#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 4.07 0.00 0.03 -1.52 -1.26 -4.97 119.66 116.01 1wnb s GLN 2 Ca 0.00 0.29 0.00 0.00 -1.95 0.00 0.00 55.36 53.70 1wnb s GLN 2 Cb 0.00 -3.32 0.00 0.00 -0.22 0.00 0.00 33.01 29.47 1wnb s GLN 2 CO 0.00 0.45 0.32 -2.39 -0.25 0.00 0.00 175.29 173.42 1wnb n HIS 3 N 2.74 0.00 -3.60 0.91 1.44 -1.26 -4.68 115.22 110.76 1wnb n HIS 3 Ca -0.12 -0.03 -0.32 0.00 -2.01 0.00 0.00 57.72 55.24 1wnb n HIS 3 Cb 0.52 -0.00 -0.05 0.00 0.12 0.00 0.00 29.99 30.58 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 -0.06 3.67 0.51 -1.40 1.02 -1.26 -4.68 119.74 117.55 1wnb s LYS 4 Ca 0.00 0.02 -0.18 0.00 0.02 0.00 0.00 55.97 55.82 1wnb s LYS 4 Cb 0.00 -2.80 -0.07 0.00 -0.52 0.00 0.00 37.83 34.43 1wnb s LYS 4 CO 0.00 0.43 1.02 -0.51 -0.92 0.00 0.00 175.35 175.37 1wnb s LEU 5 N -2.67 3.72 -0.29 3.17 1.43 0.62 -4.73 118.68 119.93 1wnb s LEU 5 Ca 0.42 1.78 -0.09 0.00 -1.03 0.00 0.00 54.13 55.22 1wnb s LEU 5 Cb -0.12 -4.54 -0.02 0.00 0.03 0.00 0.00 46.19 41.54 1wnb s LEU 5 CO 0.23 -0.78 0.14 -0.22 0.23 0.00 0.00 176.35 175.95 1wnb s LEU 6 N -3.84 3.94 -0.06 1.79 0.20 -0.32 -0.15 118.68 120.24 1wnb s LEU 6 Ca 0.64 -0.39 0.01 0.00 0.69 0.00 0.00 54.13 55.07 1wnb s LEU 6 Cb -0.14 -2.00 0.02 0.00 -0.43 0.00 0.00 46.19 43.65 1wnb s LEU 6 CO 0.26 -0.14 -0.05 -0.63 -0.29 0.00 0.00 176.35 175.50 1wnb s ILE 7 N 1.63 0.63 -1.46 6.68 1.01 0.47 -1.58 121.20 128.58 1wnb s ILE 7 Ca 0.05 -0.14 -0.02 0.00 0.00 0.00 0.00 60.65 60.55 1wnb s ILE 7 Cb -0.16 -0.67 0.00 0.00 0.01 0.00 0.00 42.46 41.64 1wnb s ILE 7 CO 0.06 0.26 0.23 -3.20 0.00 0.00 0.00 174.94 172.29 1wnb n ASN 8 N 4.33 0.09 0.00 3.58 5.15 -1.26 -0.01 115.26 127.13 1wnb n ASN 8 Ca -0.20 -1.15 0.00 0.00 -0.60 0.00 0.00 54.58 52.63 1wnb n ASN 8 Cb 0.51 -2.29 0.00 0.00 -0.53 0.00 0.00 39.78 37.47 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 -2.28 0.64 3.48 8.20 0.00 -1.26 -4.38 105.19 109.58 1wnb n GLY 9 Ca -0.31 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.42 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 -0.33 1.72 -0.29 1.61 0.41 0.99 -4.91 118.70 117.90 1wnb s GLU 10 Ca 0.00 -1.25 -0.13 0.00 -0.41 0.00 0.00 54.97 53.18 1wnb s GLU 10 Cb 0.00 -2.06 -0.04 0.00 -1.78 0.00 0.00 34.13 30.25 1wnb s GLU 10 CO 0.00 0.46 0.27 -0.51 -0.49 0.00 0.00 175.26 174.99 1wnb s LEU 11 N -2.25 4.09 -0.02 1.80 1.43 -1.26 -0.39 118.68 122.08 1wnb s LEU 11 Ca 0.18 0.04 -0.03 0.00 -1.03 0.00 0.00 54.13 53.29 1wnb s LEU 11 Cb -0.10 -2.24 0.00 0.00 0.03 0.00 0.00 46.19 43.89 1wnb s LEU 11 CO 0.10 -0.13 0.07 0.68 0.23 0.00 0.00 176.35 177.30 1wnb s VAL 12 N 1.88 0.02 0.35 -1.59 -7.23 0.79 -4.91 120.40 109.71 1wnb s VAL 12 Ca 0.10 -0.17 -0.28 0.00 -1.81 0.00 0.00 61.98 59.82 1wnb s VAL 12 Cb -0.16 -0.16 -0.10 0.00 0.56 0.00 0.00 36.38 36.52 1wnb s VAL 12 CO 0.11 -0.09 1.30 -0.44 -0.31 0.00 0.00 175.10 175.67 1wnb s SER 13 N -0.26 6.67 0.48 4.85 0.01 -1.26 -0.27 113.70 123.91 1wnb s SER 13 Ca -0.03 2.68 -0.23 0.00 1.31 0.00 0.00 55.95 59.68 1wnb s SER 13 Cb -0.02 -2.65 -0.08 0.00 0.21 0.00 0.00 66.02 63.48 1wnb s SER 13 CO 0.00 -0.61 1.09 0.61 0.41 0.00 0.00 173.24 174.74 1wnb n GLY 14 N 0.76 0.02 0.20 3.44 0.00 -1.26 -4.87 105.19 103.48 1wnb n GLY 14 Ca 0.01 0.07 0.02 0.00 0.00 0.00 0.00 46.02 46.12 1wnb n GLY 14 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1wnb n GLU 15 N -0.25 2.37 0.00 1.61 1.02 -1.08 -4.78 120.64 119.53 1wnb n GLU 15 Ca 0.10 -1.52 0.00 0.00 -0.02 0.00 0.00 57.16 55.72 1wnb n GLU 15 Cb 0.42 -1.08 0.00 0.00 -0.02 0.00 0.00 31.44 30.75 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 -0.10 1.34 3.75 0.62 0.00 0.15 -4.71 105.19 106.24 1wnb n GLY 16 Ca 0.04 -1.87 -0.40 0.00 0.00 0.00 0.00 46.02 43.79 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 2.44 4.75 0.34 1.61 2.12 -1.26 -4.16 118.70 124.53 1wnb s GLU 17 Ca 0.00 1.63 -0.27 0.00 0.36 0.00 0.00 54.97 56.68 1wnb s GLU 17 Cb 0.00 -3.25 -0.09 0.00 0.26 0.00 0.00 34.13 31.05 1wnb s GLU 17 CO 0.00 0.35 1.16 0.15 -0.54 0.00 0.00 175.26 176.38 1wnb s LYS 18 N -1.17 4.35 0.04 4.30 1.02 -1.26 -0.23 119.74 126.79 1wnb s LYS 18 Ca 0.43 1.88 0.03 0.00 0.02 0.00 0.00 55.97 58.34 1wnb s LYS 18 Cb -0.28 -2.95 -0.02 0.00 -0.52 0.00 0.00 37.83 34.06 1wnb s LYS 18 CO 0.36 -0.07 -0.09 -0.65 -0.92 0.00 0.00 175.35 173.97 1wnb s GLN 19 N -1.88 0.62 0.21 1.68 -1.52 -0.52 -4.92 119.66 113.33 1wnb s GLN 19 Ca 0.51 -0.73 -0.18 0.00 -1.95 0.00 0.00 55.36 53.01 1wnb s GLN 19 Cb -0.32 -0.48 -0.08 0.00 -0.22 0.00 0.00 33.01 31.91 1wnb s GLN 19 CO 0.42 0.10 0.68 -1.25 -0.25 0.00 0.00 175.29 175.00 1wnb s PRO 20 N -1.39 4.18 -0.16 2.91 0.04 -1.26 -0.93 135.00 138.40 1wnb s PRO 20 Ca -0.06 0.78 0.01 0.00 0.04 0.00 0.00 61.00 61.77 1wnb s PRO 20 Cb -0.09 -2.88 0.01 0.00 0.04 0.00 0.00 34.50 31.58 1wnb s PRO 20 CO 0.01 0.41 -0.19 0.08 0.04 0.00 0.00 177.00 177.35 1wnb s VAL 21 N -1.52 2.29 0.08 -0.36 1.01 -0.31 -4.92 120.40 116.66 1wnb s VAL 21 Ca 0.42 -0.89 -0.01 