 127 Ca -0.01 -0.46 -0.37 0.00 -0.22 0.00 0.00 54.13 53.06 1wnb s LEU 127 Cb 0.12 -1.18 -0.18 0.00 0.50 0.00 0.00 46.19 45.45 1wnb s LEU 127 CO 0.67 0.10 1.22 -0.62 -1.32 0.00 0.00 176.35 176.40 1wnb n GLU 128 N 3.72 0.76 -1.18 1.98 4.71 -1.26 -1.83 120.64 127.54 1wnb n GLU 128 Ca -0.20 0.28 -0.06 0.00 -0.01 0.00 0.00 57.16 57.17 1wnb n GLU 128 Cb 0.52 -1.85 -0.02 0.00 -1.01 0.00 0.00 31.44 29.08 1wnb n GLU 128 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1wnb n GLY 129 N 2.15 0.81 2.85 0.62 0.00 -1.26 -5.02 105.19 105.33 1wnb n GLY 129 Ca 0.19 -0.80 -0.16 0.00 0.00 0.00 0.00 46.02 45.24 1wnb n GLY 129 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1wnb s HIS 130 N -2.21 -0.18 -0.23 1.61 3.76 -0.76 -0.86 115.29 116.41 1wnb s HIS 130 Ca 0.00 0.60 -0.21 0.00 -0.15 0.00 0.00 55.06 55.30 1wnb s HIS 130 Cb 0.00 -0.24 -0.02 0.00 1.11 0.00 0.00 32.58 33.43 1wnb s HIS 130 CO 0.00 -0.26 0.67 0.99 -0.85 0.00 0.00 174.74 175.29 1wnb s THR 131 N 2.17 4.97 -0.13 1.30 2.01 -0.66 -4.12 115.64 121.17 1wnb s THR 131 Ca 0.02 1.23 -0.08 0.00 0.31 0.00 0.00 61.69 63.18 1wnb s THR 131 Cb -0.12 -3.97 -0.04 0.00 0.01 0.00 0.00 72.50 68.38 1wnb s THR 131 CO -0.06 0.03 0.15 -0.44 -0.69 0.00 0.00 174.62 173.61 1wnb s SER 132 N 1.37 6.38 0.19 3.53 0.01 0.14 -0.66 113.70 124.65 1wnb s SER 132 Ca 0.29 0.45 0.07 0.00 1.31 0.00 0.00 55.95 58.07 1wnb s SER 132 Cb -0.16 -2.08 -0.04 0.00 0.21 0.00 0.00 66.02 63.95 1wnb s SER 132 CO 0.09 0.38 -0.14 0.00 0.41 0.00 0.00 173.24 173.97 1wnb s MET 133 N -0.86 1.27 -0.09 12.44 0.23 0.22 -0.85 119.30 131.66 1wnb s MET 133 Ca 0.14 -1.52 0.04 0.00 -1.03 0.00 0.00 55.69 53.32 1wnb s MET 133 Cb -0.12 -1.08 -0.01 0.00 -1.53 0.00 0.00 34.83 32.10 1wnb s MET 133 CO 0.04 0.18 -0.22 0.42 -2.03 0.00 0.00 175.02 173.41 1wnb s ILE 134 N -2.81 2.32 0.25 3.16 -1.09 -1.26 -1.80 121.20 119.97 1wnb s ILE 134 Ca 0.20 -0.95 0.11 0.00 -2.23 0.00 0.00 60.65 57.78 1wnb s ILE 134 Cb -0.01 -1.89 -0.05 0.00 -1.58 0.00 0.00 42.46 38.93 1wnb s ILE 134 CO 0.06 0.56 -0.15 -0.13 -1.23 0.00 0.00 174.94 174.04 1wnb s ARG 135 N 0.10 1.83 -0.35 2.79 0.52 0.68 -4.73 118.95 119.78 1wnb s ARG 135 Ca -0.10 -1.60 0.03 0.00 -0.52 0.00 0.00 55.73 53.53 1wnb s ARG 135 Cb -0.16 -1.91 0.10 0.00 0.52 0.00 0.00 34.95 33.51 1wnb s ARG 135 CO 0.06 0.36 0.09 1.03 0.02 0.00 0.00 175.30 176.86 1wnb s ARG 136 N -3.35 1.31 0.21 3.54 0.52 -1.26 -1.55 118.95 118.37 1wnb s ARG 136 Ca 0.28 -1.74 0.05 0.00 -0.52 0.00 0.00 55.73 53.81 1wnb s ARG 136 Cb -0.06 -2.85 -0.04 0.00 0.52 0.00 0.00 34.95 32.53 1wnb s ARG 136 CO 0.15 -0.98 0.23 -0.51 0.02 0.00 0.00 175.30 174.21 1wnb s ASP 137 N 0.95 5.81 0.75 0.23 1.01 -0.79 -4.85 116.67 119.78 1wnb s ASP 137 Ca 0.12 -0.09 -0.11 0.00 0.71 0.00 0.00 52.55 53.18 1wnb s ASP 137 Cb -0.19 -1.58 0.04 0.00 1.01 0.00 0.00 42.92 42.19 1wnb s ASP 137 CO -0.11 -0.00 1.08 -2.16 0.21 0.00 0.00 175.17 174.18 1wnb s PRO 138 N -3.59 2.48 -0.01 8.23 0.04 -1.25 0.62 135.00 141.52 1wnb s PRO 138 Ca 0.33 0.84 0.11 0.00 0.04 0.00 0.00 61.00 62.32 1wnb s PRO 138 Cb -0.09 -1.95 -0.23 0.00 0.04 0.00 0.00 34.50 32.28 1wnb s PRO 138 CO 0.26 -1.39 0.80 -0.07 0.04 0.00 0.00 177.00 176.64 1wnb h LEU 139 N -0.93 0.01 0.00 -3.56 3.38 -1.88 -3.43 115.31 108.90 1wnb h LEU 139 Ca -0.45 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.50 1wnb h LEU 139 Cb 1.24 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.98 1wnb h LEU 139 CO 0.57 1.02 0.00 0.61 0.09 0.00 0.00 178.44 180.73 1wnb n GLY 140 N 1.52 0.22 3.65 0.83 0.00 -1.26 -4.87 105.19 105.27 1wnb n GLY 140 Ca -0.13 -1.34 -0.40 0.00 0.00 0.00 0.00 46.02 44.15 1wnb n GLY 140 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wnb s VAL 141 N 0.00 5.07 -0.21 1.61 1.01 -1.26 -2.25 120.40 124.37 1wnb s VAL 141 Ca 0.00 0.99 -0.10 0.00 0.00 0.00 0.00 61.98 62.86 1wnb s VAL 141 Cb 0.00 -3.86 -0.05 0.00 0.00 0.00 0.00 36.38 32.47 1wnb s VAL 141 CO 0.00 0.13 0.14 -0.69 0.00 0.00 0.00 175.10 174.68 1wnb s VAL 142 N 1.96 5.39 -0.27 2.92 1.01 0.92 -1.39 120.40 130.94 1wnb s VAL 142 Ca 0.24 0.20 -0.17 0.00 0.00 0.00 0.00 61.98 62.25 1wnb s VAL 142 Cb -0.16 -3.48 -0.03 0.00 0.00 0.00 0.00 36.38 32.71 1wnb s VAL 142 CO 0.09 0.41 0.46 0.00 0.00 0.00 0.00 175.10 176.06 1wnb s ALA 143 N 0.58 3.57 -0.16 5.51 0.00 -0.03 -1.04 121.76 130.19 1wnb s ALA 143 Ca 0.08 -0.71 -0.03 0.00 0.00 0.00 0.00 51.96 51.30 1wnb s ALA 143 Cb -0.12 -2.83 -0.02 0.00 0.00 0.00 0.00 23.12 20.15 1wnb s ALA 143 CO 0.00 -0.73 -0.05 -1.12 0.00 0.00 0.00 175.76 173.86 1wnb s SER 144 N 1.59 4.61 -0.17 0.00 0.01 0.05 -0.81 113.70 118.97 1wnb s SER 144 Ca 0.19 -0.20 0.01 0.00 1.31 0.00 0.00 55.95 57.25 1wnb s SER 144 Cb -0.16 -1.75 0.03 0.00 0.21 0.00 0.00 66.02 64.35 1wnb s SER 144 CO 0.10 0.14 -0.14 -0.63 0.41 0.00 0.00 173.24 173.11 1wnb s ILE 145 N 0.56 1.72 0.07 1.44 -1.09 0.14 -0.36 121.20 123.67 1wnb s ILE 145 Ca -0.04 -0.83 0.05 0.00 -2.23 0.00 0.00 60.65 57.60 1wnb s ILE 145 Cb -0.15 -1.65 -0.04 0.00 -1.58 0.00 0.00 42.46 39.05 1wnb s ILE 145 CO 0.03 0.38 -0.06 0.00 -1.23 0.00 0.00 174.94 174.06 1wnb s ALA 146 N 1.41 3.09 0.81 9.38 0.00 -0.66 -2.58 121.76 133.21 1wnb s ALA 146 Ca 0.03 -1.14 -0.06 0.00 0.00 0.00 0.00 51.96 50.79 1wnb s ALA 146 Cb -0.14 -1.06 0.14 0.00 0.00 0.00 0.00 23.12 22.07 1wnb s ALA 146 CO -0.10 0.65 0.92 -0.35 0.00 0.00 0.00 175.76 176.88 1wnb n PRO 147 N 0.89 -0.44 0.00 0.00 -0.04 -1.22 -2.52 135.00 131.67 1wnb n PRO 147 Ca -0.13 -1.96 0.09 0.00 -0.04 0.00 0.00 63.50 61.46 1wnb n PRO 147 Cb 0.52 -0.78 -0.02 0.00 -0.04 0.00 0.00 33.50 33.18 1wnb n PRO 147 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1wnb n TRP 148 N -2.97 0.00 0.01 0.54 4.27 -1.26 -4.20 117.44 113.83 1wnb n TRP 148 Ca 0.13 0.00 -0.18 0.00 -3.89 0.00 0.00 57.50 53.56 1wnb n TRP 148 Cb 0.47 0.00 -0.11 0.00 -1.36 0.00 0.00 31.31 30.31 1wnb n TRP 148 CO 0.00 0.00 0.00 -2.95 -2.29 0.00 0.00 177.69 172.45 1wnb h ASN 149 N 1.70 0.63 -2.37 -0.67 -1.07 -1.96 -3.39 115.58 108.45 1wnb h ASN 149 Ca 0.00 -0.76 -0.59 0.00 0.07 0.00 0.00 56.30 55.03 1wnb h ASN 149 Cb 0.58 -0.19 -0.40 0.00 -2.07 0.00 0.00 38.32 36.24 1wnb h ASN 149 CO 0.00 1.31 -0.87 -1.22 0.07 0.00 0.00 177.43 176.72 1wnb n TYR 150 N -4.12 0.81 0.17 4.14 4.01 -1.26 -5.04 117.16 115.87 1wnb n TYR 150 Ca -0.11 -3.72 -0.14 0.00 -0.16 0.00 0.00 57.90 53.78 1wnb n TYR 150 Cb 0.73 -0.22 -0.07 0.00 -0.31 0.00 0.00 39.34 39.47 1wnb n TYR 150 CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 1wnb h PRO 151 N 4.87 -0.55 -0.23 -0.72 0.11 -1.77 -0.48 132.00 133.23 1wnb h PRO 151 Ca 0.18 0.04 -0.14 0.00 0.11 0.00 0.00 66.00 66.19 1wnb h PRO 151 Cb 0.83 0.12 -0.00 0.00 0.11 0.00 0.00 31.00 32.06 1wnb h PRO 151 CO 0.54 -0.37 -0.39 1.25 -0.21 0.00 0.00 178.00 178.83 1wnb h LEU 152 N -0.57 0.74 -0.43 2.35 6.46 -1.92 -2.39 115.31 119.55 1wnb h LEU 152 Ca 0.00 -0.53 0.03 0.00 -0.12 0.00 0.00 57.88 57.26 1wnb h LEU 152 Cb 0.54 -0.21 -0.03 0.00 -0.73 0.00 0.00 40.66 40.23 1wnb h LEU 152 CO -0.09 1.13 0.23 -0.03 -0.62 0.00 0.00 178.44 179.06 1wnb h MET 153 N 0.37 0.45 -0.05 1.25 4.05 -1.94 -0.95 114.93 118.11 1wnb h MET 153 Ca 0.02 -0.03 -0.13 0.00 -0.28 0.00 0.00 59.70 59.27 1wnb h MET 153 Cb 0.99 -0.10 -0.01 0.00 -0.80 0.00 0.00 31.60 31.67 1wnb h MET 153 CO 0.09 0.30 -0.58 0.52 0.23 0.00 0.00 176.91 177.46 1wnb h MET 154 N 0.46 0.16 -0.55 0.39 2.86 -1.06 -0.82 114.93 116.37 1wnb h MET 154 Ca 0.18 -0.10 0.00 0.00 -2.06 0.00 0.00 59.70 57.72 1wnb h MET 154 Cb 0.06 0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.70 1wnb h MET 154 CO -0.11 0.69 0.35 0.00 1.06 0.00 0.00 176.91 178.90 1wnb h ALA 155 N 1.28 0.70 -0.34 6.32 0.00 -1.03 -1.54 119.26 124.64 1wnb h ALA 155 Ca -0.00 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 1wnb h ALA 155 Cb 1.06 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 1wnb h ALA 155 CO 0.09 0.17 0.20 0.00 0.00 0.00 0.00 179.25 179.70 1wnb h ALA 156 N 1.18 0.44 -0.28 0.00 0.00 -0.63 0.43 119.26 120.39 1wnb h ALA 156 Ca 0.20 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1wnb h ALA 156 Cb -0.04 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1wnb h ALA 156 CO -0.04 -0.05 0.11 -1.49 0.00 0.00 0.00 179.25 177.79 1wnb h TRP 157 N 0.44 0.38 0.05 0.00 4.06 -0.77 0.18 115.95 120.29 1wnb h TRP 157 Ca 0.12 -0.01 -0.08 0.00 2.06 0.00 0.00 58.89 60.99 1wnb h TRP 157 Cb 0.03 -0.12 0.01 0.00 -1.00 0.00 0.00 29.16 28.08 1wnb h TRP 157 CO -0.03 0.30 -0.34 0.87 -3.56 0.00 0.00 178.44 175.68 1wnb h LYS 158 N 0.39 0.14 -0.14 0.49 1.57 -1.09 -3.40 116.57 114.52 1wnb h LYS 158 Ca 0.10 -0.22 -0.01 0.00 -1.87 0.00 0.00 60.65 58.65 1wnb h LYS 158 Cb 0.08 0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 1wnb h LYS 158 CO -0.01 1.08 0.06 -0.07 -0.57 0.00 0.00 179.45 179.93 1wnb h LEU 159 N -0.69 0.20 0.85 2.94 3.38 0.30 -3.28 115.31 119.02 1wnb h LEU 159 Ca -0.06 -0.16 -0.04 0.00 0.09 0.00 0.00 57.88 57.71 1wnb h LEU 159 Cb 1.24 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.94 1wnb h LEU 159 CO 0.06 0.30 -0.48 0.00 0.09 0.00 0.00 178.44 178.42 1wnb h ALA 160 N 0.90 -1.30 -0.70 1.53 0.00 -0.87 -1.46 119.26 117.37 1wnb h ALA 160 Ca 0.05 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.63 1wnb h ALA 160 Cb 0.17 0.57 -0.03 0.00 0.00 0.00 0.00 17.79 18.49 1wnb h ALA 160 CO -0.00 -1.24 0.20 -1.00 0.00 0.00 0.00 179.25 177.20 1wnb h PRO 161 N -1.23 1.09 -0.66 0.00 0.13 -1.77 -0.97 132.00 128.59 1wnb h PRO 161 Ca -0.12 -0.24 -0.00 0.00 -0.87 0.00 0.00 66.00 64.77 1wnb h PRO 161 Cb 0.97 -0.16 -0.03 0.00 0.13 0.00 0.00 31.00 31.91 1wnb h PRO 161 CO 0.15 0.95 0.40 0.00 -0.23 0.00 0.00 178.00 179.26 1wnb h ALA 162 N 1.16 0.84 -0.37 -0.56 0.00 -1.59 0.29 119.26 119.03 1wnb h ALA 162 Ca 0.22 -0.07 -0.15 0.00 0.00 0.00 0.00 54.91 54.91 1wnb h ALA 162 Cb 0.33 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1wnb h ALA 162 CO -0.00 0.31 -0.36 -0.07 0.00 0.00 0.00 179.25 179.12 1wnb h LEU 163 N 0.89 0.92 -1.06 0.00 3.38 -1.14 -1.78 115.31 116.52 1wnb h LEU 163 Ca 0.24 -0.41 -0.05 0.00 0.09 0.00 0.00 57.88 57.75 1wnb h LEU 163 Cb -0.04 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.43 1wnb h LEU 163 CO -0.05 1.18 0.12 0.00 0.09 0.00 0.00 178.44 179.78 1wnb h ALA 164 N 0.87 1.24 0.00 1.53 0.00 -0.71 -1.28 119.26 120.91 1wnb h ALA 164 Ca 0.06 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1wnb h ALA 164 Cb 0.93 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1wnb h ALA 164 CO 0.09 0.53 0.00 0.00 0.00 0.00 0.00 179.25 179.86 1wnb n ALA 165 N -2.46 1.97 -0.19 0.00 0.00 0.05 -4.82 120.51 115.06 1wnb n ALA 165 Ca 0.04 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1wnb n ALA 165 Cb 0.23 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.35 1wnb n ALA 165 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wnb n GLY 166 N 0.55 0.87 3.90 0.00 0.00 -0.48 -3.91 105.19 106.11 1wnb n GLY 166 Ca 0.06 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.80 1wnb n GLY 166 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1wnb s ASN 167 N -2.13 5.89 0.04 1.61 -0.87 -0.68 -3.76 114.94 115.04 1wnb s ASN 167 Ca 0.00 0.97 -0.01 0.00 -1.57 0.00 0.00 52.86 52.25 1wnb s ASN 167 Cb 0.00 -2.04 -0.04 0.00 -0.02 0.00 0.00 41.25 39.15 1wnb s ASN 167 CO 0.00 -0.92 0.20 0.00 -2.57 0.00 0.00 177.10 173.80 1wnb s VAL 169 N -1.44 1.28 -0.22 0.00 1.01 0.14 -0.06 120.40 121.11 1wnb s VAL 169 Ca 0.32 -0.73 0.01 0.00 0.00 0.00 0.00 61.98 61.58 1wnb s VAL 169 Cb -0.13 -1.07 0.05 0.00 0.00 0.00 0.00 36.38 35.23 1wnb s VAL 169 CO 0.25 0.33 -0.08 -0.69 0.00 0.00 0.00 175.10 174.90 1wnb s VAL 170 N -0.43 1.64 -0.18 2.92 1.01 -0.21 -0.97 120.40 124.18 1wnb s VAL 170 Ca 0.06 -1.16 -0.07 0.00 0.00 0.00 0.00 61.98 60.81 1wnb s VAL 170 Cb -0.06 -1.80 -0.04 0.00 0.00 0.00 0.00 