0.00 0.00 0.00 0.00 61.98 61.50 1wnb s VAL 21 Cb -0.16 -1.95 -0.04 0.00 0.00 0.00 0.00 36.38 34.23 1wnb s VAL 21 CO 0.20 0.53 0.25 -0.31 0.00 0.00 0.00 175.10 175.78 1wnb s TYR 22 N 0.96 3.51 -0.46 5.22 1.51 -1.26 0.19 117.35 127.01 1wnb s TYR 22 Ca -0.03 0.33 -0.25 0.00 -1.01 0.00 0.00 57.07 56.10 1wnb s TYR 22 Cb -0.15 -1.82 0.03 0.00 -0.11 0.00 0.00 41.96 39.91 1wnb s TYR 22 CO -0.04 0.55 0.91 1.21 -1.11 0.00 0.00 175.55 177.07 1wnb s ASN 23 N -2.48 6.49 0.49 2.29 3.04 0.03 -4.70 114.94 120.10 1wnb s ASN 23 Ca 0.36 0.09 0.31 0.00 0.04 0.00 0.00 52.86 53.66 1wnb s ASN 23 Cb -0.13 -2.44 1.15 0.00 -1.54 0.00 0.00 41.25 38.29 1wnb s ASN 23 CO 0.27 -1.04 1.89 1.55 -3.04 0.00 0.00 177.10 176.73 1wnb h PRO 24 N 9.07 0.00 0.00 0.43 0.13 -1.79 0.43 132.00 140.27 1wnb h PRO 24 Ca -0.24 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.82 1wnb h PRO 24 Cb 1.08 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.20 1wnb h PRO 24 CO 1.02 0.00 -0.34 0.00 -0.23 0.00 0.00 178.00 178.45 1wnb h ALA 25 N 2.05 1.12 0.00 -0.56 0.00 -1.89 0.16 119.26 120.14 1wnb h ALA 25 Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1wnb h ALA 25 Cb 0.57 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1wnb h ALA 25 CO 0.00 0.43 -0.84 0.25 0.00 0.00 0.00 179.25 179.10 1wnb n THR 26 N -3.68 0.00 -0.92 0.00 -2.24 -1.00 -4.32 114.28 102.13 1wnb n THR 26 Ca -0.01 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.67 1wnb n THR 26 Cb 0.45 0.58 0.00 0.00 -2.10 0.00 0.00 70.33 69.26 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 2.18 0.51 3.80 3.38 0.00 0.15 -3.36 105.19 111.85 1wnb n GLY 27 Ca -0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.34 5.79 -0.05 1.61 1.01 -1.21 -4.84 116.67 116.64 1wnb s ASP 28 Ca 0.00 1.83 -0.30 0.00 0.71 0.00 0.00 52.55 54.80 1wnb s ASP 28 Cb 0.00 -2.54 -0.03 0.00 1.01 0.00 0.00 42.92 41.37 1wnb s ASP 28 CO 0.00 -1.16 1.08 -0.69 0.21 0.00 0.00 175.17 174.61 1wnb s VAL 29 N -2.41 4.55 0.03 -1.27 1.01 -1.26 -0.79 120.40 120.26 1wnb s VAL 29 Ca 0.64 1.84 -0.17 0.00 0.00 0.00 0.00 61.98 64.28 1wnb s VAL 29 Cb -0.16 -4.18 -0.25 0.00 0.00 0.00 0.00 36.38 31.78 1wnb s VAL 29 CO 0.36 0.05 1.10 -0.07 0.00 0.00 0.00 175.10 176.54 1wnb h LEU 30 N 7.65 0.70 -7.04 3.92 3.38 -0.57 -3.46 115.31 119.89 1wnb h LEU 30 Ca -0.35 -0.79 0.38 0.00 0.09 0.00 0.00 57.88 57.21 1wnb h LEU 30 Cb 1.18 -0.22 -0.14 0.00 0.09 0.00 0.00 40.66 41.57 1wnb h LEU 30 CO 0.83 1.41 0.97 -1.48 0.09 0.00 0.00 178.44 180.26 1wnb s LEU 31 N -8.13 -0.01 -0.14 1.67 0.05 -1.20 -5.02 118.68 105.90 1wnb s LEU 31 Ca -0.12 -0.03 -0.03 0.00 0.05 0.00 0.00 54.13 54.01 1wnb s LEU 31 Cb 0.05 1.08 -0.03 0.00 -2.05 0.00 0.00 46.19 45.24 1wnb s LEU 31 CO 0.87 -0.06 -0.04 -1.61 -0.55 0.00 0.00 176.35 174.96 1wnb s GLU 32 N -2.09 3.52 -0.09 1.48 2.02 -1.26 -1.16 118.70 121.11 1wnb s GLU 32 Ca 0.15 -0.52 0.03 0.00 0.02 0.00 0.00 54.97 54.64 1wnb s GLU 32 Cb 0.07 -2.86 0.01 0.00 0.10 0.00 0.00 34.13 31.44 1wnb s GLU 32 CO -0.06 0.32 -0.20 0.42 0.02 0.00 0.00 175.26 175.76 1wnb s ILE 33 N 0.15 1.73 0.16 -1.63 1.01 -0.11 -4.87 121.20 117.63 1wnb s ILE 33 Ca -0.02 -0.82 -0.30 0.00 0.00 0.00 0.00 60.65 59.51 1wnb s ILE 33 Cb -0.14 -1.52 -0.07 0.00 0.01 0.00 0.00 42.46 40.74 1wnb s ILE 33 CO 0.03 0.49 1.16 0.00 0.00 0.00 0.00 174.94 176.62 1wnb s ALA 34 N 0.52 3.40 0.67 9.38 0.00 -1.26 -1.44 121.76 133.03 1wnb s ALA 34 Ca -0.16 0.88 -0.15 0.00 0.00 0.00 0.00 51.96 52.53 1wnb s ALA 34 Cb -0.17 -3.40 0.00 0.00 0.00 0.00 0.00 23.12 19.56 1wnb s ALA 34 CO 0.06 -0.33 1.12 -1.21 0.00 0.00 0.00 175.76 175.40 1wnb s GLU 35 N -0.01 2.74 0.21 0.00 2.02 0.68 -4.02 118.70 120.32 1wnb s GLU 35 Ca 0.53 1.42 -0.32 0.00 0.02 0.00 0.00 54.97 56.61 1wnb s GLU 35 Cb -0.31 -1.94 -0.14 0.00 0.10 0.00 0.00 34.13 31.84 1wnb s GLU 35 CO 0.34 -1.30 1.40 0.00 0.02 0.00 0.00 175.26 175.72 1wnb n ALA 36 N -2.45 0.77 -1.85 5.21 0.00 -0.17 -0.67 120.51 121.34 1wnb n ALA 36 Ca 0.11 0.43 -0.29 0.00 0.00 0.00 0.00 53.44 53.68 1wnb n ALA 36 Cb 0.52 -2.24 0.08 0.00 0.00 0.00 0.00 19.45 17.81 1wnb n ALA 36 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1wnb s SER 37 N 0.38 4.63 0.33 0.00 1.04 -1.26 -4.45 113.70 114.37 1wnb s SER 37 Ca 0.72 0.90 0.02 0.00 0.48 0.00 0.00 55.95 58.06 1wnb s SER 37 Cb -0.70 -1.48 0.58 0.00 0.10 0.00 0.00 66.02 64.53 1wnb s SER 37 CO 0.48 -1.84 1.96 0.00 0.98 0.00 0.00 173.24 174.82 1wnb h ALA 38 N -1.00 1.46 -0.53 5.32 0.00 -1.95 -2.04 119.26 120.52 1wnb h ALA 38 Ca -0.46 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.37 1wnb h ALA 38 Cb 1.31 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.83 1wnb h ALA 38 CO 0.65 0.45 0.34 0.93 0.00 0.00 0.00 179.25 181.62 1wnb h GLU 39 N 0.81 0.67 -0.75 0.00 5.08 -2.00 -2.43 114.58 115.97 1wnb h GLU 39 Ca 0.21 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.50 1wnb h GLU 39 Cb 0.02 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.09 1wnb h GLU 39 CO -0.03 0.44 0.35 1.96 -1.00 