36.38 34.48 1wnb s VAL 170 CO -0.00 0.03 0.04 -0.22 0.00 0.00 0.00 175.10 174.95 1wnb s LEU 171 N 1.37 3.69 -0.26 3.92 2.96 0.44 -0.77 118.68 130.02 1wnb s LEU 171 Ca -0.04 0.02 -0.01 0.00 -0.22 0.00 0.00 54.13 53.88 1wnb s LEU 171 Cb -0.18 -1.93 0.04 0.00 0.50 0.00 0.00 46.19 44.62 1wnb s LEU 171 CO -0.07 0.16 -0.06 -0.75 -1.32 0.00 0.00 176.35 174.31 1wnb s LYS 172 N 0.45 2.67 1.05 1.98 2.20 0.52 -1.76 119.74 126.85 1wnb s LYS 172 Ca 0.02 -1.09 -0.14 0.00 -0.36 0.00 0.00 55.97 54.40 1wnb s LYS 172 Cb -0.13 -3.00 0.21 0.00 -1.51 0.00 0.00 37.83 33.41 1wnb s LYS 172 CO 0.01 -0.46 1.11 -2.14 -0.36 0.00 0.00 175.35 173.50 1wnb s PRO 173 N 1.28 0.02 0.19 4.03 0.02 -1.26 -1.65 135.00 137.62 1wnb s PRO 173 Ca -0.02 0.30 -0.30 0.00 0.02 0.00 0.00 61.00 60.99 1wnb s PRO 173 Cb -0.18 -1.71 -0.09 0.00 0.02 0.00 0.00 34.50 32.54 1wnb s PRO 173 CO -0.04 -2.96 1.41 0.45 -0.33 0.00 0.00 177.00 175.53 1wnb s SER 174 N -3.67 6.75 0.45 2.53 0.15 -1.05 -4.70 113.70 114.15 1wnb s SER 174 Ca 0.67 2.51 0.21 0.00 0.70 0.00 0.00 55.95 60.05 1wnb s SER 174 Cb -0.16 -2.61 1.16 0.00 -1.71 0.00 0.00 66.02 62.71 1wnb s SER 174 CO 0.57 -0.66 1.61 1.05 1.20 0.00 0.00 173.24 177.00 1wnb h GLU 175 N 5.75 0.00 0.17 5.44 9.09 -1.91 -2.08 114.58 131.04 1wnb h GLU 175 Ca -0.44 0.00 -0.32 0.00 0.05 0.00 0.00 59.36 58.65 1wnb h GLU 175 Cb 1.21 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 28.32 1wnb h GLU 175 CO 0.81 0.00 -1.52 0.82 0.05 0.00 0.00 179.01 179.17 1wnb h ILE 176 N 0.00 1.19 -2.09 -1.06 1.08 -1.91 -3.42 117.51 111.30 1wnb h ILE 176 Ca 0.00 -2.75 -0.54 0.00 -0.39 0.00 0.00 64.86 61.18 1wnb h ILE 176 Cb 0.48 2.86 -0.41 0.00 -3.07 0.00 0.00 36.82 36.69 1wnb h ILE 176 CO 0.00 0.84 -0.97 0.35 -0.69 0.00 0.00 178.15 177.68 1wnb n THR 177 N -3.56 0.81 0.90 -0.27 -2.24 -0.79 -4.52 114.28 104.61 1wnb n THR 177 Ca -0.17 -4.78 0.13 0.00 -2.27 0.00 0.00 64.05 56.96 1wnb n THR 177 Cb 1.06 -1.16 0.35 0.00 -2.10 0.00 0.00 70.33 68.49 1wnb n THR 177 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1wnb n PRO 178 N 0.49 0.07 -0.15 -0.78 -0.04 -1.15 -4.50 135.00 128.93 1wnb n PRO 178 Ca 0.26 0.03 -0.06 0.00 -0.04 0.00 0.00 63.50 63.69 1wnb n PRO 178 Cb 0.53 -1.55 0.03 0.00 -0.04 0.00 0.00 33.50 32.47 1wnb n PRO 178 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1wnb h LEU 179 N 0.00 0.42 -1.17 1.53 3.38 -1.91 -0.91 115.31 116.65 1wnb h LEU 179 Ca 0.00 0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 1wnb h LEU 179 Cb 0.56 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 1wnb h LEU 179 CO 0.00 0.30 0.02 0.71 0.09 0.00 0.00 178.44 179.56 1wnb h THR 180 N 0.53 1.20 -0.53 0.22 1.35 -1.89 -1.47 112.91 112.33 1wnb h THR 180 Ca 0.19 -0.80 -0.06 0.00 -0.55 0.00 0.00 66.41 65.18 1wnb h THR 180 Cb 0.03 0.89 -0.02 0.00 -1.73 0.00 0.00 68.15 67.32 1wnb h THR 180 CO -0.09 0.28 0.09 0.00 -0.25 0.00 0.00 175.52 175.55 1wnb h ALA 181 N 1.46 0.70 0.00 6.62 0.00 -1.71 0.28 119.26 126.61 1wnb h ALA 181 Ca 0.12 -0.24 -0.15 0.00 0.00 0.00 0.00 54.91 54.64 1wnb h ALA 181 Cb 0.33 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1wnb h ALA 181 CO 0.01 0.44 -0.72 -0.07 0.00 0.00 0.00 179.25 178.91 1wnb h LEU 182 N 0.76 0.00 -0.58 0.00 3.38 -0.92 -0.39 115.31 117.56 1wnb h LEU 182 Ca 0.16 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.99 1wnb h LEU 182 Cb 0.40 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 1wnb h LEU 182 CO 0.01 0.72 -0.34 0.50 0.09 0.00 0.00 178.44 179.42 1wnb h LYS 183 N 0.00 0.76 -0.92 1.13 1.63 -1.03 -2.58 116.57 115.56 1wnb h LYS 183 Ca -0.01 -0.37 0.04 0.00 -0.85 0.00 0.00 60.65 59.47 1wnb h LYS 183 Cb 1.31 -0.00 -0.06 0.00 -0.60 0.00 0.00 32.23 32.88 1wnb h LYS 183 CO 0.09 0.99 0.59 1.25 -3.45 0.00 0.00 179.45 178.93 1wnb h LEU 184 N 0.64 0.98 0.13 5.20 5.85 -0.16 -2.03 115.31 125.92 1wnb h LEU 184 Ca 0.07 -0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.79 1wnb h LEU 184 Cb 0.88 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.68 1wnb h LEU 184 CO 0.08 0.66 -0.15 0.00 -0.34 0.00 0.00 178.44 178.68 1wnb h ALA 185 N 1.39 -0.28 -0.19 1.25 0.00 -0.81 0.41 119.26 121.02 1wnb h ALA 185 Ca 0.38 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.26 1wnb h ALA 185 Cb 0.05 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1wnb h ALA 185 CO -0.14 -0.68 0.12 1.49 0.00 0.00 0.00 179.25 180.04 1wnb h GLU 186 N -0.32 0.24 -0.46 0.00 4.81 -1.41 -2.59 114.58 114.85 1wnb h GLU 186 Ca 0.01 -0.01 -0.11 0.00 -0.13 0.00 0.00 59.36 59.11 1wnb h GLU 186 Cb 0.31 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.63 1wnb h GLU 186 CO -0.05 0.16 -0.16 -0.07 -0.73 0.00 0.00 179.01 178.16 1wnb h LEU 187 N 0.24 0.89 -1.16 1.64 3.38 -0.98 -3.26 115.31 116.06 1wnb h LEU 187 Ca 0.07 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 57.74 1wnb h LEU 187 Cb -0.01 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.49 1wnb h LEU 187 CO -0.03 1.04 -0.28 0.00 0.09 0.00 0.00 178.44 179.26 1wnb n ALA 188 N -2.50 3.12 -0.19 1.53 0.00 0.10 -4.67 120.51 117.90 1wnb n ALA 188 Ca 0.01 -0.60 -0.00 0.00 0.00 0.00 0.00 53.44 52.84 1wnb n ALA 188 Cb 0.41 -0.88 0.02 0.00 0.00 0.00 0.00 19.45 19.00 1wnb n ALA 188 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1wnb n LYS 189 N 0.25 -0.12 -0.44 0.00 4.81 -0.98 -1.70 118.16 119.98 1wnb n LYS 189 Ca 0.12 0.78 0.09 0.00 -0.87 0.00 0.00 58.31 58.42 1wnb n LYS 189 Cb 0.47 -1.16 0.28 0.00 0.02 0.00 0.00 35.03 34.65 1wnb n LYS 189 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1wnb n ASP 190 N -4.75 4.04 0.10 3.14 8.00 -1.26 -4.51 116.55 121.31 1wnb n ASP 190 Ca 0.05 -2.36 -0.24 0.00 0.71 0.00 0.00 54.79 52.96 1wnb n ASP 190 Cb 0.20 -0.47 -0.15 0.00 -0.02 0.00 0.00 41.12 40.68 1wnb n ASP 190 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 1wnb h ILE 191 N 3.21 1.11 -2.33 0.53 2.04 -1.66 -3.46 117.51 116.96 1wnb h ILE 191 Ca 0.00 -2.59 -0.53 0.00 1.00 0.00 0.00 64.86 62.74 1wnb h ILE 191 Cb 1.20 2.90 -0.06 0.00 -0.74 0.00 0.00 36.82 40.13 1wnb h ILE 191 CO 0.14 0.83 -0.55 -0.36 0.00 0.00 0.00 178.15 178.21 1wnb s PHE 192 N -2.58 3.08 0.80 1.37 0.40 -1.26 -4.95 117.98 114.85 1wnb s PHE 192 Ca -0.13 -0.10 -0.13 0.00 -0.60 0.00 0.00 56.93 55.97 1wnb s PHE 192 Cb 0.05 -1.41 0.08 0.00 0.51 0.00 0.00 43.02 42.25 1wnb s PHE 192 CO 0.89 0.53 1.20 -2.14 0.70 0.00 0.00 175.22 176.40 1wnb s PRO 193 N -3.65 1.66 -0.31 0.24 0.02 -1.26 -4.85 135.00 126.86 1wnb s PRO 193 Ca 0.32 1.74 -0.42 0.00 0.02 0.00 0.00 61.00 62.66 1wnb s PRO 193 Cb -0.08 -1.78 -0.18 0.00 0.02 0.00 0.00 34.50 32.48 1wnb s PRO 193 CO 0.24 -2.19 1.61 0.00 -0.33 0.00 0.00 177.00 176.33 1wnb n ALA 194 N -3.29 -0.90 0.00 -1.55 0.00 -1.26 -2.07 120.51 111.44 1wnb n ALA 194 Ca 0.13 0.45 0.00 0.00 0.00 0.00 0.00 53.44 54.02 1wnb n ALA 194 Cb 0.51 -2.07 0.00 0.00 0.00 0.00 0.00 19.45 17.88 1wnb n ALA 194 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wnb n GLY 195 N 3.80 2.51 0.27 0.00 0.00 -1.26 -4.68 105.19 105.83 1wnb n GLY 195 Ca 0.27 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.17 1wnb n GLY 195 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1wnb h VAL 196 N 0.00 1.27 -3.22 1.61 2.07 -1.71 -3.26 116.25 113.01 1wnb h VAL 196 Ca 0.00 -1.37 -0.67 0.00 0.82 0.00 0.00 66.70 65.47 1wnb h VAL 196 Cb 0.00 1.18 -0.33 0.00 -1.52 0.00 0.00 31.29 30.62 1wnb h VAL 196 CO 0.00 0.47 -0.85 -0.69 0.02 0.00 0.00 177.57 176.52 1wnb s VAL 197 N -4.65 2.20 -0.02 2.57 1.01 -1.26 0.24 120.40 120.49 1wnb s VAL 197 Ca -0.12 -0.93 0.04 0.00 0.00 0.00 0.00 61.98 60.97 1wnb s VAL 197 Cb 0.12 -1.89 -0.01 0.00 0.00 0.00 0.00 36.38 34.60 1wnb s VAL 197 CO 0.86 0.54 -0.14 0.20 0.00 0.00 0.00 175.10 176.56 1wnb s ASN 198 N 0.80 1.72 -0.07 3.32 0.01 -0.15 -4.67 114.94 115.91 1wnb s ASN 198 Ca -0.07 -0.27 0.02 0.00 -0.71 0.00 0.00 52.86 51.83 1wnb s ASN 198 Cb -0.16 -0.34 0.01 0.00 0.41 0.00 0.00 41.25 41.18 1wnb s ASN 198 CO -0.01 0.15 -0.14 -0.63 -1.51 0.00 0.00 177.10 174.95 1wnb s ILE 199 N -0.11 1.29 0.33 0.60 1.01 0.69 -0.42 121.20 124.58 1wnb s ILE 199 Ca 0.01 -0.57 0.00 0.00 0.00 0.00 0.00 60.65 60.10 1wnb s ILE 199 Cb -0.08 -1.17 0.00 0.00 0.01 0.00 0.00 42.46 41.23 1wnb s ILE 199 CO 0.00 0.39 0.04 0.18 0.00 0.00 0.00 174.94 175.55 1wnb n LEU 200 N 3.81 0.00 -3.82 2.97 4.77 -0.72 -1.12 117.00 122.89 1wnb n LEU 200 Ca -0.22 -2.00 -0.12 0.00 -0.03 0.00 0.00 56.01 53.64 1wnb n LEU 200 Cb 0.52 0.19 -0.11 0.00 -2.33 0.00 0.00 43.42 41.68 1wnb n LEU 200 CO 0.26 -0.31 -0.15 0.12 -1.33 0.00 0.00 177.39 175.97 1wnb s PHE 201 N -2.10 -0.14 0.00 -1.77 2.19 -1.26 -4.33 117.98 110.57 1wnb s PHE 201 Ca 0.03 0.32 0.00 0.00 0.33 0.00 0.00 56.93 57.61 1wnb s PHE 201 Cb -0.00 0.04 0.00 0.00 -1.31 0.00 0.00 43.02 41.75 1wnb s PHE 201 CO 0.02 -0.16 0.00 0.41 1.83 0.00 0.00 175.22 177.32 1wnb n GLY 202 N 2.50 2.05 3.80 13.12 0.00 -1.26 -0.89 105.19 124.52 1wnb n GLY 202 Ca -0.16 -1.42 -0.29 0.00 0.00 0.00 0.00 46.02 44.15 1wnb n GLY 202 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wnb s ARG 203 N -1.91 1.24 0.11 1.61 0.52 -1.26 -4.05 118.95 115.21 1wnb s ARG 203 Ca 0.00 0.26 -0.19 0.00 -0.52 0.00 0.00 55.73 55.27 1wnb s ARG 203 Cb 0.00 -1.85 -0.06 0.00 0.52 0.00 0.00 34.95 33.55 1wnb s ARG 203 CO 0.00 -2.12 1.73 0.78 0.02 0.00 0.00 175.30 175.70 1wnb h GLY 204 N -1.44 0.34 1.67 -3.53 0.00 -1.96 -0.57 103.07 97.57 1wnb h GLY 204 Ca -0.50 -0.15 -0.17 0.00 0.00 0.00 0.00 47.33 46.52 1wnb h GLY 204 CO 0.62 0.14 -0.67 0.50 0.00 0.00 0.00 176.54 177.14 1wnb h LYS 205 N 0.27 0.33 0.00 4.80 1.57 -1.95 0.26 116.57 121.86 1wnb h LYS 205 Ca 0.08 -0.25 -0.22 0.00 -1.87 0.00 0.00 60.65 58.39 1wnb h LYS 205 Cb 0.05 0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.36 1wnb h LYS 205 CO -0.01 0.88 -1.96 -2.37 -0.57 0.00 0.00 179.45 175.42 1wnb n THR 206 N -3.85 1.03 0.00 -0.16 5.66 -1.15 -4.33 114.28 111.47 1wnb n THR 206 Ca -0.03 -0.72 0.00 0.00 -3.05 0.00 0.00 64.05 60.24 1wnb n THR 206 Cb 0.67 -0.48 0.00 0.00 -1.55 0.00 0.00 70.33 68.97 1wnb n THR 206 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 175.07 172.54 1wnb n VAL 207 N -2.70 0.00 -0.06 1.08 0.31 -0.26 -4.69 118.33 112.01 1wnb n VAL 207 Ca -0.18 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.01 1wnb n VAL 207 Cb 0.92 -0.57 -0.07 0.00 -0.91 0.00 0.00 33.84 33.21 1wnb n VAL 207 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 1wnb h GLY 208 N 0.00 0.45 0.35 2.92 0.00 -0.52 -2.60 103.07 103.66 1wnb h GLY 208 Ca 0.00 -0.48 0.05 0.00 0.00 0.00 0.00 47.33 46.90 1wnb h GLY 208 CO 0.00 0.43 -0.20 -0.55 0.00 0.00 0.00 176.54 176.22 1wnb h ASP 209 N 0.04 -0.62 0.43 0.19 3.32 -0.79 0.66 116.42 119.65 1wnb h ASP 209 Ca 0.02 0.11 -0.04 0.00 0.02 0.00 0.00 57.03 57.14 1wnb h ASP 209 Cb 0.75 0.29 -0.01 0.00 0.22 0.00 0.00 39.33 40.58 1wnb h ASP 209 CO 0.05 -0.25 -0.18 1.55 -1.72 0.00 0.00 179.24 178.68 1wnb h PRO 210 N -0.25 0.00 0.15 3.56 0.13 -1.83 -2.13 132.00 131.64 1wnb h PRO 210 Ca 0.10 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.23 1wnb h PRO 210 Cb 0.40 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.53 1wnb h PRO 210 CO -0.29 0.18 -0.07 1.25 -0.23 0.00 0.00 178.00 178.85 1wnb h LEU 211 N 0.00 -0.17 -1.43 1.56 5.85 -0.98 -2.97 115.31 117.17 1wnb h LEU 211 Ca -0.00 -0.37 -0.00 0.00 0.84 0.00 0.00 57.88 58.34 1wnb h LEU 211 Cb 0.45 0.04 -0.00 0.00 0.37 0.00 0.00 40.66 41.52 1wnb h LEU 211 CO 0.02 0.38 -0.00 0.71 -0.34 0.00 0.00 178.44 179.21 1wnb h THR 212 N -0.83 0.00 0.00 1.05 1.35 -0.92 -2.69 112.91 110.88 1wnb h THR 212 Ca -0.02 -0.53 0.00 0.00 -0.55 0.00 0.00 66.41 65.31 1wnb h THR 212 Cb 0.53 1.52 0.00 0.00 -1.73 0.00 0.00 68.15 68.48 1wnb h THR 212 CO 0.03 0.00 -0.13 0.61 -0.25 0.00 0.00 175.52 175.78 1wnb n GLY 213 N 0.06 -1.50 3.69 5.82 0.00 -0.80 -4.79 105.19 