0.00 0.00 179.01 180.73 1wnb h GLN 40 N 0.69 1.08 -0.15 2.33 4.20 -1.76 -0.67 115.11 120.84 1wnb h GLN 40 Ca 0.20 -0.17 0.03 0.00 0.06 0.00 0.00 58.65 58.78 1wnb h GLN 40 Cb -0.05 -0.19 -0.03 0.00 0.30 0.00 0.00 27.48 27.51 1wnb h GLN 40 CO -0.06 0.85 -0.05 0.28 -0.67 0.00 0.00 178.83 179.18 1wnb h VAL 41 N 1.05 0.83 -0.14 -0.54 2.07 -1.34 0.19 116.25 118.37 1wnb h VAL 41 Ca 0.26 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.78 1wnb h VAL 41 Cb 0.13 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 30.72 1wnb h VAL 41 CO -0.03 0.00 0.10 -0.78 0.02 0.00 0.00 177.57 176.87 1wnb h ASP 42 N -0.02 0.16 -0.99 0.57 3.58 -1.19 -2.08 116.42 116.46 1wnb h ASP 42 Ca 0.07 -0.00 0.07 0.00 0.42 0.00 0.00 57.03 57.59 1wnb h ASP 42 Cb 0.13 -0.04 -0.07 0.00 1.72 0.00 0.00 39.33 41.07 1wnb h ASP 42 CO -0.16 0.12 0.63 0.00 -2.88 0.00 0.00 179.24 176.95 1wnb h ALA 43 N 1.05 1.37 -0.18 -0.78 0.00 -0.87 0.10 119.26 119.96 1wnb h ALA 43 Ca 0.05 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.77 1wnb h ALA 43 Cb -0.02 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.47 1wnb h ALA 43 CO -0.01 0.41 -0.60 0.00 0.00 0.00 0.00 179.25 179.05 1wnb h ALA 44 N 1.45 0.61 -0.56 0.00 0.00 -0.17 -1.73 119.26 118.87 1wnb h ALA 44 Ca 0.43 -0.54 -0.09 0.00 0.00 0.00 0.00 54.91 54.71 1wnb h ALA 44 Cb 0.18 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1wnb h ALA 44 CO -0.18 0.70 -0.02 0.28 0.00 0.00 0.00 179.25 180.04 1wnb h VAL 45 N 0.45 1.27 0.00 0.00 2.07 -0.98 -2.10 116.25 116.95 1wnb h VAL 45 Ca -0.00 -1.15 -0.09 0.00 0.82 0.00 0.00 66.70 66.28 1wnb h VAL 45 Cb 1.17 0.88 -0.01 0.00 -1.52 0.00 0.00 31.29 31.80 1wnb h VAL 45 CO 0.11 0.41 -0.43 0.03 0.02 0.00 0.00 177.57 177.72 1wnb h ARG 46 N 0.89 0.00 -0.27 1.57 3.08 -0.89 -1.26 114.38 117.51 1wnb h ARG 46 Ca 0.16 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 60.07 1wnb h ARG 46 Cb 0.57 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.61 1wnb h ARG 46 CO 0.03 0.43 -0.41 0.00 -1.07 0.00 0.00 179.97 178.95 1wnb h ALA 47 N 1.57 0.77 -0.17 0.04 0.00 -1.07 -1.81 119.26 118.60 1wnb h ALA 47 Ca -0.00 -0.45 -0.22 0.00 0.00 0.00 0.00 54.91 54.24 1wnb h ALA 47 Cb 0.84 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.53 1wnb h ALA 47 CO 0.06 0.66 -0.74 0.00 0.00 0.00 0.00 179.25 179.22 1wnb h ALA 48 N 1.01 0.35 -0.41 0.00 0.00 -1.08 0.11 119.26 119.23 1wnb h ALA 48 Ca 0.04 -0.59 -0.03 0.00 0.00 0.00 0.00 54.91 54.33 1wnb h ALA 48 Cb 0.94 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 1wnb h ALA 48 CO 0.08 0.69 0.12 0.22 0.00 0.00 0.00 179.25 180.37 1wnb h ASP 49 N 0.55 0.61 -0.47 0.00 3.58 -1.25 -0.50 116.42 118.94 1wnb h ASP 49 Ca -0.04 -0.21 -0.02 0.00 0.42 0.00 0.00 57.03 57.18 1wnb h ASP 49 Cb 1.37 -0.16 -0.02 0.00 1.72 0.00 0.00 39.33 42.24 1wnb h ASP 49 CO 0.15 0.66 0.23 0.00 -2.88 0.00 0.00 179.24 177.40 1wnb h ALA 50 N 0.97 0.60 0.00 -0.78 0.00 -1.29 -2.78 119.26 115.99 1wnb h ALA 50 Ca 0.13 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 1wnb h ALA 50 Cb 0.27 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1wnb h ALA 50 CO -0.00 0.15 -0.33 0.00 0.00 0.00 0.00 179.25 179.07 1wnb h ALA 51 N 1.07 1.39 -0.46 0.00 0.00 -0.60 -3.10 119.26 117.56 1wnb h ALA 51 Ca 0.16 -0.30 0.12 0.00 0.00 0.00 0.00 54.91 54.89 1wnb h ALA 51 Cb 0.10 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1wnb h ALA 51 CO -0.02 0.42 0.33 0.35 0.00 0.00 0.00 179.25 180.32 1wnb h PHE 52 N 0.00 0.09 -0.44 0.00 3.57 -0.79 -1.25 116.94 118.13 1wnb h PHE 52 Ca -0.00 0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.57 1wnb h PHE 52 Cb 0.61 -0.03 -0.06 0.00 2.79 0.00 0.00 35.95 39.26 1wnb h PHE 52 CO 0.00 0.04 0.07 0.00 -2.23 0.00 0.00 178.31 176.19 1wnb h ALA 53 N 1.77 0.46 0.02 2.41 0.00 -1.63 -0.92 119.26 121.37 1wnb h ALA 53 Ca 0.22 0.10 -0.06 0.00 0.00 0.00 0.00 54.91 55.17 1wnb h ALA 53 Cb 0.76 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.68 1wnb h ALA 53 CO -0.02 -0.33 -0.27 0.93 0.00 0.00 0.00 179.25 179.56 1wnb h GLU 54 N 0.20 0.05 -0.53 0.00 5.08 -1.74 -3.39 114.58 114.24 1wnb h GLU 54 Ca 0.21 -0.08 0.06 0.00 -1.00 0.00 0.00 59.36 58.55 1wnb h GLU 54 Cb 0.28 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.53 1wnb h GLU 54 CO -0.30 1.04 0.35 2.35 -1.00 0.00 0.00 179.01 181.46 1wnb h TRP 55 N -0.90 0.49 0.00 4.33 2.91 -1.13 -0.85 115.95 120.80 1wnb h TRP 55 Ca -0.06 0.01 0.00 0.00 1.13 0.00 0.00 58.89 59.97 1wnb h TRP 55 Cb 1.14 -0.16 0.00 0.00 -0.51 0.00 0.00 29.16 29.63 1wnb h TRP 55 CO 0.25 0.27 0.00 0.41 -1.03 0.00 0.00 178.44 178.33 1wnb n GLY 56 N -1.50 -1.35 0.88 2.65 0.00 -0.36 -2.33 105.19 103.19 1wnb n GLY 56 Ca 0.07 -0.10 0.08 0.00 0.00 0.00 0.00 46.02 46.07 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 -1.45 2.48 -1.97 1.61 6.02 -0.34 -4.78 117.38 118.96 1wnb n GLN 57 Ca 0.08 -2.13 -0.35 0.00 -0.01 0.00 0.00 57.00 54.58 1wnb n GLN 57 Cb 0.29 -1.38 0.04 0.00 1.02 0.00 0.00 30.24 30.20 