107.66 1wnb n GLY 213 Ca 0.01 -0.13 -0.44 0.00 0.00 0.00 0.00 46.02 45.45 1wnb n GLY 213 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1wnb n HIS 214 N -1.74 2.52 0.02 1.61 -0.00 -1.02 -4.88 115.22 111.73 1wnb n HIS 214 Ca 0.06 0.04 0.19 0.00 -0.00 0.00 0.00 57.72 58.01 1wnb n HIS 214 Cb 0.37 -2.65 0.69 0.00 -0.00 0.00 0.00 29.99 28.39 1wnb n HIS 214 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 1wnb h PRO 215 N 7.37 0.00 0.00 1.57 0.11 -1.92 -1.84 132.00 137.30 1wnb h PRO 215 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1wnb h PRO 215 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1wnb h PRO 215 CO 0.93 0.00 0.00 1.63 -0.21 0.00 0.00 178.00 180.35 1wnb n LYS 216 N -4.38 0.10 -2.77 1.05 4.76 -1.26 -4.80 118.16 110.86 1wnb n LYS 216 Ca 0.09 0.04 -0.42 0.00 -2.87 0.00 0.00 58.31 55.15 1wnb n LYS 216 Cb 0.57 -1.50 -0.03 0.00 -1.84 0.00 0.00 35.03 32.23 1wnb n LYS 216 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1wnb s VAL 217 N -2.89 4.81 -0.08 -0.18 1.01 -0.69 -4.26 120.40 118.12 1wnb s VAL 217 Ca 0.16 1.87 0.19 0.00 0.00 0.00 0.00 61.98 64.19 1wnb s VAL 217 Cb 0.18 -4.24 -0.28 0.00 0.00 0.00 0.00 36.38 32.04 1wnb s VAL 217 CO 0.47 -0.00 0.30 0.54 0.00 0.00 0.00 175.10 176.40 1wnb n ARG 218 N 5.23 0.74 -3.83 2.72 5.12 -0.48 -4.94 116.66 121.22 1wnb n ARG 218 Ca 0.07 -0.12 -0.12 0.00 -1.93 0.00 0.00 57.85 55.75 1wnb n ARG 218 Cb 0.48 -1.47 -0.13 0.00 -1.16 0.00 0.00 32.46 30.19 1wnb n ARG 218 CO 0.00 0.00 0.00 1.41 -1.93 0.00 0.00 177.63 177.11 1wnb s MET 219 N -3.04 0.16 -0.15 5.56 1.75 -1.18 -1.96 119.30 120.43 1wnb s MET 219 Ca -0.08 0.14 0.02 0.00 -1.25 0.00 0.00 55.69 54.51 1wnb s MET 219 Cb 0.10 0.08 0.02 0.00 2.84 0.00 0.00 34.83 37.86 1wnb s MET 219 CO 0.80 -0.02 -0.20 0.08 -0.65 0.00 0.00 175.02 175.03 1wnb s VAL 220 N -0.02 1.95 -0.19 10.11 1.01 -0.42 -0.85 120.40 131.98 1wnb s VAL 220 Ca -0.01 -0.89 -0.03 0.00 0.00 0.00 0.00 61.98 61.05 1wnb s VAL 220 Cb -0.01 -1.75 -0.01 0.00 0.00 0.00 0.00 36.38 34.60 1wnb s VAL 220 CO 0.00 0.52 -0.05 -0.55 0.00 0.00 0.00 175.10 175.02 1wnb s SER 221 N 1.10 4.35 -0.09 3.32 0.15 0.01 -1.14 113.70 121.41 1wnb s SER 221 Ca -0.01 -0.33 0.01 0.00 0.70 0.00 0.00 55.95 56.32 1wnb s SER 221 Cb -0.14 -1.73 0.02 0.00 -1.71 0.00 0.00 66.02 62.46 1wnb s SER 221 CO -0.07 0.04 -0.11 -0.22 1.20 0.00 0.00 173.24 174.08 1wnb s LEU 222 N 1.09 1.49 -0.21 3.45 2.96 -0.57 0.23 118.68 127.12 1wnb s LEU 222 Ca 0.01 -0.31 -0.06 0.00 -0.22 0.00 0.00 54.13 53.55 1wnb s LEU 222 Cb -0.15 -0.84 -0.03 0.00 0.50 0.00 0.00 46.19 45.67 1wnb s LEU 222 CO -0.00 -0.02 0.04 -0.89 -1.32 0.00 0.00 176.35 174.16 1wnb s THR 223 N 1.05 4.29 -0.80 3.68 2.01 -1.06 -1.63 115.64 123.18 1wnb s THR 223 Ca -0.07 -0.19 0.00 0.00 0.31 0.00 0.00 61.69 61.74 1wnb s THR 223 Cb -0.15 -2.97 0.00 0.00 0.01 0.00 0.00 72.50 69.40 1wnb s THR 223 CO -0.01 0.40 0.00 0.61 -0.69 0.00 0.00 174.62 174.93 1wnb n GLY 224 N 4.33 -0.67 3.94 4.40 0.00 -1.05 -3.40 105.19 112.73 1wnb n GLY 224 Ca -0.17 -0.49 -0.26 0.00 0.00 0.00 0.00 46.02 45.11 1wnb n GLY 224 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wnb s SER 225 N -4.00 4.62 0.14 1.61 1.04 -1.26 -4.14 113.70 111.70 1wnb s SER 225 Ca 0.00 0.35 -0.18 0.00 0.48 0.00 0.00 55.95 56.61 1wnb s SER 225 Cb 0.00 -0.93 -0.02 0.00 0.10 0.00 0.00 66.02 65.17 1wnb s SER 225 CO 0.00 -1.72 1.79 0.40 0.98 0.00 0.00 173.24 174.69 1wnb h ILE 226 N -0.68 1.09 0.11 -1.02 2.04 -1.90 -1.31 117.51 115.84 1wnb h ILE 226 Ca -0.44 -0.17 0.01 0.00 1.00 0.00 0.00 64.86 65.27 1wnb h ILE 226 Cb 1.30 0.64 -0.02 0.00 -0.74 0.00 0.00 36.82 38.00 1wnb h ILE 226 CO 0.56 0.09 -0.19 0.00 0.00 0.00 0.00 178.15 178.61 1wnb h ALA 227 N 1.11 -0.32 -0.60 1.87 0.00 -1.96 0.12 119.26 119.48 1wnb h ALA 227 Ca 0.11 -0.03 0.12 0.00 0.00 0.00 0.00 54.91 55.11 1wnb h ALA 227 Cb -0.04 0.30 -0.09 0.00 0.00 0.00 0.00 17.79 17.96 1wnb h ALA 227 CO -0.02 -0.72 0.08 1.15 0.00 0.00 0.00 179.25 179.74 1wnb h THR 228 N -0.36 0.58 0.01 0.00 2.02 -1.95 -1.56 112.91 111.65 1wnb h THR 228 Ca 0.03 -0.07 0.02 0.00 0.77 0.00 0.00 66.41 67.16 1wnb h THR 228 Cb 0.38 0.37 -0.03 0.00 -1.74 0.00 0.00 68.15 67.13 1wnb h THR 228 CO -0.10 0.04 -0.18 1.23 0.37 0.00 0.00 175.52 176.87 1wnb h GLY 229 N 0.20 -0.26 0.82 2.16 0.00 -0.54 -1.17 103.07 104.28 1wnb h GLY 229 Ca 0.31 0.21 0.06 0.00 0.00 0.00 0.00 47.33 47.92 1wnb h GLY 229 CO -0.45 -0.17 0.63 -2.09 0.00 0.00 0.00 176.54 174.47 1wnb h GLU 230 N -0.30 1.13 -0.27 4.80 4.81 -0.62 -1.87 114.58 122.25 1wnb h GLU 230 Ca 0.05 -0.07 -0.15 0.00 -0.13 0.00 0.00 59.36 59.06 1wnb h GLU 230 Cb 0.37 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 29.49 1wnb h GLU 230 CO -0.16 0.75 -0.44 1.25 -0.73 0.00 0.00 179.01 179.67 1wnb h HIS 231 N 1.16 0.84 -0.31 0.92 2.76 -0.92 -1.99 115.15 117.62 1wnb h HIS 231 Ca 0.41 -0.26 -0.16 0.00 -2.20 0.00 0.00 60.37 58.16 1wnb h HIS 231 Cb 0.12 -0.17 -0.00 0.00 1.55 0.00 0.00 27.41 28.91 1wnb h HIS 231 CO -0.00 1.01 -0.44 0.82 -1.30 0.00 0.00 177.93 178.02 1wnb h ILE 232 N 0.56 1.28 -0.81 6.26 2.04 -0.71 -0.93 117.51 125.20 1wnb h ILE 232 Ca 0.04 -1.62 -0.02 0.00 1.00 0.00 0.00 64.86 64.26 1wnb h ILE 232 Cb 0.99 1.57 -0.04 0.00 -0.74 0.00 0.00 36.82 38.60 1wnb h ILE 232 CO 0.09 0.53 0.43 0.40 0.00 0.00 0.00 178.15 179.61 1wnb h ILE 233 N 0.62 1.24 0.05 -0.67 2.04 -1.33 -1.80 117.51 117.66 1wnb h ILE 233 Ca 0.03 -0.61 -0.00 0.00 1.00 0.00 0.00 64.86 65.28 1wnb h ILE 233 Cb 1.04 0.16 0.00 0.00 -0.74 0.00 0.00 36.82 37.27 1wnb h ILE 233 CO 0.10 0.27 -0.03 0.28 0.00 0.00 0.00 178.15 178.78 1wnb h SER 234 N 1.13 -0.06 -0.26 1.72 0.02 -1.14 -2.77 113.55 112.18 1wnb h SER 234 Ca 0.28 -0.19 -0.02 0.00 -0.84 0.00 0.00 61.79 61.03 1wnb h SER 234 Cb 0.04 0.02 -0.02 0.00 0.14 0.00 0.00 62.40 62.58 1wnb h SER 234 CO -0.04 0.15 0.13 -0.74 -1.14 0.00 0.00 176.83 175.19 1wnb h HIS 235 N -0.28 0.42 -0.25 3.45 6.17 -0.95 -2.70 115.15 121.01 1wnb h HIS 235 Ca -0.01 -0.01 0.00 0.00 0.71 0.00 0.00 60.37 61.06 1wnb h HIS 235 Cb 0.25 -0.14 0.00 0.00 2.52 0.00 0.00 27.41 30.04 1wnb h HIS 235 CO -0.01 0.34 0.00 0.25 0.71 0.00 0.00 177.93 179.22 1wnb n THR 236 N -4.41 0.42 -0.30 6.26 -2.24 -0.70 -4.61 114.28 108.70 1wnb n THR 236 Ca 0.02 -0.71 -0.00 0.00 -2.27 0.00 0.00 64.05 61.09 1wnb n THR 236 Cb 0.13 1.01 0.13 0.00 -2.10 0.00 0.00 70.33 69.50 1wnb n THR 236 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1wnb h ALA 237 N 3.44 1.13 0.00 6.98 0.00 -1.18 -2.40 119.26 127.24 1wnb h ALA 237 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1wnb h ALA 237 Cb 0.81 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1wnb h ALA 237 CO 0.00 0.27 0.06 0.66 0.00 0.00 0.00 179.25 180.24 1wnb h SER 238 N 0.96 0.00 0.00 0.00 4.64 -1.81 -1.09 113.55 116.24 1wnb h SER 238 Ca 0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.68 1wnb h SER 238 Cb 0.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.23 1wnb h SER 238 CO -0.16 0.00 -0.07 -1.54 -0.87 0.00 0.00 176.83 174.19 1wnb n SER 239 N -2.52 1.89 -3.86 4.97 3.41 -0.93 -5.01 113.62 111.57 1wnb n SER 239 Ca -0.02 -2.72 -0.30 0.00 -0.26 0.00 0.00 58.87 55.56 1wnb n SER 239 Cb 0.10 -0.33 -0.02 0.00 -0.26 0.00 0.00 64.21 63.71 1wnb n SER 239 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1wnb n ILE 240 N -1.06 -0.99 -1.87 -1.33 2.08 -0.41 -4.84 119.36 110.94 1wnb n ILE 240 Ca 0.11 0.00 -0.41 0.00 0.56 0.00 0.00 62.75 63.01 1wnb n ILE 240 Cb 0.59 -1.69 -0.02 0.00 -0.75 0.00 0.00 39.64 37.78 1wnb n ILE 240 CO 0.00 0.00 0.00 -0.54 0.56 0.00 0.00 176.55 176.57 1wnb s LYS 241 N -6.53 4.17 0.35 0.38 1.02 -1.18 -4.94 119.74 113.01 1wnb s LYS 241 Ca 0.60 2.48 -0.29 0.00 0.02 0.00 0.00 55.97 58.78 1wnb s LYS 241 Cb -0.32 -3.04 -0.11 0.00 -0.52 0.00 0.00 37.83 33.83 1wnb s LYS 241 CO 0.74 -0.53 1.47 0.50 -0.92 0.00 0.00 175.35 176.61 1wnb s ARG 242 N -0.76 4.16 0.17 1.68 3.52 -0.83 -4.89 118.95 122.01 1wnb s ARG 242 Ca 0.60 2.50 0.10 0.00 -0.13 0.00 0.00 55.73 58.80 1wnb s ARG 242 Cb -0.45 -3.00 -0.04 0.00 -1.56 0.00 0.00 34.95 29.89 1wnb s ARG 242 CO 0.49 -0.49 -0.22 0.95 -0.81 0.00 0.00 175.30 175.22 1wnb s THR 243 N -0.89 2.10 -0.09 4.11 -4.23 -1.26 -1.30 115.64 114.09 1wnb s THR 243 Ca 0.54 -1.91 -0.03 0.00 -1.18 0.00 0.00 61.69 59.11 1wnb s THR 243 Cb -0.45 -1.96 0.05 0.00 1.34 0.00 0.00 72.50 71.48 1wnb s THR 243 CO 0.58 -0.15 0.14 -2.28 -0.54 0.00 0.00 174.62 172.37 1wnb s HIS 244 N -1.67 -0.12 -0.03 3.99 2.46 -0.29 -4.95 115.29 114.68 1wnb s HIS 244 Ca 0.17 0.48 0.00 0.00 0.47 0.00 0.00 55.06 56.18 1wnb s HIS 244 Cb -0.08 -0.33 0.03 0.00 -0.13 0.00 0.00 32.58 32.07 1wnb s HIS 244 CO 0.08 -0.29 -0.01 1.41 -2.47 0.00 0.00 174.74 173.46 1wnb s MET 245 N 2.27 0.45 -0.28 2.88 1.75 -0.71 -1.52 119.30 124.13 1wnb s MET 245 Ca 0.04 0.03 -0.02 0.00 -1.25 0.00 0.00 55.69 54.49 1wnb s MET 245 Cb -0.12 -0.59 0.09 0.00 2.84 0.00 0.00 34.83 37.05 1wnb s MET 245 CO -0.06 -0.13 0.09 -2.00 -0.65 0.00 0.00 175.02 172.28 1wnb s GLU 246 N 1.03 0.57 -0.26 4.11 -6.30 -0.65 -1.45 118.70 115.75 1wnb s GLU 246 Ca -0.10 -0.81 0.11 0.00 -2.50 0.00 0.00 54.97 51.67 1wnb s GLU 246 Cb -0.14 -1.81 0.51 0.00 0.00 0.00 0.00 34.13 32.69 1wnb s GLU 246 CO -0.01 -0.93 1.45 1.28 0.02 0.00 0.00 175.26 177.07 1wnb n LEU 247 N 4.99 4.05 0.00 2.70 4.77 0.37 -2.54 117.00 131.33 1wnb n LEU 247 Ca -0.04 -3.59 0.00 0.00 -0.03 0.00 0.00 56.01 52.34 1wnb n LEU 247 Cb 0.43 -0.61 0.00 0.00 -2.33 0.00 0.00 43.42 40.91 1wnb n LEU 247 CO 0.10 1.12 0.00 0.61 -1.33 0.00 0.00 177.39 177.89 1wnb n GLY 248 N -1.01 0.13 3.38 -0.72 0.00 -1.26 -4.05 105.19 101.66 1wnb n GLY 248 Ca 0.30 -1.91 -0.10 0.00 0.00 0.00 0.00 46.02 44.32 1wnb n GLY 248 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wnb n GLY 249 N 0.16 1.45 2.65 -0.02 0.00 -1.25 -4.46 105.19 103.71 1wnb n GLY 249 Ca 0.00 -1.37 -0.16 0.00 0.00 0.00 0.00 46.02 44.49 1wnb n GLY 249 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1wnb s LYS 250 N -2.33 0.86 -0.26 1.61 2.47 -1.26 -4.62 119.74 116.22 1wnb s LYS 250 Ca 0.19 -1.32 -0.29 0.00 -1.56 0.00 0.00 55.97 52.99 1wnb s LYS 250 Cb -0.03 -0.73 -0.00 0.00 -1.46 0.00 0.00 37.83 35.60 1wnb s LYS 250 CO 0.14 -1.30 1.31 0.00 0.16 0.00 0.00 175.35 175.66 1wnb s ALA 251 N 0.82 3.44 0.17 3.13 0.00 -1.25 -4.90 121.76 123.17 1wnb s ALA 251 Ca 0.26 0.22 -0.31 0.00 0.00 0.00 0.00 51.96 52.13 1wnb s ALA 251 Cb -0.04 -3.74 -0.09 0.00 0.00 0.00 0.00 23.12 19.25 1wnb s ALA 251 CO -0.09 -1.62 1.38 -1.25 0.00 0.00 0.00 175.76 174.17 1wnb s PRO 252 N 4.02 4.33 -0.42 0.00 0.05 -1.26 -3.23 135.00 138.49 1wnb s PRO 252 Ca 0.57 2.11 -0.06 0.00 0.05 0.00 0.00 61.00 63.67 1wnb s PRO 252 Cb -0.18 -3.20 0.10 0.00 0.05 0.00 0.00 34.50 31.26 1wnb s PRO 252 CO 0.21 -0.37 0.24 0.08 0.05 0.00 0.00 177.00 177.20 1wnb s VAL 253 N 0.59 3.69 -0.36 -0.36 1.01 0.72 -1.51 120.40 124.17 1wnb s VAL 253 Ca 0.61 -1.81 -0.18 0.00 0.00 0.00 0.00 61.98 60.60 1wnb s VAL 253 Cb -0.38 -3.42 -0.00 0.00 0.00 0.00 0.00 36.38 32.58 1wnb s VAL 253 CO 0.35 -0.64 0.52 -0.63 0.00 0.00 0.00 175.10 174.70 1wnb s ILE 254 N 1.26 5.00 -0.26 2.22 1.01 -0.47 -0.48 121.20 129.49 1wnb s ILE 254 Ca 0.06 0.32 -0.00 0.00 0.00 0.00 0.00 60.65 61.02 1wnb s ILE 254 Cb -0.24 -3.98 0.04 0.00 0.01 0.00 0.00 42.46 38.30 1wnb s ILE 254 CO -0.02 -0.24 -0.07 -0.69 0.00 0.00 0.00 174.94 173.92 1wnb s VAL 255 N 2.42 2.66 0.62 2.92 1.01 0.63 -0.52 120.40 130.13 1wnb s VAL 255 Ca 0.19 -1.29 -0.06 0.00 0.00 0.00 0.00 61.98 60.81 1wnb s VAL 255 Cb -0.15 -2.44 0.02 0.00 0.00 0.00 0.00 36.38 33.80 1wnb s VAL 255 CO 0.14 0.07 0.93 -0.36 0.00 0.00 0.00 175.10 175.87 1wnb s PHE 256 N 1.24 3.17 0.58 5.22 0.40 -0.57 -0.61 117.98 127.41 1wnb s PHE 256 Ca -0.04 0.59 0.28 0.00 -0.60 0.00 0.00 56.93 57.17 1wnb s PHE 256 Cb -0.18 -2.85 1.64 0.00 0.51 0.00 0.00 43.02 42.15 1wnb s PHE 256 CO -0.04 -0.96 2.11 -0.44 0.70 0.00 0.00 175.22 176.59 1wnb h ASP 257 N -0.27 0.00 -0.63 1.36 3.32 -1.88 -2.16 116.42 116.16 1wnb h ASP 257 Ca -0.45 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 1wnb h ASP 257 Cb 1.27 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.82 1wnb h ASP 257 CO 0.60 0.00 0.00 -0.90 -1.72 0.00 0.00 179.24 177.22 1wnb n ASP 258 N -3.87 4.47 -4.82 6.45 5.75 -1.26 -4.87 116.55 118.41 1wnb n ASP 258 Ca 0.01 -2.38 -0.32 0.00 -0.01 0.00 0.00 54.79 52.10 1wnb n ASP 258 Cb 0.30 -0.56 0.03 0.00 -1.03 0.00 0.00 41.12 39.87 1wnb n ASP 258 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1wnb s ALA 259 N -1.76 2.74 -0.52 2.12 0.00 -0.82 -3.34 121.76 120.18 1wnb s ALA 259 Ca 0.48 0.18 -0.28 0.00 0.00 0.00 0.00 51.96 52.34 1wnb s ALA 259 Cb 0.31 -3.19 0.02 0.00 0.00 0.00 0.00 23.12 20.26 1wnb s ALA 259 CO 0.24 -1.02 1.25 0.34 0.00 0.00 0.00 175.76 176.58 1wnb s ASP 260 N -3.44 6.43 0.16 0.00 -1.08 -1.26 -4.88 116.67 112.59 1wnb s ASP 260 Ca 0.60 0.37 0.02 0.00 -0.52 0.00 0.00 52.55 53.01 1wnb s ASP 260 Cb -0.14 -2.55 -0.03 0.00 -1.46 0.00 0.00 42.92 38.74 1wnb s ASP 260 CO 0.48 -1.45 1.36 0.40 0.52 0.00 0.00 175.17 176.48 1wnb h ILE 261 N 6.28 1.49 0.00 4.11 1.08 -1.96 -1.38 117.51 127.12 1wnb h ILE 261 Ca -0.25 -2.62 -0.11 0.00 -0.39 0.00 0.00 64.86 61.49 1wnb h ILE 261 Cb 1.07 2.48 -0.02 0.00 -3.07 0.00 0.00 36.82 37.29 1wnb h ILE 261 CO 1.15 0.77 -0.51 -0.33 -0.69 0.00 0.00 178.15 178.53 1wnb h GLU 262 N 0.12 0.00 -0.05 2.37 5.08 -1.99 -1.46 114.58 118.64 1wnb h GLU 262 Ca -0.05 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.08 1wnb h GLU 262 Cb 1.53 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.80 1wnb h GLU 262 CO 0.14 0.51 -0.86 0.00 -1.00 0.00 0.00 179.01 177.80 1wnb h ALA 263 N 1.49 0.17 -0.34 3.43 0.00 -1.82 -0.83 119.26 121.36 1wnb h ALA 263 Ca -0.01 -0.63 0.07 0.00 0.00 0.00 0.00 54.91 54.34 1wnb h ALA 263 Cb 0.99 0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.74 1wnb h ALA 263 CO 0.07 0.61 -0.12 0.28 0.00 0.00 0.00 179.25 180.08 1wnb h VAL 264 N 0.34 0.58 -0.35 0.00 2.07 -1.13 0.16 116.25 117.94 1wnb h VAL 264 Ca -0.09 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.41 1wnb h VAL 264 Cb 1.51 0.58 -0.02 0.00 -1.52 0.00 0.00 31.29 31.85 1wnb h VAL 264 CO 0.17 0.00 0.14 0.58 0.02 0.00 0.00 177.57 178.48 1wnb h VAL 265 N -0.05 1.19 -0.73 2.57 2.07 -1.19 0.50 116.25 120.60 1wnb h VAL 265 Ca 0.17 -0.57 0.05 0.00 0.82 0.00 0.00 66.70 67.17 1wnb h VAL 265 Cb 0.31 0.91 -0.05 0.00 -1.52 0.00 0.00 31.29 30.94 1wnb h VAL 265 CO -0.38 0.20 0.44 -0.08 0.02 0.00 0.00 177.57 177.77 1wnb h GLU 266 N 0.42 0.80 0.06 1.57 4.81 -0.99 -0.62 114.58 120.63 1wnb h GLU 266 Ca 0.12 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.30 1wnb h GLU 266 Cb 0.18 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1wnb h GLU 266 CO -0.01 0.53 -0.03 0.78 -0.73 0.00 0.00 179.01 179.55 1wnb h GLY 267 N 0.82 -0.08 1.57 1.92 0.00 -0.20 -3.15 103.07 103.96 1wnb h GLY 267 Ca 0.31 0.03 -0.09 0.00 0.00 0.00 0.00 47.33 47.58 1wnb h GLY 267 CO -0.15 -0.03 -0.23 -2.08 0.00 0.00 0.00 176.54 174.05 1wnb h VAL 268 N -0.43 1.26 -0.15 4.60 2.07 -0.88 0.41 116.25 123.13 1wnb h VAL 268 Ca -0.01 -1.23 -0.01 0.00 0.82 0.00 0.00 66.70 66.28 1wnb h VAL 268 Cb 0.38 1.31 -0.01 0.00 -1.52 0.00 0.00 31.29 31.45 1wnb h VAL 268 CO 0.01 0.39 0.06 -0.09 0.02 0.00 0.00 177.57 177.96 1wnb h ARG 269 N 0.45 0.20 0.00 1.57 2.43 -1.14 0.16 114.38 118.06 1wnb h ARG 269 Ca 0.07 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.21 1wnb h ARG 269 Cb 0.64 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.15 1wnb h ARG 269 CO 0.05 0.17 -0.03 1.15 -1.51 0.00 0.00 179.97 179.80 1wnb h THR 270 N 0.21 1.79 0.00 0.20 2.02 -1.41 -3.39 112.91 112.33 1wnb h THR 270 Ca 0.05 -2.35 0.00 0.00 0.77 0.00 0.00 66.41 64.88 1wnb h THR 270 Cb 0.05 3.39 0.00 0.00 -1.74 0.00 0.00 68.15 69.85 1wnb h THR 270 CO -0.01 0.61 -0.61 -0.26 0.37 0.00 0.00 175.52 175.63 1wnb h PHE 271 N -0.98 0.00 0.00 3.16 0.04 0.18 0.49 116.94 119.84 1wnb h PHE 271 Ca -0.00 0.00 -0.11 0.00 2.80 0.00 0.00 57.97 60.65 1wnb h PHE 271 Cb 1.02 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.16 1wnb h PHE 271 CO 0.28 0.00 -0.53 0.78 -0.60 0.00 0.00 178.31 178.24 1wnb h GLY 272 N 4.14 0.00 0.00 -1.45 0.00 -0.87 -2.11 103.07 102.78 1wnb h GLY 272 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1wnb h GLY 272 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 176.54 174.82 1wnb n TYR 273 N -3.62 0.00 -1.75 5.60 4.02 -1.15 -4.19 117.16 116.07 1wnb n TYR 273 Ca -0.00 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.47 1wnb n TYR 273 Cb 0.60 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.92 1wnb n TYR 273 CO 0.00 0.00 0.00 0.98 -1.01 0.00 0.00 176.86 176.83 1wnb n TYR 274 N -0.24 2.69 -1.71 -0.72 4.19 0.15 -0.68 117.16 120.84 1wnb n TYR 274 Ca 0.00 0.48 -0.19 0.00 3.31 0.00 0.00 57.90 61.50 1wnb n TYR 274 Cb 0.06 -2.48 -0.07 0.00 0.49 0.00 0.00 39.34 37.35 1wnb n TYR 274 CO 0.00 0.00 0.00 -1.71 0.91 0.00 0.00 176.86 176.06 1wnb n ASN 275 N 0.38 -5.29 -1.40 2.98 5.15 -1.26 -1.69 115.26 114.13 1wnb n ASN 275 Ca 0.03 0.36 -0.17 0.00 -0.60 0.00 0.00 54.58 54.20 1wnb n ASN 275 Cb 0.39 -4.41 -0.07 0.00 -0.53 0.00 0.00 39.78 35.16 1wnb n ASN 275 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1wnb n ALA 276 N 0.68 -0.29 -0.99 5.20 0.00 0.15 -2.45 120.51 122.80 1wnb n ALA 276 Ca -0.19 0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.51 1wnb n ALA 276 Cb 0.63 -1.81 0.00 0.00 0.00 0.00 0.00 19.45 18.26 1wnb n ALA 276 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wnb n GLY 277 N -0.86 0.55 3.02 0.00 0.00 -0.68 -0.53 105.19 106.70 1wnb n GLY 277 Ca -0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.41 1wnb n GLY 277 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1wnb n GLN 278 N -2.50 3.65 -3.74 1.61 6.02 -1.03 -3.41 117.38 117.99 1wnb n GLN 278 Ca 0.00 -3.72 -0.12 0.00 -0.01 0.00 0.00 57.00 53.15 1wnb n GLN 278 Cb 0.04 -2.90 -0.12 0.00 1.02 0.00 0.00 30.24 28.28 1wnb n GLN 278 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1wnb s ASP 279 N 1.04 -0.35 0.00 1.08 -1.08 -1.26 -4.84 116.67 111.26 1wnb s ASP 279 Ca 0.39 0.66 0.21 0.00 -0.52 0.00 0.00 52.55 53.29 1wnb s ASP 279 Cb 0.06 0.59 0.91 0.00 -1.46 0.00 0.00 42.92 43.02 1wnb s ASP 279 CO 0.01 -0.15 1.69 0.00 0.52 0.00 0.00 175.17 177.24 1wnb n THR 281 N -1.51 1.73 -1.65 0.00 -2.24 -1.26 -3.87 114.28 105.48 1wnb n THR 281 Ca 0.05 -1.68 -0.43 0.00 -2.27 0.00 0.00 64.05 59.71 1wnb n THR 281 Cb 0.25 0.01 -0.01 0.00 -2.10 0.00 0.00 70.33 68.48 1wnb n THR 281 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1wnb n ALA 282 N -0.57 0.58 -1.65 6.98 0.00 -0.98 -4.71 120.51 120.15 1wnb n ALA 282 Ca 0.15 0.38 -0.40 0.00 0.00 0.00 0.00 53.44 53.56 1wnb n ALA 282 Cb 0.63 -2.14 -0.04 0.00 0.00 0.00 0.00 19.45 17.90 1wnb n ALA 282 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wnb n ALA 283 N 0.29 3.57 0.34 0.00 0.00 -0.79 -3.94 120.51 119.97 1wnb n ALA 283 Ca 0.07 -3.46 0.07 0.00 0.00 0.00 0.00 53.44 50.12 1wnb n ALA 283 Cb 0.34 -3.58 -0.09 0.00 0.00 0.00 0.00 19.45 16.12 1wnb n ALA 283 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wnb s ARG 285 N -2.57 0.62 -0.14 0.00 1.70 -1.20 -2.21 118.95 115.15 1wnb s ARG 285 Ca 0.00 -0.74 -0.20 0.00 -0.47 0.00 0.00 55.73 54.32 1wnb s ARG 285 Cb 0.09 -1.91 -0.04 0.00 -0.57 0.00 0.00 34.95 32.53 1wnb s ARG 285 CO 0.56 -0.86 0.55 0.42 -1.08 0.00 0.00 175.30 174.89 1wnb s ILE 286 N 1.78 5.12 -0.29 4.99 1.01 0.10 -0.20 121.20 133.71 1wnb s ILE 286 Ca 0.05 1.08 -0.11 0.00 0.00 0.00 0.00 60.65 61.67 1wnb s ILE 286 Cb -0.17 -3.88 -0.05 0.00 0.01 0.00 0.00 42.46 38.37 1wnb s ILE 286 CO -0.21 0.25 0.21 -0.31 0.00 0.00 0.00 174.94 174.88 1wnb s TYR 287 N 1.05 3.22 -0.16 3.97 1.51 0.37 -0.81 117.35 126.51 1wnb s TYR 287 Ca 0.28 0.10 0.01 0.00 -1.01 0.00 0.00 57.07 56.45 1wnb s TYR 287 Cb -0.16 -2.41 0.01 0.00 -0.11 0.00 0.00 41.96 39.30 1wnb s TYR 287 CO 0.12 -0.19 -0.19 0.00 -1.11 0.00 0.00 175.55 174.18 1wnb s ALA 288 N 1.78 2.36 0.59 3.71 0.00 0.95 -0.27 121.76 130.88 1wnb s ALA 288 Ca 0.07 -1.12 -0.20 0.00 0.00 0.00 0.00 51.96 50.71 1wnb s ALA 288 Cb -0.16 -1.14 -0.03 0.00 0.00 0.00 0.00 23.12 21.78 1wnb s ALA 288 CO 0.11 -0.15 1.31 -1.14 0.00 0.00 0.00 175.76 175.89 1wnb s GLN 289 N 0.99 2.91 0.46 0.00 0.74 0.22 -1.80 119.66 123.18 1wnb s GLN 289 Ca -0.02 2.11 0.18 0.00 0.05 0.00 0.00 55.36 57.68 1wnb s GLN 289 Cb -0.15 -2.06 1.11 0.00 1.10 0.00 0.00 33.01 33.01 1wnb s GLN 289 CO -0.05 -1.33 2.00 1.57 -0.55 0.00 0.00 175.29 176.93 1wnb h LYS 290 N 1.05 0.00 -0.65 1.67 2.10 -1.35 -1.10 116.57 118.30 1wnb h LYS 290 Ca -0.51 0.00 -0.07 0.00 -2.00 0.00 0.00 60.65 58.08 1wnb h LYS 290 Cb 1.31 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 32.62 1wnb h LYS 290 CO 0.55 0.19 0.14 0.78 -2.00 0.00 0.00 179.45 179.11 1wnb h GLY 291 N 0.71 1.12 -1.81 0.07 0.00 -1.89 -3.22 103.07 98.05 1wnb h GLY 291 Ca -0.00 -0.69 0.00 0.00 0.00 0.00 0.00 47.33 46.63 1wnb h GLY 291 CO 0.02 0.65 0.00 0.29 0.00 0.00 0.00 176.54 177.50 1wnb n ILE 292 N -4.24 0.63 0.26 2.60 -6.64 -0.53 -4.82 119.36 106.63 1wnb n ILE 292 Ca 0.05 -0.82 -0.16 0.00 -1.77 0.00 0.00 62.75 60.05 1wnb n ILE 292 Cb 0.26 0.82 -0.08 0.00 -1.44 0.00 0.00 39.64 39.20 1wnb n ILE 292 CO 0.00 0.00 0.00 0.22 -1.77 0.00 0.00 176.55 175.00 1wnb h TYR 293 N 3.31 -0.59 -0.56 4.28 3.20 -1.27 -1.26 116.97 124.10 1wnb h TYR 293 Ca 0.00 -0.01 -0.10 0.00 3.14 0.00 0.00 58.73 61.76 1wnb h TYR 293 Cb 0.82 0.20 -0.02 0.00 1.54 0.00 0.00 36.73 39.27 1wnb h TYR 293 CO 0.23 -0.36 -0.03 -0.44 -1.64 0.00 0.00 178.16 175.92 1wnb h ASP 294 N -0.61 0.96 -0.22 -2.11 3.32 -1.87 -1.13 116.42 114.76 1wnb h ASP 294 Ca -0.06 -0.28 0.01 0.00 0.02 0.00 0.00 57.03 56.73 1wnb h ASP 294 Cb 0.48 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.75 1wnb h ASP 294 CO 0.09 1.04 0.10 0.74 -1.72 0.00 0.00 179.24 179.48 1wnb h THR 295 N 0.90 0.99 -0.33 0.35 2.02 -1.86 -1.33 112.91 113.64 1wnb h THR 295 Ca 0.16 -0.08 0.06 0.00 0.77 0.00 0.00 66.41 67.32 1wnb h THR 295 Cb 0.57 0.75 -0.05 0.00 -1.74 0.00 0.00 68.15 67.68 1wnb h THR 295 CO 0.03 0.04 0.02 0.25 0.37 0.00 0.00 175.52 176.23 1wnb h LEU 296 N 0.22 -0.09 -0.14 2.58 5.85 -1.01 -0.63 115.31 122.10 1wnb h LEU 296 Ca 0.09 0.07 0.03 0.00 0.84 0.00 0.00 57.88 58.90 1wnb h LEU 296 Cb 0.03 0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 1wnb h LEU 296 CO -0.07 -0.01 -0.02 0.58 -0.34 0.00 0.00 178.44 178.58 1wnb h VAL 297 N 0.12 0.88 -0.23 1.05 2.07 -1.06 0.12 116.25 119.20 1wnb h VAL 297 Ca 0.16 -0.01 0.03 0.00 0.82 0.00 0.00 66.70 67.70 1wnb h VAL 297 Cb 0.20 0.86 -0.04 0.00 -1.52 0.00 0.00 31.29 30.79 1wnb h VAL 297 CO -0.25 0.00 -0.29 -0.08 0.02 0.00 0.00 177.57 176.98 1wnb h GLU 298 N 0.02 -0.19 -0.26 1.57 4.81 -1.10 0.36 114.58 119.79 1wnb h GLU 298 Ca 0.07 0.01 -0.12 0.00 -0.13 0.00 0.00 59.36 59.18 1wnb h GLU 298 Cb 0.09 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.50 1wnb h GLU 298 CO -0.13 -0.12 -0.36 0.87 -0.73 0.00 0.00 179.01 178.54 1wnb h LYS 299 N -0.19 0.57 -0.30 1.92 1.57 -0.98 -2.59 116.57 116.58 1wnb h LYS 299 Ca 0.04 -0.27 -0.04 0.00 -1.87 0.00 0.00 60.65 58.51 1wnb h LYS 299 Cb 0.30 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 1wnb h LYS 299 CO -0.32 0.85 0.03 1.25 -0.57 0.00 0.00 179.45 180.69 1wnb h LEU 300 N 0.48 0.49 -0.58 2.94 5.85 -0.73 -2.22 115.31 121.55 1wnb h LEU 300 Ca 0.05 -0.28 0.10 0.00 0.84 0.00 0.00 57.88 58.58 1wnb h LEU 300 Cb 0.84 -0.13 -0.07 0.00 0.37 0.00 0.00 40.66 41.67 1wnb h LEU 300 CO 0.07 0.65 0.17 1.23 -0.34 0.00 0.00 178.44 180.22 1wnb h GLY 301 N 0.31 0.77 1.31 3.75 