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 -1.08 2.77 0.59 5.09 -4.23 -0.98 -5.03 115.64 112.77 1wnb s THR 58 Ca 0.31 0.45 -0.18 0.00 -1.18 0.00 0.00 61.69 61.10 1wnb s THR 58 Cb 0.17 -3.13 -0.04 0.00 1.34 0.00 0.00 72.50 70.85 1wnb s THR 58 CO 0.23 -0.13 1.12 0.42 -0.54 0.00 0.00 174.62 175.71 1wnb s THR 59 N -1.76 3.24 0.28 3.99 -4.23 -1.26 -4.94 115.64 110.96 1wnb s THR 59 Ca 0.75 0.68 0.03 0.00 -1.18 0.00 0.00 61.69 61.97 1wnb s THR 59 Cb -0.28 -3.22 0.27 0.00 1.34 0.00 0.00 72.50 70.61 1wnb s THR 59 CO 0.34 -0.25 1.77 -0.65 -0.54 0.00 0.00 174.62 175.29 1wnb h PRO 60 N 0.73 0.68 -0.45 3.99 0.11 -1.94 -2.15 132.00 132.97 1wnb h PRO 60 Ca -0.49 -0.04 0.08 0.00 0.11 0.00 0.00 66.00 65.67 1wnb h PRO 60 Cb 1.25 -0.15 -0.07 0.00 0.11 0.00 0.00 31.00 32.14 1wnb h PRO 60 CO 0.56 0.45 0.02 -0.22 -0.21 0.00 0.00 178.00 178.60 1wnb h LYS 61 N 0.70 0.13 -0.30 1.05 3.64 -1.93 0.11 116.57 119.98 1wnb h LYS 61 Ca 0.52 -0.01 -0.14 0.00 -1.27 0.00 0.00 60.65 59.75 1wnb h LYS 61 Cb 0.78 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.56 1wnb h LYS 61 CO -0.37 0.09 -0.39 0.28 -2.27 0.00 0.00 179.45 176.79 1wnb h VAL 62 N 0.14 1.29 -0.15 2.00 2.07 -1.79 -1.35 116.25 118.46 1wnb h VAL 62 Ca 0.23 -1.56 -0.05 0.00 0.82 0.00 0.00 66.70 66.14 1wnb h VAL 62 Cb 0.32 1.47 -0.00 0.00 -1.52 0.00 0.00 31.29 31.56 1wnb h VAL 62 CO -0.36 0.50 -0.09 0.03 0.02 0.00 0.00 177.57 177.68 1wnb h ARG 63 N 0.58 0.32 -0.67 1.57 3.08 -1.11 -1.44 114.38 116.70 1wnb h ARG 63 Ca 0.05 -0.15 0.13 0.00 0.07 0.00 0.00 59.98 60.09 1wnb h ARG 63 Cb 0.92 -0.01 -0.13 0.00 0.08 0.00 0.00 29.97 30.84 1wnb h ARG 63 CO 0.08 0.66 -0.16 0.00 -1.07 0.00 0.00 179.97 179.48 1wnb h ALA 64 N 0.65 0.45 -0.39 0.04 0.00 -0.69 -0.17 119.26 119.15 1wnb h ALA 64 Ca 0.03 0.26 -0.07 0.00 0.00 0.00 0.00 54.91 55.13 1wnb h ALA 64 Cb 0.57 0.51 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 1wnb h ALA 64 CO 0.02 -0.42 -0.02 0.93 0.00 0.00 0.00 179.25 179.76 1wnb h GLU 65 N 0.00 0.71 -0.79 0.00 5.08 -0.92 -0.33 114.58 118.34 1wnb h GLU 65 Ca 0.32 -0.24 0.12 0.00 -1.00 0.00 0.00 59.36 58.57 1wnb h GLU 65 Cb 0.49 -0.06 -0.09 0.00 0.50 0.00 0.00 28.75 29.60 1wnb h GLU 65 CO -0.69 0.81 0.39 0.00 -1.00 0.00 0.00 179.01 178.52 1wnb h LEU 67 N 0.59 0.86 -0.98 0.00 3.38 0.02 -1.87 115.31 117.33 1wnb h LEU 67 Ca 0.41 -0.42 -0.07 0.00 0.09 0.00 0.00 57.88 57.89 1wnb h LEU 67 Cb 0.54 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 1wnb h LEU 67 CO -0.33 1.19 -0.01 -0.07 0.09 0.00 0.00 178.44 179.31 1wnb h LEU 68 N 0.63 0.70 -0.73 1.67 3.38 -1.02 -0.27 115.31 119.67 1wnb h LEU 68 Ca 0.04 -0.16 -0.14 0.00 0.09 0.00 0.00 57.88 57.71 1wnb h LEU 68 Cb 1.04 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.59 1wnb h LEU 68 CO 0.10 0.77 -0.58 0.11 0.09 0.00 0.00 178.44 178.94 1wnb h LYS 69 N 0.69 0.18 -0.26 1.13 1.57 -1.34 -0.59 116.57 117.95 1wnb h LYS 69 Ca 0.14 -0.12 -0.05 0.00 -1.87 0.00 0.00 60.65 58.75 1wnb h LYS 69 Cb 0.44 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.75 1wnb h LYS 69 CO 0.02 0.71 -0.03 1.25 -0.57 0.00 0.00 179.45 180.83 1wnb h LEU 70 N 0.14 0.47 -0.34 2.94 5.85 -1.12 -2.40 115.31 120.85 1wnb h LEU 70 Ca -0.00 -0.33 0.06 0.00 0.84 0.00 0.00 57.88 58.44 1wnb h LEU 70 Cb 1.06 -0.13 -0.06 0.00 0.37 0.00 0.00 40.66 41.91 1wnb h LEU 70 CO 0.09 0.69 -0.02 0.00 -0.34 0.00 0.00 178.44 178.86 1wnb h ALA 71 N 0.79 0.29 -0.72 1.25 0.00 -0.79 -1.99 119.26 118.09 1wnb h ALA 71 Ca 0.07 0.10 0.14 0.00 0.00 0.00 0.00 54.91 55.23 1wnb h ALA 71 Cb 0.47 0.18 -0.10 0.00 0.00 0.00 0.00 17.79 18.34 1wnb h ALA 71 CO 0.02 -0.41 0.24 -0.44 0.00 0.00 0.00 179.25 178.65 1wnb h ASP 72 N 0.08 0.16 -0.30 0.00 3.32 -0.99 -1.29 116.42 117.39 1wnb h ASP 72 Ca 0.16 0.12 -0.05 0.00 0.02 0.00 0.00 57.03 57.28 1wnb h ASP 72 Cb 0.23 0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.90 1wnb h ASP 72 CO -0.29 0.05 -0.01 0.58 -1.72 0.00 0.00 179.24 177.85 1wnb h VAL 73 N 0.36 1.26 -0.16 -1.35 2.07 -1.01 0.57 116.25 117.99 1wnb h VAL 73 Ca 0.40 -0.97 0.01 0.00 0.82 0.00 0.00 66.70 66.96 1wnb h VAL 73 Cb 0.63 1.29 -0.02 0.00 -1.52 0.00 0.00 31.29 31.68 1wnb h VAL 73 CO -0.43 0.31 0.06 0.40 0.02 0.00 0.00 177.57 177.93 1wnb h ILE 74 N 0.34 0.97 -0.85 4.57 2.04 -1.16 -1.40 117.51 122.01 1wnb h ILE 74 Ca 0.08 -0.05 0.07 0.00 1.00 0.00 0.00 64.86 65.97 1wnb h ILE 74 Cb 0.46 0.82 -0.07 0.00 -0.74 0.00 0.00 36.82 37.29 1wnb h ILE 74 CO 0.02 0.02 0.52 -0.08 0.00 0.00 0.00 178.15 178.63 1wnb h GLU 75 N 0.13 0.89 0.00 2.37 4.81 -0.99 -0.03 114.58 121.76 1wnb h GLU 75 Ca 0.07 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.18 1wnb h GLU 75 Cb 0.04 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.21 1wnb h GLU 75 CO -0.07 0.59 -0.29 0.93 -0.73 0.00 0.00 179.01 179.44 1wnb h GLU 76 N 0.91 0.00 -0.68 1.92 5.08 -0.59 -2.41 114.58 118.81 1wnb h GLU 76 Ca 0.39 0.00 -0.37 0.00 -1.00 0.00 0.00 59.36 58.37 1wnb h GLU 76 Cb 0.25 0.00 -0.22 0.00 0.50 0.00 0.00 28.75 29.28 