0.00 -0.78 0.97 103.07 109.39 1wnb h GLY 301 Ca 0.09 -0.07 -0.10 0.00 0.00 0.00 0.00 47.33 47.24 1wnb h GLY 301 CO 0.01 -0.05 -0.13 0.00 0.00 0.00 0.00 176.54 176.37 1wnb h ALA 302 N 1.42 0.94 -0.07 3.60 0.00 -1.39 -1.97 119.26 121.79 1wnb h ALA 302 Ca 0.29 -0.33 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 1wnb h ALA 302 Cb 0.39 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1wnb h ALA 302 CO -0.33 0.62 -0.17 0.00 0.00 0.00 0.00 179.25 179.37 1wnb h ALA 303 N 1.12 0.12 -0.98 0.00 0.00 -0.74 -3.23 119.26 115.54 1wnb h ALA 303 Ca 0.12 -0.36 0.08 0.00 0.00 0.00 0.00 54.91 54.74 1wnb h ALA 303 Cb 0.63 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.33 1wnb h ALA 303 CO 0.04 0.04 0.63 0.28 0.00 0.00 0.00 179.25 180.24 1wnb h VAL 304 N -0.25 1.05 -0.13 0.00 2.07 -0.83 -2.78 116.25 115.38 1wnb h VAL 304 Ca -0.00 -0.38 0.04 0.00 0.82 0.00 0.00 66.70 67.18 1wnb h VAL 304 Cb 0.76 -0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.37 1wnb h VAL 304 CO 0.04 0.20 0.19 0.00 0.02 0.00 0.00 177.57 178.02 1wnb h ALA 305 N 1.48 1.63 -0.01 1.67 0.00 -1.37 -2.64 119.26 120.03 1wnb h ALA 305 Ca 0.44 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.34 1wnb h ALA 305 Cb 0.24 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1wnb h ALA 305 CO -0.18 -0.26 -0.20 0.25 0.00 0.00 0.00 179.25 178.85 1wnb n THR 306 N -3.58 0.00 -1.83 0.00 -2.24 -1.05 -4.93 114.28 100.66 1wnb n THR 306 Ca 0.00 -0.10 -0.42 0.00 -2.27 0.00 0.00 64.05 61.26 1wnb n THR 306 Cb 0.30 0.21 -0.03 0.00 -2.10 0.00 0.00 70.33 68.71 1wnb n THR 306 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1wnb s LEU 307 N -2.50 4.37 -0.29 3.22 1.43 -1.00 -4.92 118.68 118.99 1wnb s LEU 307 Ca 0.26 2.77 -0.16 0.00 -1.03 0.00 0.00 54.13 55.97 1wnb s LEU 307 Cb 0.19 -3.60 -0.03 0.00 0.03 0.00 0.00 46.19 42.78 1wnb s LEU 307 CO 0.51 -0.89 0.41 -0.75 0.23 0.00 0.00 176.35 175.85 1wnb s LYS 308 N 0.86 3.92 0.16 1.70 2.20 -1.26 -4.89 119.74 122.43 1wnb s LYS 308 Ca 0.71 0.00 -0.03 0.00 -0.36 0.00 0.00 55.97 56.29 1wnb s LYS 308 Cb -0.47 -3.69 -0.05 0.00 -1.51 0.00 0.00 37.83 32.11 1wnb s LYS 308 CO 0.34 -0.36 0.37 -1.12 -0.36 0.00 0.00 175.35 174.22 1wnb s SER 309 N 1.65 6.45 0.00 1.43 0.01 -1.26 0.15 113.70 122.13 1wnb s SER 309 Ca 0.16 0.51 0.00 0.00 1.31 0.00 0.00 55.95 57.93 1wnb s SER 309 Cb -0.16 -2.06 0.00 0.00 0.21 0.00 0.00 66.02 64.01 1wnb s SER 309 CO 0.10 0.03 0.00 0.61 0.41 0.00 0.00 173.24 174.39 1wnb n GLY 310 N -0.14 -1.80 3.67 3.44 0.00 -1.26 -4.94 105.19 104.17 1wnb n GLY 310 Ca -0.03 -1.13 -0.50 0.00 0.00 0.00 0.00 46.02 44.36 1wnb n GLY 310 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wnb n ALA 311 N 0.00 0.60 -0.38 4.61 0.00 -1.26 -4.89 120.51 119.20 1wnb n ALA 311 Ca 0.00 0.38 0.29 0.00 0.00 0.00 0.00 53.44 54.11 1wnb n ALA 311 Cb 0.00 -2.36 0.56 0.00 0.00 0.00 0.00 19.45 17.65 1wnb n ALA 311 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1wnb h PRO 312 N 7.38 0.23 -0.46 0.00 0.11 -1.88 -1.64 132.00 135.74 1wnb h PRO 312 Ca -0.47 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1wnb h PRO 312 Cb 1.28 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1wnb h PRO 312 CO 0.91 0.15 0.00 -0.40 -0.21 0.00 0.00 178.00 178.45 1wnb n ASP 313 N -4.79 1.53 -4.58 -2.05 5.68 -1.26 -1.00 116.55 110.07 1wnb n ASP 313 Ca 0.32 -2.09 -0.35 0.00 -0.50 0.00 0.00 54.79 52.17 1wnb n ASP 313 Cb 1.15 -0.29 -0.11 0.00 -1.14 0.00 0.00 41.12 40.73 1wnb n ASP 313 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1wnb s ASP 314 N -0.70 5.37 0.59 -1.12 -1.08 -0.62 -4.94 116.67 114.17 1wnb s ASP 314 Ca 0.14 -0.01 0.30 0.00 -0.52 0.00 0.00 52.55 52.47 1wnb s ASP 314 Cb 0.09 -1.92 1.81 0.00 -1.46 0.00 0.00 42.92 41.44 1wnb s ASP 314 CO 0.07 0.14 2.24 -0.08 0.52 0.00 0.00 175.17 178.06 1wnb h GLU 315 N 6.91 0.00 0.00 4.34 4.57 -1.87 -1.68 114.58 126.86 1wnb h GLU 315 Ca -0.36 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.82 1wnb h GLU 315 Cb 1.17 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.76 1wnb h GLU 315 CO 0.67 0.02 0.00 -1.13 -1.18 0.00 0.00 179.01 177.39 1wnb n SER 316 N -3.77 0.73 -4.72 1.04 3.41 -1.26 -4.86 113.62 104.19 1wnb n SER 316 Ca -0.03 0.59 -0.42 0.00 -0.26 0.00 0.00 58.87 58.75 1wnb n SER 316 Cb 0.10 -0.78 -0.03 0.00 -0.26 0.00 0.00 64.21 63.25 1wnb n SER 316 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1wnb s THR 317 N -3.14 3.14 -0.08 6.66 2.01 -0.63 -4.76 115.64 118.84 1wnb s THR 317 Ca 0.09 0.86 -0.00 0.00 0.31 0.00 0.00 61.69 62.95 1wnb s THR 317 Cb 0.12 -3.55 -0.05 0.00 0.01 0.00 0.00 72.50 69.03 1wnb s THR 317 CO 0.55 0.09 -0.08 -0.62 -0.69 0.00 0.00 174.62 173.86 1wnb n GLU 318 N 3.53 0.20 -4.13 4.92 1.02 0.12 -4.89 120.64 121.42 1wnb n GLU 318 Ca 0.10 0.05 -0.34 0.00 -0.02 0.00 0.00 57.16 56.96 1wnb n GLU 318 Cb 0.42 -1.09 -0.15 0.00 -0.02 0.00 0.00 31.44 30.59 1wnb n GLU 318 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1wnb s LEU 319 N -5.67 2.55 0.00 -4.62 2.96 0.50 -4.80 118.68 109.60 1wnb s LEU 319 Ca -0.11 -0.49 0.01 0.00 -0.22 0.00 0.00 54.13 53.32 1wnb s LEU 319 Cb 0.03 -1.61 0.04 0.00 0.50 0.00 0.00 46.19 45.14 1wnb s LEU 319 CO 0.18 0.01 0.26 0.61 -1.32 0.00 0.00 176.35 176.10 1wnb n GLY 320 N 4.55 1.30 3.94 7.98 0.00 -1.26 -4.06 105.19 117.64 1wnb n GLY 320 Ca -0.19 -2.06 -0.27 0.00 0.00 0.00 0.00 46.02 43.50 1wnb n GLY 320 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wnb s PRO 321 N -2.98 1.61 0.95 1.61 0.04 -1.26 -4.72 135.00 130.25 1wnb s PRO 321 Ca 0.19 -0.41 -0.12 0.00 0.04 0.00 0.00 61.00 60.69 1wnb s PRO 321 Cb -0.01 -2.08 0.16 0.00 0.04 0.00 0.00 34.50 32.61 1wnb s PRO 321 CO 0.12 -1.67 1.11 -0.51 0.04 0.00 0.00 177.00 176.09 1wnb s LEU 322 N -5.46 1.86 0.18 -3.56 1.43 0.51 -4.80 118.68 108.84 1wnb s LEU 322 Ca 0.66 1.14 0.03 0.00 -1.03 0.00 0.00 54.13 54.93 1wnb s LEU 322 Cb -0.08 -3.43 0.03 0.00 0.03 0.00 0.00 46.19 42.75 1wnb s LEU 322 CO 0.48 -2.81 1.41 0.77 0.23 0.00 0.00 176.35 176.42 1wnb h SER 323 N -1.67 0.23 -5.16 2.29 4.64 -1.86 -3.42 113.55 108.60 1wnb h SER 323 Ca -0.52 -0.18 -0.03 0.00 -0.47 0.00 0.00 61.79 60.59 1wnb h SER 323 Cb 1.32 -0.07 -0.09 0.00 -0.31 0.00 0.00 62.40 63.25 1wnb h SER 323 CO 0.59 0.97 -0.03 -0.94 -0.87 0.00 0.00 176.83 176.54 1wnb s SER 324 N -6.91 -0.16 0.12 4.97 1.04 -1.26 -4.74 113.70 106.77 1wnb s SER 324 Ca -0.03 -0.75 -0.20 0.00 0.48 0.00 0.00 55.95 55.45 1wnb s SER 324 Cb 0.10 0.60 -0.05 0.00 0.10 0.00 0.00 66.02 66.77 1wnb s SER 324 CO 0.82 -1.13 1.74 0.25 0.98 0.00 0.00 173.24 175.90 1wnb h LEU 325 N 2.22 0.02 -1.22 2.42 5.85 -1.96 -1.83 115.31 120.80 1wnb h LEU 325 Ca -0.26 0.03 -0.07 0.00 0.84 0.00 0.00 57.88 58.42 1wnb h LEU 325 Cb 1.25 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 42.30 1wnb h LEU 325 CO 0.35 0.04 -0.21 0.00 -0.34 0.00 0.00 178.44 178.27 1wnb h ALA 326 N 1.12 1.35 0.02 1.25 0.00 -1.99 -2.10 119.26 118.91 1wnb h ALA 326 Ca 0.08 -0.28 -0.22 0.00 0.00 0.00 0.00 54.91 54.50 1wnb h ALA 326 Cb 0.07 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1wnb h ALA 326 CO -0.10 0.44 -0.95 1.25 0.00 0.00 0.00 179.25 179.90 1wnb h HIS 327 N 0.25 0.40 -0.75 0.00 -0.00 -1.94 -1.78 115.15 111.34 1wnb h HIS 327 Ca 0.04 -0.23 0.08 0.00 -0.00 0.00 0.00 60.37 60.26 1wnb h HIS 327 Cb 0.52 -0.04 -0.07 0.00 -0.00 0.00 0.00 27.41 27.83 1wnb h HIS 327 CO 0.01 1.07 0.41 1.25 -0.00 0.00 0.00 177.93 180.67 1wnb h LEU 328 N 0.14 0.59 -0.03 0.26 5.85 -1.20 -1.85 115.31 119.07 1wnb h LEU 328 Ca -0.06 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 1wnb h LEU 328 Cb 1.60 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 42.55 1wnb h LEU 328 CO 0.15 0.36 -0.00 -0.33 -0.34 0.00 0.00 178.44 178.28 1wnb h GLU 329 N 0.72 0.06 -0.79 1.25 4.39 -1.09 -1.01 114.58 118.11 1wnb h GLU 329 Ca 0.35 -0.02 0.11 0.00 0.34 0.00 0.00 59.36 60.14 1wnb h GLU 329 Cb 0.29 -0.01 -0.13 0.00 -0.10 0.00 0.00 28.75 28.81 1wnb h GLU 329 CO -0.23 0.36 -0.45 -0.09 -1.16 0.00 0.00 179.01 177.45 1wnb h ARG 330 N -0.24 -0.11 0.20 2.33 2.43 -1.32 -0.32 114.38 117.35 1wnb h ARG 330 Ca 0.01 0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.19 1wnb h ARG 330 Cb 0.33 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.90 1wnb h ARG 330 CO 0.00 -0.07 -0.16 0.28 -1.51 0.00 0.00 179.97 178.51 1wnb h VAL 331 N -0.11 0.66 -0.51 0.20 2.07 -1.27 -2.07 116.25 115.21 1wnb h VAL 331 Ca 0.23 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.85 1wnb h VAL 331 Cb 0.54 0.66 -0.10 0.00 -1.52 0.00 0.00 31.29 30.87 1wnb h VAL 331 CO -0.83 0.00 -0.17 1.23 0.02 0.00 0.00 177.57 177.82 1wnb h GLY 332 N -0.37 0.28 0.66 2.17 0.00 -0.99 -1.60 103.07 103.22 1wnb h GLY 332 Ca -0.01 0.22 0.05 0.00 0.00 0.00 0.00 47.33 47.59 1wnb h GLY 332 CO -0.01 -0.21 0.24 0.50 0.00 0.00 0.00 176.54 177.06 1wnb h LYS 333 N -0.05 0.45 -0.66 4.80 1.79 -0.89 -0.72 116.57 121.29 1wnb h LYS 333 Ca 0.25 -0.03 0.08 0.00 -2.18 0.00 0.00 60.65 58.77 1wnb h LYS 333 Cb 0.42 -0.10 -0.07 0.00 -1.58 0.00 0.00 32.23 30.91 1wnb h LYS 333 CO -0.55 0.30 0.32 0.00 -1.08 0.00 0.00 179.45 178.43 1wnb h ALA 334 N 1.30 0.89 -0.13 3.86 0.00 -1.03 0.10 119.26 124.26 1wnb h ALA 334 Ca 0.23 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.17 1wnb h ALA 334 Cb 0.18 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 1wnb h ALA 334 CO -0.19 -0.07 -0.02 0.28 0.00 0.00 0.00 179.25 179.25 1wnb h VAL 335 N 0.56 1.28 -0.85 0.00 2.07 -0.37 -2.37 116.25 116.57 1wnb h VAL 335 Ca 0.32 -0.93 0.09 0.00 0.82 0.00 0.00 66.70 67.00 1wnb h VAL 335 Cb 0.32 1.64 -0.06 0.00 -1.52 0.00 0.00 31.29 31.67 1wnb h VAL 335 CO -0.26 0.27 0.55 -0.33 0.02 0.00 0.00 177.57 177.82 1wnb h GLU 336 N -0.06 0.80 -0.28 1.57 4.39 -0.87 -1.92 114.58 118.22 1wnb h GLU 336 Ca 0.03 -0.05 -0.07 0.00 0.34 0.00 0.00 59.36 59.62 1wnb h GLU 336 Cb 0.43 -0.18 -0.02 0.00 -0.10 0.00 0.00 28.75 28.88 1wnb h GLU 336 CO 0.01 0.53 -0.12 1.49 -1.16 0.00 0.00 179.01 179.76 1wnb h GLU 337 N 0.83 0.47 -0.29 2.33 4.81 -0.30 -1.97 114.58 120.45 1wnb h GLU 337 Ca 0.39 -0.13 -0.09 0.00 -0.13 0.00 0.00 59.36 59.40 1wnb h GLU 337 Cb 0.40 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.72 1wnb h GLU 337 CO -0.16 0.59 -0.16 0.00 -0.73 0.00 0.00 179.01 178.56 1wnb h ALA 338 N 1.44 0.41 -0.41 2.92 0.00 -0.91 -3.03 119.26 119.68 1wnb h ALA 338 Ca 0.08 -0.33 0.06 0.00 0.00 0.00 0.00 54.91 54.72 1wnb h ALA 338 Cb 0.47 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.11 1wnb h ALA 338 CO 0.03 0.31 0.10 0.87 0.00 0.00 0.00 179.25 180.56 1wnb h LYS 339 N 0.37 0.23 0.00 0.00 1.57 -1.05 -2.46 116.57 115.23 1wnb h LYS 339 Ca 0.06 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1wnb h LYS 339 Cb 0.68 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.94 1wnb h LYS 339 CO 0.05 0.15 0.00 0.00 -0.57 0.00 0.00 179.45 179.08 1wnb n ALA 340 N -2.42 1.77 -0.18 3.86 0.00 -0.77 -2.30 120.51 120.46 1wnb n ALA 340 Ca 0.03 -0.06 0.07 0.00 0.00 0.00 0.00 53.44 53.47 1wnb n ALA 340 Cb 0.17 -1.25 0.35 0.00 0.00 0.00 0.00 19.45 18.73 1wnb n ALA 340 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1wnb h THR 341 N 0.00 1.02 0.00 0.00 2.02 -1.32 -3.47 112.91 111.16 1wnb h THR 341 Ca 0.00 -0.26 0.00 0.00 0.77 0.00 0.00 66.41 66.92 1wnb h THR 341 Cb 0.22 0.20 0.00 0.00 -1.74 0.00 0.00 68.15 66.83 1wnb h THR 341 CO 0.00 0.14 0.00 0.61 0.37 0.00 0.00 175.52 176.64 1wnb n GLY 342 N -1.45 2.64 0.02 2.16 0.00 -0.97 -4.89 105.19 102.70 1wnb n GLY 342 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1wnb n GLY 342 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1wnb n HIS 343 N -2.00 0.01 -3.70 1.61 1.44 -1.26 -5.01 115.22 106.31 1wnb n HIS 343 Ca 0.00 -0.24 -0.37 0.00 -2.01 0.00 0.00 57.72 55.09 1wnb n HIS 343 Cb 0.00 -0.02 -0.12 0.00 0.12 0.00 0.00 29.99 29.97 1wnb n