1wnb h GLU 76 CO -0.20 0.29 0.26 0.09 -1.00 0.00 0.00 179.01 178.44 1wnb n ASN 77 N -3.95 3.49 0.03 1.42 4.13 -0.12 -4.80 115.26 115.46 1wnb n ASN 77 Ca -0.02 -3.72 -0.12 0.00 1.68 0.00 0.00 54.58 52.40 1wnb n ASN 77 Cb 0.36 -0.73 -0.06 0.00 -1.54 0.00 0.00 39.78 37.80 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 1.13 0.05 0.60 7.41 0.00 -0.77 -1.54 103.07 109.95 1wnb h GLY 78 Ca 0.43 -0.02 0.02 0.00 0.00 0.00 0.00 47.33 47.76 1wnb h GLY 78 CO 0.79 0.02 -0.19 -1.61 0.00 0.00 0.00 176.54 175.55 1wnb h GLN 79 N 0.05 -0.32 -0.23 4.80 5.75 -1.87 0.31 115.11 123.60 1wnb h GLN 79 Ca 0.01 0.02 -0.00 0.00 -0.15 0.00 0.00 58.65 58.53 1wnb h GLN 79 Cb -0.01 0.07 -0.01 0.00 1.07 0.00 0.00 27.48 28.61 1wnb h GLN 79 CO -0.00 -0.21 0.12 0.28 -2.65 0.00 0.00 178.83 176.37 1wnb h VAL 80 N -0.33 1.11 -0.52 2.39 2.07 -1.89 -0.80 116.25 118.27 1wnb h VAL 80 Ca 0.04 -0.30 0.04 0.00 0.82 0.00 0.00 66.70 67.30 1wnb h VAL 80 Cb 0.38 0.90 -0.04 0.00 -1.52 0.00 0.00 31.29 31.02 1wnb h VAL 80 CO -0.15 0.11 0.28 -0.26 0.02 0.00 0.00 177.57 177.58 1wnb h PHE 81 N 0.26 0.53 -0.55 1.57 0.04 -1.02 -1.71 116.94 116.06 1wnb h PHE 81 Ca 0.08 0.02 0.01 0.00 2.80 0.00 0.00 57.97 60.88 1wnb h PHE 81 Cb 0.07 -0.16 -0.03 0.00 2.20 0.00 0.00 35.95 38.03 1wnb h PHE 81 CO -0.04 0.27 0.36 0.00 -0.60 0.00 0.00 178.31 178.30 1wnb h ALA 82 N 1.26 0.71 -0.50 2.45 0.00 -0.64 -1.22 119.26 121.31 1wnb h ALA 82 Ca 0.22 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1wnb h ALA 82 Cb 0.09 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1wnb h ALA 82 CO -0.13 0.11 0.29 0.93 0.00 0.00 0.00 179.25 180.44 1wnb h GLU 83 N 0.72 0.69 -0.17 0.00 5.08 -0.67 0.11 114.58 120.34 1wnb h GLU 83 Ca 0.21 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.48 1wnb h GLU 83 Cb -0.05 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.06 1wnb h GLU 83 CO -0.06 0.52 0.04 -0.07 -1.00 0.00 0.00 179.01 178.44 1wnb h LEU 84 N 0.67 0.26 -0.59 1.33 3.38 -1.17 0.21 115.31 119.40 1wnb h LEU 84 Ca 0.18 -0.24 0.02 0.00 0.09 0.00 0.00 57.88 57.92 1wnb h LEU 84 Cb 0.02 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.67 1wnb h LEU 84 CO -0.03 0.44 0.38 -0.08 0.09 0.00 0.00 178.44 179.23 1wnb h GLU 85 N 0.08 0.73 -0.17 1.13 4.57 -1.08 0.34 114.58 120.18 1wnb h GLU 85 Ca 0.05 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.19 1wnb h GLU 85 Cb 0.28 -0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 28.70 1wnb h GLU 85 CO 0.00 0.49 0.11 1.03 -1.18 0.00 0.00 179.01 179.46 1wnb h SER 86 N 0.76 0.20 -0.55 1.04 0.87 -0.63 0.70 113.55 115.94 1wnb h SER 86 Ca 0.23 -0.01 0.01 0.00 -1.23 0.00 0.00 61.79 60.78 1wnb h SER 86 Cb -0.03 -0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 61.85 1wnb h SER 86 CO -0.07 0.15 0.36 0.03 -0.53 0.00 0.00 176.83 176.77 1wnb h ARG 87 N 0.23 0.70 0.00 2.24 3.08 -0.26 0.31 114.38 120.69 1wnb h ARG 87 Ca 0.06 -0.04 -0.14 0.00 0.07 0.00 0.00 59.98 59.93 1wnb h ARG 87 Cb -0.02 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 29.86 1wnb h ARG 87 CO -0.01 0.47 -0.72 -0.97 -1.07 0.00 0.00 179.97 177.67 1wnb h ASN 88 N 0.73 0.00 -0.00 7.04 -0.73 -0.87 -3.39 115.58 118.36 1wnb h ASN 88 Ca 0.21 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.38 1wnb h ASN 88 Cb -0.06 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.53 1wnb h ASN 88 CO -0.05 0.62 -0.05 0.00 -0.37 0.00 0.00 177.43 177.57 1wnb n GLY 90 N 0.56 0.57 3.74 0.00 0.00 0.10 -4.76 105.19 105.38 1wnb n GLY 90 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 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 -1.91 2.57 -1.74 1.61 5.02 -1.25 -4.17 118.16 118.28 1wnb n LYS 91 Ca 0.00 0.91 -0.42 0.00 -2.02 0.00 0.00 58.31 56.78 1wnb n LYS 91 Cb 0.03 -2.64 -0.02 0.00 -0.02 0.00 0.00 35.03 32.38 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 1.55 2.75 -0.18 1.97 -0.02 -1.26 -4.53 135.00 135.28 1wnb n PRO 92 Ca 0.07 0.98 -0.01 0.00 -2.02 0.00 0.00 63.50 62.52 1wnb n PRO 92 Cb 0.37 -2.79 0.09 0.00 -0.02 0.00 0.00 33.50 31.15 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 5.28 0.11 -0.81 2.45 5.85 -0.79 -1.87 115.31 125.54 1wnb h LEU 93 Ca -0.46 0.08 0.06 0.00 0.84 0.00 0.00 57.88 58.41 1wnb h LEU 93 Cb 1.22 0.09 -0.06 0.00 0.37 0.00 0.00 40.66 42.27 1wnb h LEU 93 CO 0.83 0.08 0.49 1.12 -0.34 0.00 0.00 178.44 180.63 1wnb h HIS 94 N 0.32 0.91 -0.50 1.25 2.07 -1.90 0.78 115.15 118.09 1wnb h HIS 94 Ca 0.28 0.03 -0.07 0.00 -2.85 0.00 0.00 60.37 57.76 1wnb h HIS 94 Cb 0.36 -0.29 -0.02 0.00 2.57 0.00 0.00 27.41 30.03 1wnb h HIS 94 CO -0.20 0.45 0.04 0.77 -3.07 0.00 0.00 177.93 175.92 1wnb h SER 95 N 0.89 0.83 -0.25 3.10 0.02 -1.74 0.17 113.55 116.56 1wnb h SER 95 Ca 0.36 -0.28 -0.06 0.00 -0.84 0.00 0.00 61.79 60.97 1wnb h SER 95 Cb 0.19 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.51 1wnb h SER 95 CO -0.18 0.91 -0.07 0.00 -1.14 0.00 0.00 176.83 176.34 1wnb h ALA 96 N 0.95 0.35 -0.05 3.77 0.00 -0.60 0.46 119.26 124.14 1wnb h ALA 