HIS 343 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 1wnb s ILE 344 N -0.51 4.60 -0.03 0.61 1.01 -1.26 -4.63 121.20 120.99 1wnb s ILE 344 Ca 0.01 -0.13 -0.19 0.00 0.00 0.00 0.00 60.65 60.34 1wnb s ILE 344 Cb 0.00 -3.19 -0.05 0.00 0.01 0.00 0.00 42.46 39.23 1wnb s ILE 344 CO 0.01 0.28 0.54 -0.75 0.00 0.00 0.00 174.94 175.02 1wnb s LYS 345 N 1.65 4.27 -0.37 2.79 2.20 -0.34 -4.72 119.74 125.21 1wnb s LYS 345 Ca 0.06 0.63 -0.25 0.00 -0.36 0.00 0.00 55.97 56.05 1wnb s LYS 345 Cb -0.16 -3.35 0.01 0.00 -1.51 0.00 0.00 37.83 32.83 1wnb s LYS 345 CO 0.06 0.36 0.86 0.08 -0.36 0.00 0.00 175.35 176.35 1wnb s VAL 346 N -0.11 4.64 0.06 4.02 1.01 -1.26 -1.22 120.40 127.54 1wnb s VAL 346 Ca 0.29 1.03 0.02 0.00 0.00 0.00 0.00 61.98 63.32 1wnb s VAL 346 Cb -0.17 -4.29 -0.25 0.00 0.00 0.00 0.00 36.38 31.67 1wnb s VAL 346 CO 0.15 -0.51 1.07 0.40 0.00 0.00 0.00 175.10 176.21 1wnb h ILE 347 N 5.81 1.42 -1.57 2.22 1.08 -1.26 -3.48 117.51 121.73 1wnb h ILE 347 Ca -0.24 -3.09 0.07 0.00 -0.39 0.00 0.00 64.86 61.21 1wnb h ILE 347 Cb 1.08 2.81 -0.24 0.00 -3.07 0.00 0.00 36.82 37.40 1wnb h ILE 347 CO 0.95 0.86 0.51 0.28 -0.69 0.00 0.00 178.15 180.07 1wnb s THR 348 N -2.66 0.00 0.00 -0.27 -1.32 -1.23 -4.96 115.64 105.20 1wnb s THR 348 Ca -0.03 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.45 1wnb s THR 348 Cb 0.08 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 70.07 1wnb s THR 348 CO 0.85 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.87 1wnb n GLY 349 N 1.25 0.39 2.09 6.08 0.00 -1.20 -0.93 105.19 112.87 1wnb n GLY 349 Ca -0.11 -0.97 -0.04 0.00 0.00 0.00 0.00 46.02 44.90 1wnb n GLY 349 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wnb n GLY 350 N 0.00 0.34 3.14 -0.02 0.00 -1.26 -5.00 105.19 102.39 1wnb n GLY 350 Ca 0.00 -0.76 -0.11 0.00 0.00 0.00 0.00 46.02 45.15 1wnb n GLY 350 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wnb s GLU 351 N -3.69 0.55 0.30 1.61 2.02 -1.26 -4.98 118.70 113.25 1wnb s GLU 351 Ca 0.00 -0.46 -0.29 0.00 0.02 0.00 0.00 54.97 54.24 1wnb s GLU 351 Cb 0.00 0.23 -0.10 0.00 0.10 0.00 0.00 34.13 34.36 1wnb s GLU 351 CO 0.00 -0.14 1.22 0.15 0.02 0.00 0.00 175.26 176.51 1wnb s LYS 352 N -1.73 4.47 0.38 1.61 1.02 -1.26 -1.57 119.74 122.66 1wnb s LYS 352 Ca -0.12 2.04 -0.27 0.00 0.02 0.00 0.00 55.97 57.64 1wnb s LYS 352 Cb -0.05 -3.13 -0.09 0.00 -0.52 0.00 0.00 37.83 34.04 1wnb s LYS 352 CO 0.00 -0.03 1.28 0.50 -0.92 0.00 0.00 175.35 176.18 1wnb s ARG 353 N -1.55 4.11 0.66 1.68 3.52 -0.96 -4.86 118.95 121.56 1wnb s ARG 353 Ca 0.48 2.12 -0.14 0.00 -0.13 0.00 0.00 55.73 58.05 1wnb s ARG 353 Cb -0.36 -2.85 -0.00 0.00 -1.56 0.00 0.00 34.95 30.18 1wnb s ARG 353 CO 0.47 -0.36 1.08 0.15 -0.81 0.00 0.00 175.30 175.84 1wnb s LYS 354 N -2.10 2.88 0.00 5.12 1.02 -1.26 -4.81 119.74 120.59 1wnb s LYS 354 Ca 0.54 1.24 0.00 0.00 0.02 0.00 0.00 55.97 57.77 1wnb s LYS 354 Cb -0.37 -1.97 0.00 0.00 -0.52 0.00 0.00 37.83 34.97 1wnb s LYS 354 CO 0.48 -1.17 0.00 0.41 -0.92 0.00 0.00 175.35 174.16 1wnb n GLY 355 N -0.97 1.27 3.89 -3.33 0.00 -1.26 -5.04 105.19 99.76 1wnb n GLY 355 Ca 0.09 -2.15 -0.29 0.00 0.00 0.00 0.00 46.02 43.67 1wnb n GLY 355 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1wnb s ASN 356 N 0.00 5.32 0.00 1.61 0.01 -1.26 -4.94 114.94 115.68 1wnb s ASN 356 Ca 0.00 1.00 0.00 0.00 -0.71 0.00 0.00 52.86 53.15 1wnb s ASN 356 Cb 0.00 -1.78 0.00 0.00 0.41 0.00 0.00 41.25 39.88 1wnb s ASN 356 CO 0.00 -1.39 0.00 0.61 -1.51 0.00 0.00 177.10 174.81 1wnb n GLY 357 N -2.99 0.61 2.75 0.66 0.00 -1.22 -4.70 105.19 100.31 1wnb n GLY 357 Ca 0.07 -1.89 -0.30 0.00 0.00 0.00 0.00 46.02 43.90 1wnb n GLY 357 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1wnb n TYR 358 N 1.01 3.62 -2.95 1.61 4.01 -0.08 -4.87 117.16 119.52 1wnb n TYR 358 Ca 0.00 -3.41 -0.40 0.00 -0.16 0.00 0.00 57.90 53.93 1wnb n TYR 358 Cb 0.00 -0.50 -0.06 0.00 -0.31 0.00 0.00 39.34 38.48 1wnb n TYR 358 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 1wnb s TYR 359 N -3.65 3.84 -0.06 -0.72 1.51 -1.26 -0.36 117.35 116.65 1wnb s TYR 359 Ca 0.48 1.60 0.03 0.00 -1.01 0.00 0.00 57.07 58.18 1wnb s TYR 359 Cb 0.32 -2.82 0.00 0.00 -0.11 0.00 0.00 41.96 39.36 1wnb s TYR 359 CO -0.18 0.40 -0.16 -0.47 -1.11 0.00 0.00 175.55 174.04 1wnb s TYR 360 N -0.67 1.68 0.31 2.71 5.04 -1.26 -2.26 117.35 122.91 1wnb s TYR 360 Ca 0.38 -0.56 -0.29 0.00 -2.44 0.00 0.00 57.07 54.15 1wnb s TYR 360 Cb -0.22 -1.17 -0.12 0.00 0.35 0.00 0.00 41.96 40.80 1wnb s TYR 360 CO 0.26 -0.24 1.40 0.00 -1.34 0.00 0.00 175.55 175.63 1wnb n ALA 361 N 3.46 1.60 -1.77 3.97 0.00 -0.61 -4.89 120.51 122.27 1wnb n ALA 361 Ca -0.20 0.37 -0.42 0.00 0.00 0.00 0.00 53.44 53.19 1wnb n ALA 361 Cb 0.53 -2.32 -0.03 0.00 0.00 0.00 0.00 19.45 17.63 1wnb n ALA 361 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1wnb s PRO 362 N -1.27 4.15 -0.05 0.00 0.04 -1.26 -4.20 135.00 132.40 1wnb s PRO 362 Ca 0.60 2.55 0.02 0.00 0.04 0.00 0.00 61.00 64.21 1wnb s PRO 362 Cb -0.57 -3.27 0.01 0.00 0.04 0.00 0.00 34.50 30.72 1wnb s PRO 362 CO 0.57 -0.75 -0.11 0.99 0.04 0.00 0.00 177.00 177.74 1wnb s THR 363 N 1.71 1.00 -0.13 1.26 2.01 -0.35 -3.25 115.64 117.88 1wnb s THR 363 Ca 0.76 -0.41 0.01 0.00 0.31 0.00 0.00 61.69 62.35 1wnb s THR 363 Cb -0.47 -0.92 -0.01 0.00 0.01 0.00 0.00 72.50 71.11 1wnb s THR 363 CO 0.33 0.32 -0.16 -0.22 -0.69 0.00 0.00 174.62 174.20 1wnb s LEU 364 N 0.60 2.54 -0.14 4.42 2.96 -0.11 -1.76 118.68 127.19 1wnb s LEU 364 Ca -0.12 -0.41 0.02 0.00 -0.22 0.00 0.00 54.13 53.41 1wnb s LEU 364 Cb -0.14 -1.56 0.01 0.00 0.50 0.00 0.00 46.19 45.00 1wnb s LEU 364 CO 0.03 0.15 -0.21 -0.76 -1.32 0.00 0.00 176.35 174.23 1wnb s LEU 365 N 0.44 2.16 0.23 -0.68 1.43 0.10 -0.65 118.68 121.72 1wnb s LEU 365 Ca -0.12 -0.59 0.10 0.00 -1.03 0.00 0.00 54.13 52.49 1wnb s LEU 365 Cb -0.16 -1.46 -0.04 0.00 0.03 0.00 0.00 46.19 44.55 1wnb s LEU 365 CO 0.05 0.08 -0.07 0.00 0.23 0.00 0.00 176.35 176.64 1wnb s ALA 366 N 0.84 3.00 -0.05 4.21 0.00 -0.36 -0.51 121.76 128.88 1wnb s ALA 366 Ca -0.06 -1.60 0.00 0.00 0.00 0.00 0.00 51.96 50.30 1wnb s ALA 366 Cb -0.15 -0.69 0.00 0.00 0.00 0.00 0.00 23.12 22.28 1wnb s ALA 366 CO -0.02 0.36 0.00 0.41 0.00 0.00 0.00 175.76 176.51 1wnb n GLY 367 N -0.42 0.47 3.71 0.00 0.00 -0.91 -1.20 105.19 106.84 1wnb n GLY 367 Ca -0.08 -0.25 -0.43 0.00 0.00 0.00 0.00 46.02 45.25 1wnb n GLY 367 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wnb n ALA 368 N 1.01 2.13 -2.81 4.61 0.00 -0.96 -4.61 120.51 119.88 1wnb n ALA 368 Ca -0.01 0.40 -0.32 0.00 0.00 0.00 0.00 53.44 53.52 1wnb n ALA 368 Cb 0.05 -2.43 -0.06 0.00 0.00 0.00 0.00 19.45 17.01 1wnb n ALA 368 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1wnb s LEU 369 N 0.44 3.96 0.17 0.00 1.43 -1.26 -4.15 118.68 119.27 1wnb s LEU 369 Ca 0.71 0.12 -0.02 0.00 -1.03 0.00 0.00 54.13 53.92 1wnb s LEU 369 Cb -0.57 -2.47 0.35 0.00 0.03 0.00 0.00 46.19 43.53 1wnb s LEU 369 CO 0.41 0.22 0.90 1.67 0.23 0.00 0.00 176.35 179.78 1wnb n GLN 370 N 0.77 -0.05 -0.09 1.70 -0.06 -1.26 -0.56 117.38 117.82 1wnb n GLN 370 Ca -0.10 0.88 0.10 0.00 -2.00 0.00 0.00 57.00 55.88 1wnb n GLN 370 Cb 0.52 -1.35 0.35 0.00 -4.06 0.00 0.00 30.24 25.70 1wnb n GLN 370 CO 0.00 0.00 0.00 -0.25 -0.20 0.00 0.00 177.06 176.61 1wnb n ASP 371 N -4.82 1.75 -4.76 1.69 8.00 -1.26 -4.56 116.55 112.59 1wnb n ASP 371 Ca 0.11 -1.75 -0.39 0.00 0.71 0.00 0.00 54.79 53.48 1wnb n ASP 371 Cb 0.37 -0.12 -0.05 0.00 -0.02 0.00 0.00 41.12 41.29 1wnb n ASP 371 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1wnb s ASP 372 N -1.51 7.32 0.32 -2.24 1.01 0.27 -4.92 116.67 116.92 1wnb s ASP 372 Ca 0.32 2.08 0.06 0.00 0.71 0.00 0.00 52.55 55.72 1wnb s ASP 372 Cb 0.17 -2.61 0.71 0.00 1.01 0.00 0.00 42.92 42.20 1wnb s ASP 372 CO 0.25 -0.09 1.83 0.00 0.21 0.00 0.00 175.17 177.38 1wnb h ALA 373 N 3.64 1.69 -0.13 5.23 0.00 -1.90 0.16 119.26 127.95 1wnb h ALA 373 Ca -0.46 0.03 0.04 0.00 0.00 0.00 0.00 54.91 54.52 1wnb h ALA 373 Cb 1.21 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 1wnb h ALA 373 CO 0.66 0.03 0.20 0.97 0.00 0.00 0.00 179.25 181.11 1wnb h ILE 374 N 0.82 0.30 0.03 0.00 6.09 -1.91 -1.41 117.51 121.43 1wnb h ILE 374 Ca 0.50 0.00 -0.33 0.00 -1.37 0.00 0.00 64.86 63.66 1wnb h ILE 374 Cb 0.70 0.83 -0.05 0.00 0.47 0.00 0.00 36.82 38.77 1wnb h ILE 374 CO -0.27 0.00 -1.99 0.52 -3.07 0.00 0.00 178.15 173.34 1wnb n VAL 375 N -3.52 1.60 0.02 2.19 0.31 0.48 -4.53 118.33 114.88 1wnb n VAL 375 Ca 0.00 -0.76 -0.01 0.00 -0.01 0.00 0.00 64.34 63.57 1wnb n VAL 375 Cb 0.30 -1.12 -0.09 0.00 -0.91 0.00 0.00 33.84 32.02 1wnb n VAL 375 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1wnb n GLN 376 N -3.11 0.62 -4.77 5.55 1.13 -0.78 -4.92 117.38 111.11 1wnb n GLN 376 Ca -0.26 0.22 -0.33 0.00 -1.94 0.00 0.00 57.00 54.69 1wnb n GLN 376 Cb 1.07 -1.80 -0.15 0.00 0.11 0.00 0.00 30.24 29.47 1wnb n GLN 376 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 1wnb s LYS 377 N -2.89 3.32 0.11 -1.09 1.02 -0.57 -4.85 119.74 114.80 1wnb s LYS 377 Ca -0.03 -0.71 -0.31 0.00 0.02 0.00 0.00 55.97 54.93 1wnb s LYS 377 Cb 0.09 -2.60 -0.10 0.00 -0.52 0.00 0.00 37.83 34.69 1wnb s LYS 377 CO 0.81 0.17 1.79 -2.00 -0.92 0.00 0.00 175.35 175.21 1wnb s GLU 378 N 0.44 4.15 -0.06 1.68 2.12 -1.26 -4.76 118.70 121.01 1wnb s GLU 378 Ca -0.11 2.54 0.02 0.00 0.36 0.00 0.00 54.97 57.78 1wnb s GLU 378 Cb -0.16 -3.59 -0.25 0.00 0.26 0.00 0.00 34.13 30.39 1wnb s GLU 378 CO 0.05 -0.82 0.60 0.28 -0.54 0.00 0.00 175.26 174.83 1wnb h VAL 379 N 4.70 0.84 -5.54 3.70 2.07 -1.92 -3.49 116.25 116.61 1wnb h VAL 379 Ca -0.45 -2.59 -0.42 0.00 0.82 0.00 0.00 66.70 64.05 1wnb h VAL 379 Cb 1.21 2.53 0.03 0.00 -1.52 0.00 0.00 31.29 33.55 1wnb h VAL 379 CO 0.94 0.72 -0.67 0.33 0.02 0.00 0.00 177.57 178.92 1wnb n PHE 380 N -3.30 -2.31 -4.31 1.57 7.35 -1.26 -4.73 117.46 110.47 1wnb n PHE 380 Ca -0.22 0.77 -0.19 0.00 -0.76 0.00 0.00 57.45 57.04 1wnb n PHE 380 Cb 1.05 -4.28 -0.08 0.00 0.35 0.00 0.00 39.48 36.51 1wnb n PHE 380 CO 0.00 0.00 0.00 0.20 -0.76 0.00 0.00 176.76 176.20 1wnb s GLY 381 N -3.05 2.28 -1.27 7.13 0.00 -1.22 -4.06 107.32 107.12 1wnb s GLY 381 Ca 0.51 -1.92 -0.16 0.00 0.00 0.00 0.00 44.72 43.14 1wnb s GLY 381 CO 0.63 -1.51 2.17 -1.55 0.00 0.00 0.00 173.10 172.83 1wnb n PRO 382 N -0.62 2.50 -3.73 2.90 -0.04 0.31 -4.19 135.00 132.12 1wnb n PRO 382 Ca 0.05 -2.37 -0.13 0.00 -0.04 0.00 0.00 63.50 61.01 1wnb n PRO 382 Cb 0.63 -3.17 -0.13 0.00 -0.04 0.00 0.00 33.50 30.79 1wnb n PRO 382 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1wnb s VAL 383 N 3.66 -0.05 -0.02 0.52 1.01 -1.26 -1.21 120.40 123.06 1wnb s VAL 383 Ca 0.50 0.16 0.03 0.00 0.00 0.00 0.00 61.98 62.68 1wnb s VAL 383 Cb 0.14 -0.34 -0.00 0.00 0.00 0.00 0.00 36.38 36.17 1wnb s VAL 383 CO -0.03 0.06 -0.12 -0.69 0.00 0.00 0.00 175.10 174.32 1wnb s VAL 384 N 1.25 0.98 0.17 2.92 1.01 -0.72 -4.81 120.40 121.21 1wnb s VAL 384 Ca -0.09 -0.50 0.06 0.00 0.00 0.00 0.00 61.98 61.45 1wnb s VAL 384 Cb -0.11 -0.84 -0.04 0.00 0.00 0.00 0.00 36.38 35.39 1wnb s VAL 384 CO -0.08 0.29 0.06 -0.94 0.00 0.00 0.00 175.10 174.43 1wnb s SER 385 N -0.08 5.11 -0.07 3.32 1.04 -0.94 0.02 113.70 122.09 1wnb s SER 385 Ca 0.01 -0.28 0.02 0.00 0.48 0.00 0.00 55.95 56.18 1wnb s SER 385 Cb -0.07 -1.21 0.01 0.00 0.10 0.00 0.00 66.02 64.85 1wnb s SER 385 CO 0.00 0.08 -0.14 -0.69 0.98 0.00 0.00 173.24 173.47 1wnb s VAL 386 N -1.76 1.31 -0.07 5.02 1.01 0.33 -0.72 120.40 125.52 1wnb s VAL 386 Ca 0.29 -0.58 0.04 0.00 0.00 0.00 0.00 61.98 61.74 1wnb s VAL 386 Cb -0.10 -1.18 -0.00 0.00 0.00 0.00 0.00 36.38 35.10 1wnb s VAL 386 CO 0.21 0.39 -0.21 -0.89 0.00 0.00 0.00 175.10 174.61 1wnb s THR 387 N 0.64 1.75 0.43 3.92 2.01 0.01 -2.15 115.64 122.25 1wnb s THR 387 Ca -0.15 -0.86 -0.21 0.00 0.31 0.00 0.00 61.69 60.78 1wnb s THR 387 Cb -0.16 -1.51 -0.10 0.00 0.01 0.00 0.00 72.50 70.73 1wnb s THR 387 CO 0.04 0.49 0.97 -2.16 -0.69 0.00 0.00 174.62 173.28 1wnb s PRO 388 N 0.23 4.16 0.05 4.92 0.04 -1.26 -0.03 135.00 143.12 1wnb s PRO 388 Ca -0.12 1.21 0.02 0.00 0.04 0.00 0.00 61.00 62.15 1wnb s PRO 388 Cb -0.15 -2.23 -0.03 0.00 0.04 0.00 0.00 34.50 32.13 1wnb s PRO 388 CO 0.05 -0.10 -0.06 -0.59 0.04 0.00 0.00 177.00 176.34 1wnb s PHE 389 N -2.06 0.65 -0.04 0.56 -0.12 -0.74 -4.82 117.98 111.41 1wnb s PHE 389 Ca 0.62 -0.64 -0.00 0.00 -0.05 0.00 0.00 56.93 56.86 1wnb s PHE 389 Cb -0.12 -0.40 -0.00 0.00 -0.63 0.00 0.00 43.02 41.87 1wnb s PHE 389 CO 0.16 -0.13 -0.00 0.22 -0.05 0.00 0.00 175.22 175.41 1wnb h ASP 390 N 4.08 0.00 -5.25 1.98 3.58 -1.96 -0.37 116.42 118.48 1wnb h ASP 390 Ca -0.35 0.00 -0.20 0.00 0.42 0.00 0.00 57.03 56.90 1wnb h ASP 390 Cb 1.19 0.00 -0.15 0.00 1.72 0.00 0.00 39.33 42.09 1wnb h ASP 390 CO 0.48 0.19 -0.65 0.54 -2.88 0.00 0.00 179.24 176.92 1wnb s ASN 391 N -3.98 0.48 0.18 2.28 4.22 -1.26 -4.74 114.94 112.13 1wnb s ASN 391 Ca -0.00 -1.19 -0.12 0.00 -2.14 0.00 0.00 52.86 49.41 1wnb s ASN 391 Cb 0.00 0.26 0.16 0.00 1.28 0.00 0.00 41.25 42.95 1wnb s ASN 391 CO 0.00 -0.69 1.78 -0.08 -2.04 0.00 0.00 177.10 176.07 1wnb h GLU 392 N 2.86 0.47 -0.10 3.55 4.81 -2.00 -2.01 114.58 122.16 1wnb h GLU 392 Ca -0.35 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 58.83 1wnb h GLU 392 Cb 1.19 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 30.46 1wnb h GLU 392 CO 0.60 0.31 -0.01 1.49 -0.73 0.00 0.00 179.01 180.68 1wnb h GLU 393 N 0.49 0.19 -0.10 1.92 4.57 -2.00 -1.96 114.58 117.69 1wnb h GLU 393 Ca 0.24 -0.06 0.04 0.00 -1.18 0.00 0.00 59.36 58.39 1wnb h GLU 393 Cb 0.17 -0.02 -0.06 0.00 -0.16 0.00 0.00 28.75 28.68 1wnb h GLU 393 CO -0.18 0.45 -0.43 0.37 -1.18 0.00 0.00 179.01 178.05 1wnb h GLN 394 N -0.10 -0.50 -0.84 1.92 4.15 -1.95 -2.10 115.11 115.69 1wnb h GLN 394 Ca 0.03 0.03 -0.02 0.00 0.77 0.00 0.00 58.65 59.46 1wnb h GLN 394 Cb 0.37 0.11 -0.04 0.00 0.21 0.00 0.00 27.48 28.14 1wnb h GLN 394 CO 0.01 -0.33 0.43 -0.24 -1.93 0.00 0.00 178.83 176.77 1wnb h VAL 395 N -0.52 1.25 -0.16 2.39 3.04 -1.33 0.25 116.25 121.17 1wnb h VAL 395 Ca 0.06 -0.65 -0.00 0.00 -1.01 0.00 0.00 66.70 65.10 1wnb h VAL 395 Cb 0.64 0.14 -0.01 0.00 -2.01 0.00 0.00 31.29 30.06 1wnb h VAL 395 CO -0.38 0.29 0.09 0.58 -1.01 0.00 0.00 177.57 177.14 1wnb h VAL 396 N 1.18 1.08 -0.89 1.51 2.07 -1.32 0.27 116.25 120.14 1wnb h VAL 396 Ca 0.29 -0.20 0.04 0.00 0.82 0.00 0.00 66.70 67.66 1wnb h VAL 396 Cb 0.06 0.92 -0.06 0.00 -1.52 0.00 0.00 31.29 30.70 1wnb h VAL 396 CO -0.04 0.07 0.57 0.78 0.02 0.00 0.00 177.57 178.97 1wnb h ASN 397 N 0.18 0.94 -0.29 0.57 2.35 -1.18 0.83 115.58 118.98 1wnb h ASN 397 Ca 0.06 -0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.74 1wnb h ASN 397 Cb 0.04 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.19 1wnb h ASN 397 CO -0.01 0.63 -0.06 -0.50 -1.65 0.00 0.00 177.43 175.85 1wnb h TRP 398 N 1.10 0.62 -0.91 1.19 6.55 -0.69 -1.00 115.95 122.81 1wnb h TRP 398 Ca 0.37 -0.13 -0.01 0.00 0.95 0.00 0.00 58.89 60.06 1wnb h TRP 398 Cb 0.05 -0.15 -0.04 0.00 -0.86 0.00 0.00 29.16 28.15 1wnb h TRP 398 CO -0.02 0.74 0.51 0.00 -1.05 0.00 0.00 178.44 178.62 1wnb h ALA 399 N 0.79 1.19 0.00 1.49 0.00 -0.05 -2.63 119.26 120.05 1wnb h ALA 399 Ca 0.08 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1wnb h ALA 399 Cb 0.53 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1wnb h ALA 399 CO 0.03 0.66 -0.18 0.09 0.00 0.00 0.00 179.25 179.85 1wnb n ASN 400 N -4.33 0.67 -4.09 0.00 3.02 0.25 -4.15 115.26 106.63 1wnb n ASN 400 Ca 0.10 0.42 -0.43 0.00 -0.03 0.00 0.00 54.58 54.63 1wnb n ASN 400 Cb 0.09 -0.47 0.00 0.00 -0.61 0.00 0.00 39.78 38.79 1wnb n ASN 400 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1wnb n ASP 401 N -2.09 4.81 -3.82 6.41 2.03 -0.39 -4.89 116.55 118.61 1wnb n ASP 401 Ca 0.05 -2.99 -0.11 0.00 0.52 0.00 0.00 54.79 52.26 1wnb n ASP 401 Cb 0.42 -1.59 -0.08 0.00 -0.72 0.00 0.00 41.12 39.15 1wnb n ASP 401 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 1wnb s SER 402 N 2.39 -0.03 0.00 1.67 0.15 -1.26 -4.97 113.70 111.66 1wnb s SER 402 Ca 0.44 -0.26 0.28 0.00 0.70 0.00 0.00 55.95 57.11 1wnb s SER 402 Cb 0.07 0.30 0.99 0.00 -1.71 0.00 0.00 66.02 65.67 1wnb s SER 402 CO -0.01 -0.54 1.73 0.00 1.20 0.00 0.00 173.24 175.62 1wnb n GLN 403 N 0.79 0.42 -3.34 5.44 10.64 -1.26 -4.90 117.38 125.17 1wnb n GLN 403 Ca -0.19 -0.17 -0.28 0.00 -1.83 0.00 0.00 57.00 54.53 1wnb n GLN 403 Cb 0.58 -1.50 -0.03 0.00 -0.86 0.00 0.00 30.24 28.44 1wnb n GLN 403 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.06 175.94 1wnb s TYR 404 N -2.70 3.48 -0.02 2.61 2.02 -1.26 -0.49 117.35 121.00 1wnb s TYR 404 Ca 0.21 0.60 0.06 0.00 -0.37 0.00 0.00 57.07 57.57 1wnb s TYR 404 Cb 0.19 -2.07 0.11 0.00 -0.40 0.00 0.00 41.96 39.78 1wnb s TYR 404 CO 0.54 0.16 1.06 0.41 -1.57 0.00 0.00 175.55 176.15 1wnb n GLY 405 N -1.06 0.67 0.08 0.71 0.00 -1.21 -4.89 105.19 99.49 1wnb n GLY 405 Ca -0.02 -0.19 -0.13 0.00 0.00 0.00 0.00 46.02 45.69 1wnb n GLY 405 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1wnb h LEU 406 N 0.26 0.00 -7.74 0.99 5.85 -1.82 0.34 115.31 113.19 1wnb h LEU 406 Ca -0.49 -0.32 -0.07 0.00 0.84 0.00 0.00 57.88 57.83 1wnb h LEU 406 Cb 1.50 0.00 -0.13 0.00 0.37 0.00 0.00 40.66 42.41 1wnb h LEU 406 CO -0.20 1.08 -0.20 0.00 -0.34 0.00 0.00 178.44 178.78 1wnb s ALA 407 N -2.50 -0.50 -0.04 1.25 0.00 -1.26 -1.57 121.76 117.14 1wnb s ALA 407 Ca -0.20 -0.46 -0.30 0.00 0.00 0.00 0.00 51.96 51.00 1wnb s ALA 407 Cb 0.03 0.72 0.11 0.00 0.00 0.00 0.00 23.12 23.98 1wnb s ALA 407 CO 0.41 -0.64 1.04 -1.54 0.00 0.00 0.00 175.76 175.02 1wnb s SER 408 N -2.88 -0.24 0.02 0.00 1.04 -0.30 -4.13 113.70 107.22 1wnb s SER 408 Ca 0.09 -0.07 -0.04 0.00 0.48 0.00 0.00 55.95 56.41 1wnb s SER 408 Cb 0.02 0.30 -0.01 0.00 0.10 0.00 0.00 66.02 66.43 1wnb s SER 408 CO -0.07 -0.51 0.05 -0.94 0.98 0.00 0.00 173.24 172.75 1wnb s SER 409 N -2.51 0.19 -0.05 7.02 1.04 -0.57 -0.98 113.70 117.85 1wnb s SER 409 Ca 0.08 -0.49 0.04 0.00 0.48 0.00 0.00 55.95 56.07 1wnb s SER 409 Cb -0.00 0.17 -0.00 0.00 0.10 0.00 0.00 66.02 66.29 1wnb s SER 409 CO -0.06 -0.41 -0.19 0.54 0.98 0.00 0.00 173.24 174.11 1wnb s VAL 410 N -2.02 1.57 -0.26 5.02 0.11 0.09 -1.36 120.40 123.55 1wnb s VAL 410 Ca -0.10 -0.79 0.01 0.00 -2.93 0.00 0.00 61.98 58.17 1wnb s VAL 410 Cb -0.05 -1.35 0.05 0.00 -1.53 0.00 0.00 36.38 33.50 1wnb s VAL 410 CO -0.02 0.45 -0.09 0.26 -3.33 0.00 0.00 175.10 172.37 1wnb s TRP 411 N 0.07 3.19 -0.19 1.54 0.52 0.33 -0.75 118.94 123.65 1wnb s TRP 411 Ca -0.06 -2.05 -0.29 0.00 0.02 0.00 0.00 56.10 53.73 1wnb s TRP 411 Cb -0.13 -1.99 0.12 0.00 -1.15 0.00 0.00 33.47 30.32 1wnb s TRP 411 CO 0.03 -0.83 0.96 -0.08 0.02 0.00 0.00 176.95 177.04 1wnb s THR 412 N 1.19 0.00 -0.57 2.01 -1.32 -1.26 -1.51 115.64 114.18 1wnb s THR 412 Ca -0.05 0.00 0.24 0.00 -1.21 0.00 0.00 61.69 60.67 1wnb s THR 412 Cb -0.19 -1.00 0.08 0.00 -1.51 0.00 0.00 72.50 69.88 1wnb s THR 412 CO -0.05 0.00 1.33 0.11 -2.21 0.00 0.00 174.62 173.80 1wnb h LYS 413 N 3.19 0.00 -6.15 7.08 1.57 -1.93 -3.46 116.57 116.87 1wnb h LYS 413 Ca -0.23 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 57.98 1wnb h LYS 413 Cb 1.16 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 33.42 1wnb h LYS 413 CO 0.25 0.00 0.72 0.34 -0.57 0.00 0.00 179.45 180.20 1wnb s ASP 414 N -4.57 7.14 0.17 0.86 2.15 -1.26 -4.96 116.67 116.21 1wnb s ASP 414 Ca 0.05 1.46 -0.14 0.00 0.43 0.00 0.00 52.55 54.35 1wnb s ASP 414 Cb 0.12 -2.55 0.11 0.00 -0.30 0.00 0.00 42.92 40.31 1wnb s ASP 414 CO 0.72 -0.60 1.77 0.58 -0.17 0.00 0.00 175.17 177.48 1wnb h VAL 415 N 5.32 0.93 0.28 1.11 2.07 -2.00 -1.53 116.25 122.44 1wnb h VAL 415 Ca -0.24 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.14 1wnb h VAL 415 Cb 1.09 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 31.32 1wnb h VAL 415 CO 0.94 0.08 -0.27 1.23 0.02 0.00 0.00 177.57 179.56 1wnb h GLY 416 N 0.42 -0.61 0.78 2.17 0.00 -2.00 -2.12 103.07 101.71 1wnb h GLY 416 Ca 0.20 0.31 0.02 0.00 0.00 0.00 0.00 47.33 47.86 1wnb h GLY 416 CO -0.16 -0.24 -0.05 -0.09 0.00 0.00 0.00 176.54 176.00 1wnb h ARG 417 N -0.57 -0.05 -1.01 4.80 2.43 -1.96 -0.06 114.38 117.95 1wnb h ARG 417 Ca -0.01 0.00 0.24 0.00 -0.81 0.00 0.00 59.98 59.41 1wnb h ARG 417 Cb 0.53 0.01 -0.11 0.00 -0.42 0.00 0.00 29.97 29.98 1wnb h ARG 417 CO -0.05 -0.03 0.63 0.00 -1.51 0.00 0.00 179.97 179.00 1wnb h ALA 418 N 1.02 1.95 0.19 2.80 0.00 -1.04 0.76 119.26 124.94 1wnb h ALA 418 Ca 0.05 0.09 -0.32 0.00 0.00 0.00 0.00 54.91 54.73 1wnb h ALA 418 Cb 0.12 0.00 0.02 0.00 0.00 0.00 0.00 17.79 17.93 1wnb h ALA 418 CO -0.11 -0.37 -1.48 0.45 0.00 0.00 0.00 179.25 177.74 1wnb h HIS 419 N 0.54 0.74 -0.22 0.00 3.86 -0.80 -1.93 115.15 117.33 1wnb h HIS 419 Ca 0.61 -0.54 -0.01 0.00 -1.16 0.00 0.00 60.37 59.27 1wnb h HIS 419 Cb 1.27 -0.03 -0.01 0.00 1.06 0.00 0.00 27.41 29.70 1wnb h HIS 419 CO -0.00 1.49 0.12 0.00 0.86 0.00 0.00 177.93 180.39 1wnb h ARG 420 N 0.11 0.31 -0.30 2.45 3.08 -0.51 -1.42 114.38 118.11 1wnb h ARG 420 Ca -0.24 -0.04 -0.15 0.00 0.07 0.00 0.00 59.98 59.62 1wnb h ARG 420 Cb 2.09 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 32.07 1wnb h ARG 420 CO 0.23 0.30 -0.41 0.28 -1.07 0.00 0.00 179.97 179.29 1wnb h VAL 421 N 0.25 1.29 -0.72 2.04 2.07 -0.93 -2.88 116.25 117.36 1wnb h VAL 421 Ca 0.08 -1.59 -0.06 0.00 0.82 0.00 0.00 66.70 65.95 1wnb h VAL 421 Cb 0.08 1.49 -0.03 0.00 -1.52 0.00 0.00 31.29 31.31 1wnb h VAL 421 CO -0.01 0.52 0.23 0.28 0.02 0.00 0.00 177.57 178.60 1wnb h SER 422 N 0.60 1.04 -0.39 0.57 0.02 -1.27 -1.75 113.55 112.38 1wnb h SER 422 Ca 0.05 -0.19 -0.02 0.00 -0.84 0.00 0.00 61.79 60.78 1wnb h SER 422 Cb 0.96 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 63.21 1wnb h SER 422 CO 0.09 0.97 0.18 0.00 -1.14 0.00 0.00 176.83 176.92 1wnb h ALA 423 N 1.17 1.48 0.00 3.77 0.00 -1.10 -3.28 119.26 121.31 1wnb h ALA 423 Ca 0.24 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1wnb h ALA 423 Cb 0.29 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 1wnb h ALA 423 CO -0.01 0.40 -1.35 0.54 0.00 0.00 0.00 179.25 178.83 1wnb n ARG 424 N -4.37 0.62 -2.00 0.00 1.74 -0.89 -4.93 116.66 106.84 1wnb n ARG 424 Ca 0.03 0.03 -0.42 0.00 -0.77 0.00 0.00 57.85 56.72 1wnb n ARG 424 Cb 0.15 -1.73 -0.03 0.00 -1.02 0.00 0.00 32.46 29.83 1wnb n ARG 424 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1wnb s LEU 425 N -5.13 4.37 -1.25 0.55 1.43 -0.71 -4.91 118.68 113.03 1wnb s LEU 425 Ca -0.03 2.51 -0.07 0.00 -1.03 0.00 0.00 54.13 55.51 1wnb s LEU 425 Cb 0.11 -3.59 0.19 0.00 0.03 0.00 0.00 46.19 42.93 1wnb s LEU 425 CO 0.83 -0.78 1.91 0.00 0.23 0.00 0.00 176.35 178.54 1wnb n GLN 426 N 4.16 4.04 -3.81 1.70 6.02 -1.26 -4.90 117.38 123.33 1wnb n GLN 426 Ca 0.13 -3.73 -0.12 0.00 -0.01 0.00 0.00 57.00 53.27 1wnb n GLN 426 Cb 0.40 -2.78 -0.12 0.00 1.02 0.00 0.00 30.24 28.76 1wnb n GLN 426 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 1wnb s TYR 427 N -0.66 -0.18 0.53 1.08 1.51 -1.26 -4.55 117.35 113.82 1wnb s TYR 427 Ca 0.41 0.44 0.29 0.00 -1.01 0.00 0.00 57.07 57.20 1wnb s TYR 427 Cb 0.11 0.06 1.44 0.00 -0.11 0.00 0.00 41.96 43.46 1wnb s TYR 427 CO -0.00 -0.09 1.94 0.78 -1.11 0.00 0.00 175.55 177.06 1wnb h GLY 428 N 5.84 0.01 -5.16 0.71 0.00 -0.25 -3.40 103.07 100.83 1wnb h GLY 428 Ca -0.25 -0.00 -0.15 0.00 0.00 0.00 0.00 47.33 46.92 1wnb h GLY 428 CO 0.40 0.00 -0.39 0.00 0.00 0.00 0.00 176.54 176.55 1wnb s THR 430 N -0.24 0.81 0.13 0.00 2.01 -1.26 -1.15 115.64 115.94 1wnb s THR 430 Ca -0.04 -0.24 0.01 0.00 0.31 0.00 0.00 61.69 61.73 1wnb s THR 430 Cb -0.03 -0.81 -0.04 0.00 0.01 0.00 0.00 72.50 71.63 1wnb s THR 430 CO 0.01 0.30 0.29 