96 Ca 0.15 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 1wnb h ALA 96 Cb 0.46 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 1wnb h ALA 96 CO 0.02 0.17 0.00 0.35 0.00 0.00 0.00 179.25 179.79 1wnb h PHE 97 N 0.24 0.09 0.00 0.00 3.57 -0.82 -2.27 116.94 117.75 1wnb h PHE 97 Ca 0.06 -0.01 -0.24 0.00 3.53 0.00 0.00 57.97 61.31 1wnb h PHE 97 Cb 0.55 -0.02 -0.04 0.00 2.79 0.00 0.00 35.95 39.23 1wnb h PHE 97 CO 0.05 0.34 -1.29 -0.91 -2.23 0.00 0.00 178.31 174.27 1wnb h ASN 98 N -0.18 0.00 0.00 0.41 2.35 -0.67 -3.32 115.58 114.16 1wnb h ASN 98 Ca 0.01 0.00 -0.34 0.00 -0.55 0.00 0.00 56.30 55.43 1wnb h ASN 98 Cb 0.30 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.62 1wnb h ASN 98 CO 0.00 1.00 -2.02 0.47 -1.65 0.00 0.00 177.43 175.23 1wnb n ASP 99 N -3.22 1.93 -0.04 5.81 8.00 0.14 -4.66 116.55 124.52 1wnb n ASP 99 Ca -0.07 0.36 -0.11 0.00 0.71 0.00 0.00 54.79 55.68 1wnb n ASP 99 Cb 0.98 -0.83 -0.10 0.00 -0.02 0.00 0.00 41.12 41.16 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 -1.00 -0.03 -0.36 -1.24 5.08 -1.37 -3.28 114.58 112.37 1wnb h GLU 100 Ca -0.51 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 57.92 1wnb h GLU 100 Cb 1.42 0.01 -0.09 0.00 0.50 0.00 0.00 28.75 30.60 1wnb h GLU 100 CO -0.31 0.66 -0.43 0.82 -1.00 0.00 0.00 179.01 178.75 1wnb h ILE 101 N -0.93 0.12 -0.70 3.13 1.08 -1.52 -0.97 117.51 117.71 1wnb h ILE 101 Ca -0.00 0.00 0.14 0.00 -0.39 0.00 0.00 64.86 64.60 1wnb h ILE 101 Cb 0.71 0.12 -0.04 0.00 -3.07 0.00 0.00 36.82 34.53 1wnb h ILE 101 CO 0.01 0.00 0.47 -0.65 -0.69 0.00 0.00 178.15 177.29 1wnb h PRO 102 N -0.35 0.38 -0.16 2.37 0.11 -1.76 -0.42 132.00 132.16 1wnb h PRO 102 Ca 0.13 -0.02 -0.20 0.00 0.11 0.00 0.00 66.00 66.02 1wnb h PRO 102 Cb 0.59 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.62 1wnb h PRO 102 CO -0.54 0.25 -0.69 0.00 -0.21 0.00 0.00 178.00 176.81 1wnb h ALA 103 N 1.66 0.48 -0.31 -0.75 0.00 -1.45 -1.77 119.26 117.13 1wnb h ALA 103 Ca 0.34 -0.57 -0.11 0.00 0.00 0.00 0.00 54.91 54.57 1wnb h ALA 103 Cb 0.79 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1wnb h ALA 103 CO -0.10 0.71 -0.24 0.82 0.00 0.00 0.00 179.25 180.43 1wnb h ILE 104 N 0.47 1.30 -0.42 0.00 2.04 -0.42 0.13 117.51 120.61 1wnb h ILE 104 Ca -0.02 -1.39 0.00 0.00 1.00 0.00 0.00 64.86 64.44 1wnb h ILE 104 Cb 1.28 1.51 -0.02 0.00 -0.74 0.00 0.00 36.82 38.85 1wnb h ILE 104 CO 0.13 0.45 0.27 0.58 0.00 0.00 0.00 178.15 179.58 1wnb h VAL 105 N 0.47 1.12 -0.49 1.67 2.07 -1.08 -2.96 116.25 117.04 1wnb h VAL 105 Ca 0.06 -0.24 -0.09 0.00 0.82 0.00 0.00 66.70 67.25 1wnb h VAL 105 Cb 0.80 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 31.08 1wnb h VAL 105 CO 0.06 0.12 -0.04 -0.78 0.02 0.00 0.00 177.57 176.95 1wnb h ASP 106 N 0.56 0.83 -0.67 0.57 1.82 -1.09 -2.14 116.42 116.31 1wnb h ASP 106 Ca 0.15 -0.22 0.13 0.00 -0.39 0.00 0.00 57.03 56.70 1wnb h ASP 106 Cb -0.04 -0.22 -0.09 0.00 0.68 0.00 0.00 39.33 39.66 1wnb h ASP 106 CO -0.03 0.91 0.19 0.58 -1.61 0.00 0.00 179.24 179.28 1wnb h VAL 107 N 0.78 0.62 -0.22 2.25 2.07 -0.80 0.23 116.25 121.19 1wnb h VAL 107 Ca 0.14 -0.11 -0.18 0.00 0.82 0.00 0.00 66.70 67.38 1wnb h VAL 107 Cb 0.52 0.28 -0.00 0.00 -1.52 0.00 0.00 31.29 30.57 1wnb h VAL 107 CO 0.03 0.06 -0.58 -0.26 0.02 0.00 0.00 177.57 176.84 1wnb h PHE 108 N 0.32 0.87 -0.72 1.57 -1.00 -1.36 -1.89 116.94 114.72 1wnb h PHE 108 Ca 0.36 -0.32 -0.05 0.00 2.81 0.00 0.00 57.97 60.78 1wnb h PHE 108 Cb 0.55 -0.16 -0.03 0.00 3.61 0.00 0.00 35.95 39.92 1wnb h PHE 108 CO -0.23 1.10 0.26 0.00 -1.61 0.00 0.00 178.31 177.83 1wnb h ARG 109 N 0.52 1.09 -0.29 1.51 3.08 -0.87 -1.67 114.38 117.74 1wnb h ARG 109 Ca 0.00 -0.21 -0.08 0.00 0.07 0.00 0.00 59.98 59.77 1wnb h ARG 109 Cb 1.15 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 31.02 1wnb h ARG 109 CO 0.12 0.91 -0.13 0.35 -1.07 0.00 0.00 179.97 180.15 1wnb h PHE 110 N 1.06 0.69 0.00 3.04 3.57 -0.39 -2.76 116.94 122.15 1wnb h PHE 110 Ca 0.24 -0.17 -0.11 0.00 3.53 0.00 0.00 57.97 61.46 1wnb h PHE 110 Cb 0.25 -0.16 -0.02 0.00 2.79 0.00 0.00 35.95 38.81 1wnb h PHE 110 CO 0.02 0.83 -0.51 0.74 -2.23 0.00 0.00 178.31 177.15 1wnb h PHE 111 N 0.35 0.00 -0.34 0.41 -1.00 -1.31 -1.35 116.94 113.70 1wnb h PHE 111 Ca 0.07 0.00 0.06 0.00 2.81 0.00 0.00 57.97 60.91 1wnb h PHE 111 Cb 0.64 0.00 -0.05 0.00 3.61 0.00 0.00 35.95 40.15 1wnb h PHE 111 CO 0.06 0.51 -0.00 0.00 -1.61 0.00 0.00 178.31 177.27 1wnb h ALA 112 N 1.49 0.30 -0.24 2.45 0.00 -1.14 -0.96 119.26 121.15 1wnb h ALA 112 Ca -0.01 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1wnb h ALA 112 Cb 1.05 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 1wnb h ALA 112 CO 0.07 -0.40 0.10 0.78 0.00 0.00 0.00 179.25 179.80 1wnb h GLY 113 N 0.09 0.38 1.86 0.00 0.00 -1.23 -3.25 103.07 100.92 1wnb h GLY 113 Ca 0.16 -0.20 -0.07 0.00 0.00 0.00 0.00 47.33 47.23 1wnb h GLY 113 CO -0.27 0.19 -0.25 0.00 0.00 0.00 0.00 176.54 176.20 1wnb h ALA 114 N 0.95 1.40 -0.62 3.60 0.00 -1.03 -2.05 119.26 121.51 1wnb h ALA 114 Ca 0.08 -0.28 0.18 0.00 0.00 0.00 0.00 54.91 54.89 1wnb h ALA 114 Cb 0.16 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1wnb h ALA 114 CO -0.01 0.42 0.56 0.00 0.00 0.00 0.00 179.25 180.23 1wnb h ALA 115 N 1.59 2.44 -0.07 0.00 0.00 -1.21 -1.72 119.26 120.30 1wnb h ALA 115 Ca 0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1wnb h ALA 115 Cb 0.54 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1wnb h ALA 115 CO 0.04 -0.88 0.00 0.54 0.00 0.00 0.00 179.25 178.94 1wnb n ARG 116 N -3.89 2.28 -0.61 0.00 1.74 -0.77 -4.57 116.66 110.85 1wnb n ARG 116 Ca 0.12 -1.87 0.06 0.00 -0.77 0.00 0.00 57.85 55.39 1wnb n ARG 116 Cb 0.80 -1.47 0.18 0.00 -1.02 0.00 0.00 32.46 30.95 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 -2.86 4.42 0.93 0.00 1.43 -1.25 -5.03 118.68 116.32 1wnb s LEU 118 Ca 0.36 1.70 -0.13 0.00 -1.03 0.00 0.00 54.13 55.04 1wnb s LEU 118 Cb 0.35 -3.57 0.15 0.00 0.03 0.00 0.00 46.19 43.15 1wnb s LEU 118 CO -0.06 -0.19 1.14 0.20 0.23 0.00 0.00 176.35 177.67 1wnb s ASN 119 N 0.65 3.31 0.00 2.29 0.01 -1.26 -5.08 114.94 114.85 1wnb s ASN 119 Ca 0.50 0.93 0.00 0.00 -0.71 0.00 0.00 52.86 53.58 1wnb s ASN 119 Cb -0.22 -1.47 0.00 0.00 0.41 0.00 0.00 41.25 39.97 1wnb s ASN 119 CO 0.29 -2.67 0.00 0.61 -1.51 0.00 0.00 177.10 173.81 1wnb n GLY 120 N -2.15 2.15 3.67 0.66 0.00 -1.26 -4.95 105.19 103.31 1wnb n GLY 120 Ca 0.07 -0.87 -0.33 0.00 0.00 0.00 0.00 46.02 44.89 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 3.49 0.01 0.99 1.43 -1.26 -5.07 118.68 118.26 1wnb s LEU 121 Ca 0.00 0.02 -0.38 0.00 -1.03 0.00 0.00 54.13 52.74 1wnb s LEU 121 Cb 0.00 -1.94 -0.17 0.00 0.03 0.00 0.00 46.19 44.11 1wnb s LEU 121 CO 0.00 0.31 1.39 0.00 0.23 0.00 0.00 176.35 178.27 1wnb n ALA 122 N 1.62 -1.10 -1.78 4.21 0.00 -1.26 -4.55 120.51 117.65 1wnb n ALA 122 Ca -0.16 0.50 -0.35 0.00 0.00 0.00 0.00 53.44 53.43 1wnb n ALA 122 Cb 0.53 -2.07 -0.02 0.00 0.00 0.00 0.00 19.45 17.89 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 0.99 2.88 0.00 0.00 0.00 -1.26 -4.91 121.76 119.47 1wnb s ALA 123 Ca 0.88 0.75 0.00 0.00 0.00 0.00 0.00 51.96 53.59 1wnb s ALA 123 Cb -1.01 -3.31 0.00 0.00 0.00 0.00 0.00 23.12 18.79 1wnb s ALA 123 CO 0.51 -0.49 0.00 0.41 0.00 0.00 0.00 175.76 176.19 1wnb n GLY 124 N 0.12 -1.43 3.25 0.00 0.00 -0.42 -4.96 105.19 101.74 1wnb n GLY 124 Ca 0.09 -1.01 -0.43 0.00 0.00 0.00 0.00 46.02 44.67 1wnb n GLY 124 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wnb s GLU 125 N -1.09 3.34 0.41 1.61 8.01 -1.26 -0.03 118.70 129.68 1wnb s GLU 125 Ca 0.00 -2.59 0.26 0.00 0.01 0.00 0.00 54.97 52.65 1wnb s GLU 125 Cb 0.00 -4.21 0.74 0.00 -4.31 0.00 0.00 34.13 26.35 1wnb s GLU 125 CO 0.00 -1.25 1.74 1.88 0.01 0.00 0.00 175.26 177.64 1wnb h TYR 126 N 7.37 0.00 -3.30 1.61 -1.99 -1.93 -3.40 116.97 115.32 1wnb h TYR 126 Ca 0.08 0.00 -0.56 0.00 2.00 0.00 0.00 58.73 60.26 1wnb h TYR 126 Cb 0.99 0.00 -0.35 0.00 2.00 0.00 0.00 36.73 39.37 1wnb h TYR 126 CO 0.91 0.00 -0.82 -1.17 -0.00 0.00 0.00 178.16 177.07 1wnb s LEU 127 N -5.71 1.63 -0.10 3.88 2.96 -1.26 -5.10 118.68 114.97 1wnb s LEU 127 Ca 0.06 -0.37 -0.35 0.00 -0.22 0.00 0.00 54.13 53.25 1wnb s LEU 127 Cb 0.08 -0.98 -0.17 0.00 0.50 0.00 0.00 46.19 45.62 1wnb s LEU 127 CO 0.60 0.00 1.00 -0.62 -1.32 0.00 0.00 176.35 176.01 1wnb n GLU 128 N 4.18 0.00 -1.07 1.98 4.71 -1.26 -2.03 120.64 127.15 1wnb n GLU 128 Ca -0.19 0.00 -0.02 0.00 -0.01 0.00 0.00 57.16 56.93 1wnb n GLU 128 Cb 0.51 -1.25 -0.01 0.00 -1.01 0.00 0.00 31.44 29.68 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 1.76 0.58 2.83 0.62 0.00 -1.26 -5.01 105.19 104.70 1wnb n GLY 129 Ca 0.19 -0.46 -0.16 0.00 0.00 0.00 0.00 46.02 45.59 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 -1.99 -0.11 -0.32 1.61 3.76 -0.86 -0.25 115.29 117.14 1wnb s HIS 130 Ca 0.00 0.45 -0.14 0.00 -0.15 0.00 0.00 55.06 55.22 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 -0.20 0.32 0.99 -0.85 0.00 0.00 174.74 174.99 1wnb s THR 131 N 1.77 5.21 -0.09 1.30 2.01 -0.46 -4.00 115.64 121.38 1wnb s THR 131 Ca -0.02 0.11 -0.05 0.00 0.31 0.00 0.00 61.69 62.04 1wnb s THR 131 Cb -0.12 -3.74 -0.04 0.00 0.01 0.00 0.00 72.50 68.61 1wnb s THR 131 CO -0.05 0.02 0.10 -0.44 -0.69 0.00 0.00 174.62 173.56 1wnb s SER 132 N 1.72 6.02 0.22 3.53 0.01 0.96 -0.63 113.70 125.53 1wnb s SER 132 Ca 0.11 0.34 0.06 0.00 1.31 0.00 0.00 55.95 57.77 1wnb s SER 132 Cb -0.16 -1.86 -0.05 0.00 0.21 0.00 0.00 66.02 64.15 1wnb s SER 132 CO 0.11 0.38 -0.10 0.00 0.41 0.00 0.00 173.24 174.04 1wnb s MET 133 N -1.14 1.36 -0.13 12.44 0.23 -0.35 -1.31 119.30 130.41 1wnb s MET 133 Ca 0.16 -1.64 0.03 0.00 -1.03 0.00 0.00 55.69 53.21 1wnb s MET 133 Cb -0.12 -1.01 0.01 0.00 -1.53 0.00 0.00 34.83 32.18 1wnb s MET 133 CO 0.06 0.09 -0.22 0.42 -2.03 0.00 0.00 175.02 173.34 1wnb s ILE 134 N -3.08 2.08 0.43 3.16 -1.09 -1.26 -1.72 121.20 119.71 1wnb s ILE 134 Ca 0.25 -0.99 0.07 0.00 -2.23 0.00 0.00 60.65 57.75 1wnb s ILE 