0.26 -0.69 0.00 0.00 174.62 174.79 1wnb s TRP 431 N 1.12 3.50 -0.22 4.92 0.51 -0.15 -4.98 118.94 123.64 1wnb s TRP 431 Ca -0.07 0.23 0.02 0.00 -2.12 0.00 0.00 56.10 54.16 1wnb s TRP 431 Cb -0.14 -1.75 0.05 0.00 -0.81 0.00 0.00 33.47 30.81 1wnb s TRP 431 CO -0.01 0.51 -0.11 0.08 -0.51 0.00 0.00 176.95 176.91 1wnb s VAL 432 N -1.68 1.84 -1.55 4.03 1.01 -1.26 -0.73 120.40 122.06 1wnb s VAL 432 Ca 0.36 -1.22 0.00 0.00 0.00 0.00 0.00 61.98 61.12 1wnb s VAL 432 Cb -0.12 -1.92 0.00 0.00 0.00 0.00 0.00 36.38 34.34 1wnb s VAL 432 CO 0.28 0.12 0.00 0.59 0.00 0.00 0.00 175.10 176.09 1wnb n ASN 433 N 4.60 -5.19 -0.90 3.32 3.02 0.07 -4.94 115.26 115.23 1wnb n ASN 433 Ca -0.15 0.02 0.00 0.00 -0.03 0.00 0.00 54.58 54.42 1wnb n ASN 433 Cb 0.45 -4.27 0.00 0.00 -0.61 0.00 0.00 39.78 35.36 1wnb n ASN 433 CO 0.00 0.00 0.00 1.07 -2.62 0.00 0.00 177.26 175.71 1wnb n THR 434 N -3.89 0.00 -3.48 3.41 5.66 -1.26 -5.02 114.28 109.70 1wnb n THR 434 Ca -0.21 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.69 1wnb n THR 434 Cb 0.65 0.00 -0.02 0.00 -1.55 0.00 0.00 70.33 69.41 1wnb n THR 434 CO 0.00 0.00 0.00 -2.28 -3.05 0.00 0.00 175.07 169.74 1wnb s HIS 435 N -7.11 -0.45 0.00 1.09 2.46 -1.26 -4.69 115.29 105.32 1wnb s HIS 435 Ca 0.00 0.25 0.00 0.00 0.47 0.00 0.00 55.06 55.78 1wnb s HIS 435 Cb 0.00 0.56 0.00 0.00 -0.13 0.00 0.00 32.58 33.01 1wnb s HIS 435 CO 0.00 -0.78 0.00 0.34 -2.47 0.00 0.00 174.74 171.83 1wnb n PHE 436 N -0.35 0.00 -2.72 3.88 -0.00 -1.26 -4.97 117.46 112.03 1wnb n PHE 436 Ca -0.14 0.00 -0.43 0.00 -0.00 0.00 0.00 57.45 56.89 1wnb n PHE 436 Cb 0.64 0.00 -0.03 0.00 -0.00 0.00 0.00 39.48 40.09 1wnb n PHE 436 CO 0.00 0.00 0.00 -1.64 -0.00 0.00 0.00 176.76 175.12 1wnb s MET 437 N -0.16 4.25 -0.04 -4.13 1.00 -1.26 -5.02 119.30 113.94 1wnb s MET 437 Ca 0.00 1.25 0.05 0.00 0.00 0.00 0.00 55.69 57.00 1wnb s MET 437 Cb 0.00 -3.64 -0.02 0.00 0.00 0.00 0.00 34.83 31.17 1wnb s MET 437 CO 0.00 -0.58 -0.19 -0.51 0.00 0.00 0.00 175.02 173.73 1wnb s LEU 438 N 3.04 2.45 0.07 -0.03 1.43 -1.26 -5.11 118.68 119.27 1wnb s LEU 438 Ca 0.42 -0.31 0.05 0.00 -1.03 0.00 0.00 54.13 53.26 1wnb s LEU 438 Cb -0.15 -1.46 -0.03 0.00 0.03 0.00 0.00 46.19 44.57 1wnb s LEU 438 CO 0.07 0.33 -0.15 0.68 0.23 0.00 0.00 176.35 177.51 1wnb s VAL 439 N -0.66 1.17 0.49 -1.59 -7.23 -1.26 -5.06 120.40 106.25 1wnb s VAL 439 Ca 0.10 -1.33 0.14 0.00 -1.81 0.00 0.00 61.98 59.08 1wnb s VAL 439 Cb -0.10 -1.12 0.25 0.00 0.56 0.00 0.00 36.38 35.97 1wnb s VAL 439 CO -0.00 -0.21 2.11 0.28 -0.31 0.00 0.00 175.10 176.97 1wnb h SER 440 N 4.26 0.08 1.06 4.85 0.02 -1.96 -2.09 113.55 119.77 1wnb h SER 440 Ca -0.41 -0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.52 1wnb h SER 440 Cb 1.19 -0.02 -0.00 0.00 0.14 0.00 0.00 62.40 63.71 1wnb h SER 440 CO 0.40 0.09 -0.04 -0.33 -1.14 0.00 0.00 176.83 175.81 1wnb h GLU 441 N 0.09 0.00 -5.54 3.45 3.07 -1.96 -1.47 114.58 112.22 1wnb h GLU 441 Ca 0.02 0.00 -0.65 0.00 -0.50 0.00 0.00 59.36 58.24 1wnb h GLU 441 Cb 0.04 0.00 -0.17 0.00 -0.84 0.00 0.00 28.75 27.79 1wnb h GLU 441 CO -0.00 0.04 -0.61 -1.64 -1.40 0.00 0.00 179.01 175.40 1wnb s MET 442 N -3.64 3.52 0.60 2.33 -1.94 -0.79 -4.26 119.30 115.12 1wnb s MET 442 Ca 0.01 -0.41 -0.16 0.00 -1.71 0.00 0.00 55.69 53.43 1wnb s MET 442 Cb 0.09 -2.98 -0.03 0.00 2.01 0.00 0.00 34.83 33.92 1wnb s MET 442 CO 0.57 0.44 1.08 -1.25 -0.01 0.00 0.00 175.02 175.84 1wnb s PRO 443 N -0.13 3.18 -0.05 2.03 0.04 -1.26 -4.34 135.00 134.46 1wnb s PRO 443 Ca 0.05 1.31 0.00 0.00 0.04 0.00 0.00 61.00 62.40 1wnb s PRO 443 Cb -0.12 -2.01 0.02 0.00 0.04 0.00 0.00 34.50 32.43 1wnb s PRO 443 CO 0.02 -0.93 -0.03 -1.58 0.04 0.00 0.00 177.00 174.51 1wnb s HIS 444 N -2.33 0.74 0.00 0.56 2.46 -0.76 -4.94 115.29 111.02 1wnb s HIS 444 Ca 0.66 -0.21 0.00 0.00 0.47 0.00 0.00 55.06 55.97 1wnb s HIS 444 Cb -0.18 -0.71 0.00 0.00 -0.13 0.00 0.00 32.58 31.55 1wnb s HIS 444 CO 0.37 -0.24 0.00 0.41 -2.47 0.00 0.00 174.74 172.81 1wnb n GLY 445 N 4.36 1.53 0.00 1.59 0.00 -1.26 -0.39 105.19 111.02 1wnb n GLY 445 Ca -0.20 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 44.73 1wnb n GLY 445 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wnb n GLY 446 N -0.86 4.53 3.44 -0.02 0.00 -1.26 -3.94 105.19 107.07 1wnb n GLY 446 Ca 0.00 -2.11 -0.16 0.00 0.00 0.00 0.00 46.02 43.75 1wnb n GLY 446 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1wnb s GLN 447 N -0.10 1.93 4.24 1.61 -2.07 -1.09 -4.27 119.66 119.91 1wnb s GLN 447 Ca 0.00 -1.86 0.00 0.00 -1.82 0.00 0.00 55.36 51.68 1wnb s GLN 447 Cb 0.00 0.42 0.00 0.00 -1.09 0.00 0.00 33.01 32.34 1wnb s GLN 447 CO 0.00 -0.78 0.00 1.63 -1.32 0.00 0.00 175.29 174.82 1wnb n LYS 448 N -0.60 0.00 0.00 9.60 5.02 -1.26 -1.72 118.16 129.20 1wnb n LYS 448 Ca 0.03 0.00 0.12 0.00 -2.02 0.00 0.00 58.31 56.44 1wnb n LYS 448 Cb 0.62 0.00 0.73 0.00 -0.02 0.00 0.00 35.03 36.35 1wnb n LYS 448 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1wnb n LEU 449 N 0.00 0.00 0.06 -0.35 4.32 0.35 -1.58 117.00 119.80 1wnb n LEU 449 Ca 0.00 0.00 0.12 0.00 -0.02 0.00 0.00 56.01 56.11 1wnb n LEU 449 Cb 0.00 0.00 0.48 0.00 -1.62 0.00 0.00 43.42 42.28 1wnb n LEU 449 CO 0.00 0.00 0.88 -1.20 -1.22 0.00 0.00 177.39 175.85 1wnb n SER 450 N -0.89 0.40 0.00 -1.43 7.64 -0.70 -4.63 113.62 114.02 1wnb n SER 450 Ca 0.18 0.55 0.00 0.00 1.01 0.00 0.00 58.87 60.62 1wnb n SER 450 Cb 0.08 -0.66 0.00 0.00 -1.01 0.00 0.00 64.21 62.63 1wnb n SER 450 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wnb n GLY 451 N 0.98 0.33 3.52 0.23 0.00 -0.61 -0.48 105.19 109.16 1wnb n GLY 451 Ca 0.05 -1.78 -0.08 0.00 0.00 0.00 0.00 46.02 44.21 1wnb n GLY 451 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1wnb s TYR 452 N 0.00 -0.33 0.00 1.61 -0.85 -0.53 -3.01 117.35 114.24 1wnb s TYR 452 Ca 0.00 0.18 0.00 0.00 -0.52 0.00 0.00 57.07 56.73 1wnb s TYR 452 Cb 0.00 0.55 0.00 0.00 0.38 0.00 0.00 41.96 42.89 1wnb s TYR 452 CO 0.00 -0.58 0.00 0.41 -1.52 0.00 0.00 175.55 173.86 1wnb n GLY 453 N -0.27 -0.47 3.45 5.49 0.00 -1.26 -1.74 105.19 110.39 1wnb n GLY 453 Ca -0.09 -1.54 -0.26 0.00 0.00 0.00 0.00 46.02 44.13 1wnb n GLY 453 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wnb s LYS 454 N -3.74 1.63 0.20 1.61 -0.14 -1.26 -4.23 119.74 113.81 1wnb s LYS 454 Ca 0.00 -1.55 0.09 0.00 -1.36 0.00 0.00 55.97 53.15 1wnb s LYS 454 Cb 0.00 -1.87 -0.04 0.00 -1.68 0.00 0.00 37.83 34.24 1wnb s LYS 454 CO 0.00 0.39 -0.05 -0.51 -0.76 0.00 0.00 175.35 174.42 1wnb s ASP 455 N -2.88 4.44 0.46 2.83 1.01 0.48 -4.30 116.67 118.71 1wnb s ASP 455 Ca 0.23 -0.55 0.00 0.00 0.71 0.00 0.00 52.55 52.94 1wnb s ASP 455 Cb -0.07 -0.82 0.00 0.00 1.01 0.00 0.00 42.92 43.04 1wnb s ASP 455 CO 0.12 0.08 0.00 0.23 0.21 0.00 0.00 175.17 175.80 1wnb n MET 456 N -0.22 -3.02 -0.51 8.23 2.81 -1.26 -1.82 117.12 121.33 1wnb n MET 456 Ca -0.09 2.23 0.06 0.00 -1.81 0.00 0.00 57.70 58.09 1wnb n MET 456 Cb 0.56 -3.63 -0.03 0.00 -0.71 0.00 0.00 33.22 29.41 1wnb n MET 456 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 1wnb n SER 457 N -4.34 -3.00 -0.17 7.83 3.41 -0.55 -2.26 113.62 114.55 1wnb n SER 457 Ca -0.03 0.41 0.20 0.00 -0.26 0.00 0.00 58.87 59.18 1wnb n SER 457 Cb 0.68 -1.69 0.57 0.00 -0.26 0.00 0.00 64.21 63.51 1wnb n SER 457 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1wnb h LEU 458 N -0.50 0.27 -0.51 1.04 3.38 -1.87 -2.25 115.31 114.88 1wnb h LEU 458 Ca -0.04 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 1wnb h LEU 458 Cb 0.48 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 1wnb h LEU 458 CO 0.02 0.12 0.15 1.88 0.09 0.00 0.00 178.44 180.70 1wnb h TYR 459 N 0.28 0.82 0.00 1.13 0.05 -1.94 -1.17 116.97 116.15 1wnb h TYR 459 Ca 0.39 -0.09 -0.01 0.00 0.05 0.00 0.00 58.73 59.08 1wnb h TYR 459 Cb 1.12 -0.24 -0.00 0.00 1.01 0.00 0.00 36.73 38.63 1wnb h TYR 459 CO -0.00 0.72 -0.03 0.78 -1.05 0.00 0.00 178.16 178.58 1wnb h GLY 460 N 0.69 0.00 0.58 3.88 0.00 -0.95 -1.46 103.07 105.81 1wnb h GLY 460 Ca 0.16 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.36 1wnb h GLY 460 CO -0.00 0.00 -0.55 -2.00 0.00 0.00 0.00 176.54 173.98 1wnb h LEU 461 N 0.00 0.38 -0.98 3.11 5.85 -1.35 -3.34 115.31 118.98 1wnb h LEU 461 Ca -0.00 -0.88 0.11 0.00 0.84 0.00 0.00 57.88 57.95 1wnb h LEU 461 Cb 0.16 -0.12 -0.08 0.00 0.37 0.00 0.00 40.66 40.99 1wnb h LEU 461 CO 0.00 1.22 0.61 -0.33 -0.34 0.00 0.00 178.44 179.60 1wnb h GLU 462 N -0.41 0.94 -0.16 1.25 5.08 -0.25 -1.58 114.58 119.45 1wnb h GLU 462 Ca -0.09 -0.06 0.05 0.00 -1.00 0.00 0.00 59.36 58.26 1wnb h GLU 462 Cb 1.36 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 30.39 1wnb h GLU 462 CO 0.11 0.62 0.48 -0.44 -1.00 0.00 0.00 179.01 178.78 1wnb h ASP 463 N 0.97 0.00 -0.51 1.42 3.32 -1.45 -1.65 116.42 118.51 1wnb h ASP 463 Ca 0.48 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 57.34 1wnb h ASP 463 Cb 0.46 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 39.90 1wnb h ASP 463 CO -0.26 0.00 0.13 -1.22 -1.72 0.00 0.00 179.24 176.17 1wnb n TYR 464 N -3.09 1.67 -4.20 4.55 4.01 -0.59 -4.98 117.16 114.52 1wnb n TYR 464 Ca 0.02 -1.35 -0.15 0.00 -0.16 0.00 0.00 57.90 56.26 1wnb n TYR 464 Cb 0.57 -0.56 -0.11 0.00 -0.31 0.00 0.00 39.34 38.94 1wnb n TYR 464 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 1wnb s THR 465 N -3.09 1.08 -0.13 -0.72 -4.23 -0.62 -4.04 115.64 103.89 1wnb s THR 465 Ca 0.48 -1.72 -0.04 0.00 -1.18 0.00 0.00 61.69 59.24 1wnb s THR 465 Cb 0.41 -1.47 -0.03 0.00 1.34 0.00 0.00 72.50 72.74 1wnb s THR 465 CO 0.07 -0.54 -0.00 0.54 -0.54 0.00 0.00 174.62 174.14 1wnb s VAL 466 N -2.47 4.24 0.03 2.29 0.11 0.20 -4.91 120.40 119.88 1wnb s VAL 466 Ca 0.08 -0.25 -0.29 0.00 -2.93 0.00 0.00 61.98 58.59 1wnb s VAL 466 Cb -0.03 -2.84 -0.04 0.00 -1.53 0.00 0.00 36.38 31.94 1wnb s VAL 466 CO 0.01 0.53 0.93 -0.69 -3.33 0.00 0.00 175.10 172.55 1wnb s VAL 467 N -0.13 4.75 -0.04 2.04 1.01 -1.26 -1.89 120.40 124.88 1wnb s VAL 467 Ca 0.04 1.97 0.04 0.00 0.00 0.00 0.00 61.98 64.04 1wnb s VAL 467 Cb -0.13 -4.28 -0.00 0.00 0.00 0.00 0.00 36.38 31.97 1wnb s VAL 467 CO 0.02 0.24 -0.17 -0.13 0.00 0.00 0.00 175.10 175.05 1wnb s ARG 468 N 0.57 1.82 -0.29 2.72 0.52 -0.60 -4.98 118.95 118.71 1wnb s ARG 468 Ca 0.48 -0.62 -0.11 0.00 -0.52 0.00 0.00 55.73 54.96 1wnb s ARG 468 Cb -0.21 -1.58 -0.04 0.00 0.52 0.00 0.00 34.95 33.64 1wnb s ARG 468 CO 0.27 0.24 0.18 -1.58 0.02 0.00 0.00 175.30 174.44 1wnb s HIS 469 N 0.05 3.20 -0.16 -0.53 5.65 -1.26 -0.23 115.29 122.02 1wnb s HIS 469 Ca -0.04 -0.04 -0.01 0.00 0.25 0.00 0.00 55.06 55.22 1wnb s HIS 469 Cb -0.12 -2.38 -0.01 0.00 -1.18 0.00 0.00 32.58 28.89 1wnb s HIS 469 CO 0.02 -0.23 -0.10 0.08 -0.65 0.00 0.00 174.74 173.86 1wnb s VAL 470 N 1.73 3.18 -0.07 0.89 1.01 -0.74 -5.00 120.40 121.39 1wnb s VAL 470 Ca 0.07 -0.60 0.00 0.00 0.00 0.00 0.00 61.98 61.45 1wnb s VAL 470 Cb -0.16 -2.37 0.02 0.00 0.00 0.00 0.00 36.38 33.87 1wnb s VAL 470 CO 0.10 0.50 -0.05 -0.32 0.00 0.00 0.00 175.10 175.33 1wnb s MET 471 N 0.67 1.07 -0.22 2.72 0.00 -1.26 -0.61 119.30 121.67 1wnb s MET 471 Ca -0.05 -0.12 -0.04 0.00 0.00 0.00 0.00 55.69 55.48 1wnb s MET 471 Cb -0.15 -1.15 -0.01 0.00 0.00 0.00 0.00 34.83 33.52 1wnb s MET 471 CO 0.02 -0.18 -0.05 0.08 0.00 0.00 0.00 175.02 174.90 1wnb s VAL 472 N 1.39 3.32 0.18 10.11 1.01 0.17 -4.96 120.40 131.62 1wnb s VAL 472 Ca -0.03 -0.51 -0.30 0.00 0.00 0.00 0.00 61.98 61.14 1wnb s VAL 472 Cb -0.13 -2.50 -0.08 0.00 0.00 0.00 0.00 36.38 33.66 1wnb s VAL 472 CO -0.03 0.43 1.30 -0.75 0.00 0.00 0.00 175.10 176.04 1wnb s LYS 473 N 1.46 4.40 0.00 2.72 2.20 -1.26 -1.66 119.74 127.59 1wnb s LYS 473 Ca 0.06 2.02 0.21 0.00 -0.36 0.00 0.00 55.97 57.90 1wnb s LYS 473 Cb -0.14 -3.21 1.26 0.00 -1.51 0.00 0.00 37.83 34.22 1wnb s LYS 473 CO -0.04 -0.25 1.64 0.72 -0.36 0.00 0.00 175.35 177.07