134 Cb 0.02 -1.82 -0.04 0.00 -1.58 0.00 0.00 42.46 39.05 1wnb s ILE 134 CO 0.08 0.55 0.23 -0.13 -1.23 0.00 0.00 174.94 174.44 1wnb s ARG 135 N 0.67 2.28 -0.41 2.79 0.52 0.09 -4.80 118.95 120.09 1wnb s ARG 135 Ca -0.11 -1.83 0.02 0.00 -0.52 0.00 0.00 55.73 53.30 1wnb s ARG 135 Cb -0.16 -2.05 0.16 0.00 0.52 0.00 0.00 34.95 33.41 1wnb s ARG 135 CO 0.01 -0.19 0.29 1.03 0.02 0.00 0.00 175.30 176.47 1wnb s ARG 136 N -3.98 0.92 0.18 3.54 0.52 -1.26 -1.56 118.95 117.31 1wnb s ARG 136 Ca 0.40 -1.90 -0.01 0.00 -0.52 0.00 0.00 55.73 53.70 1wnb s ARG 136 Cb 0.02 -1.60 -0.04 0.00 0.52 0.00 0.00 34.95 33.84 1wnb s ARG 136 CO 0.23 -1.29 0.37 -0.51 0.02 0.00 0.00 175.30 174.12 1wnb s ASP 137 N 0.35 6.40 0.75 0.23 1.01 -0.72 -4.84 116.67 119.86 1wnb s ASP 137 Ca 0.26 0.41 -0.11 0.00 0.71 0.00 0.00 52.55 53.81 1wnb s ASP 137 Cb -0.09 -2.01 0.05 0.00 1.01 0.00 0.00 42.92 41.87 1wnb s ASP 137 CO -0.10 -0.01 1.10 -2.16 0.21 0.00 0.00 175.17 174.20 1wnb s PRO 138 N -3.17 2.33 0.01 8.23 0.05 -1.25 0.42 135.00 141.61 1wnb s PRO 138 Ca 0.38 1.22 -0.02 0.00 0.05 0.00 0.00 61.00 62.63 1wnb s PRO 138 Cb -0.11 -1.90 -0.27 0.00 0.05 0.00 0.00 34.50 32.26 1wnb s PRO 138 CO 0.28 -1.59 0.87 -0.07 0.05 0.00 0.00 177.00 176.54 1wnb h LEU 139 N -0.93 0.35 0.00 -3.56 3.38 -1.90 -3.43 115.31 109.22 1wnb h LEU 139 Ca -0.44 -0.49 0.00 0.00 0.09 0.00 0.00 57.88 57.04 1wnb h LEU 139 Cb 1.23 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1wnb h LEU 139 CO 0.52 1.41 0.00 0.61 0.09 0.00 0.00 178.44 181.07 1wnb n GLY 140 N 1.65 0.60 3.71 0.83 0.00 -1.26 -4.91 105.19 105.81 1wnb n GLY 140 Ca -0.16 -0.84 -0.39 0.00 0.00 0.00 0.00 46.02 44.64 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 5.12 -0.14 1.61 1.01 -1.26 -1.52 120.40 125.23 1wnb s VAL 141 Ca 0.00 1.15 0.02 0.00 0.00 0.00 0.00 61.98 63.14 1wnb s VAL 141 Cb 0.00 -3.91 0.00 0.00 0.00 0.00 0.00 36.38 32.47 1wnb s VAL 141 CO 0.00 0.28 -0.19 -0.69 0.00 0.00 0.00 175.10 174.50 1wnb s VAL 142 N 0.84 2.40 -0.16 2.92 1.01 -0.02 -1.04 120.40 126.35 1wnb s VAL 142 Ca 0.30 -0.87 -0.14 0.00 0.00 0.00 0.00 61.98 61.27 1wnb s VAL 142 Cb -0.16 -1.98 -0.05 0.00 0.00 0.00 0.00 36.38 34.19 1wnb s VAL 142 CO 0.13 0.53 0.29 0.00 0.00 0.00 0.00 175.10 176.05 1wnb s ALA 143 N 0.68 3.59 -0.12 5.51 0.00 -0.03 -1.25 121.76 130.15 1wnb s ALA 143 Ca -0.09 -0.47 0.02 0.00 0.00 0.00 0.00 51.96 51.43 1wnb s ALA 143 Cb -0.16 -2.39 0.01 0.00 0.00 0.00 0.00 23.12 20.58 1wnb s ALA 143 CO 0.02 0.07 -0.19 -1.12 0.00 0.00 0.00 175.76 174.54 1wnb s SER 144 N 0.50 2.74 -0.26 0.00 0.01 -0.42 -0.93 113.70 115.34 1wnb s SER 144 Ca 0.16 -0.50 -0.01 0.00 1.31 0.00 0.00 55.95 56.91 1wnb s SER 144 Cb -0.13 -1.25 0.04 0.00 0.21 0.00 0.00 66.02 64.89 1wnb s SER 144 CO 0.04 0.06 -0.07 -0.63 0.41 0.00 0.00 173.24 173.05 1wnb s ILE 145 N 0.82 2.70 0.06 1.44 -1.09 0.33 -0.21 121.20 125.26 1wnb s ILE 145 Ca -0.09 -1.23 0.01 0.00 -2.23 0.00 0.00 60.65 57.11 1wnb s ILE 145 Cb -0.16 -2.45 -0.04 0.00 -1.58 0.00 0.00 42.46 38.24 1wnb s ILE 145 CO -0.00 0.10 0.15 0.00 -1.23 0.00 0.00 174.94 173.96 1wnb s ALA 146 N 1.26 3.81 0.65 9.38 0.00 -0.57 -2.59 121.76 133.70 1wnb s ALA 146 Ca -0.03 -0.91 -0.02 0.00 0.00 0.00 0.00 51.96 51.00 1wnb s ALA 146 Cb -0.18 -1.66 0.06 0.00 0.00 0.00 0.00 23.12 21.34 1wnb s ALA 146 CO -0.04 0.79 0.91 -1.25 0.00 0.00 0.00 175.76 176.17 1wnb s PRO 147 N -2.40 2.22 0.05 0.00 0.04 -1.23 -1.66 135.00 132.02 1wnb s PRO 147 Ca 0.32 -0.64 0.26 0.00 0.04 0.00 0.00 61.00 60.98 1wnb s PRO 147 Cb -0.13 -2.33 0.73 0.00 0.04 0.00 0.00 34.50 32.82 1wnb s PRO 147 CO 0.25 -1.07 1.60 -2.67 0.04 0.00 0.00 177.00 175.14 1wnb n TRP 148 N -2.67 0.24 -0.04 0.56 4.27 -1.26 -4.16 117.44 114.38 1wnb n TRP 148 Ca 0.09 0.07 -0.15 0.00 -3.89 0.00 0.00 57.50 53.62 1wnb n TRP 148 Cb 0.60 -0.50 -0.08 0.00 -1.36 0.00 0.00 31.31 29.97 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 0.00 0.59 -2.56 -0.67 -1.07 -1.96 -3.38 115.58 106.53 1wnb h ASN 149 Ca 0.00 -0.61 -0.60 0.00 0.07 0.00 0.00 56.30 55.16 1wnb h ASN 149 Cb 0.58 -0.17 -0.39 0.00 -2.07 0.00 0.00 38.32 36.27 1wnb h ASN 149 CO 0.00 1.10 -0.85 -1.22 0.07 0.00 0.00 177.43 176.53 1wnb n TYR 150 N -4.29 0.59 0.39 4.14 4.01 -1.26 -5.04 117.16 115.70 1wnb n TYR 150 Ca -0.07 -3.67 -0.16 0.00 -0.16 0.00 0.00 57.90 53.84 1wnb n TYR 150 Cb 0.55 -0.08 -0.08 0.00 -0.31 0.00 0.00 39.34 39.42 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 5.39 -0.98 -0.27 -0.72 0.11 -1.75 0.11 132.00 133.89 1wnb h PRO 151 Ca 0.22 0.07 -0.02 0.00 0.11 0.00 0.00 66.00 66.37 1wnb h PRO 151 Cb 0.85 0.22 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 1wnb h PRO 151 CO 0.50 -0.65 0.10 1.25 -0.21 0.00 0.00 178.00 178.99 1wnb h LEU 152 N -1.02 0.38 -0.52 2.35 6.46 -1.92 -2.01 115.31 119.03 1wnb h LEU 152 Ca -0.10 -0.18 0.06 0.00 -0.12 0.00 0.00 57.88 57.54 1wnb h LEU 152 Cb 0.79 -0.10 -0.06 0.00 -0.73 0.00 0.00 40.66 40.57 1wnb h LEU 152 CO 0.14 0.46 0.21 -0.03 -0.62 0.00 0.00 178.44 178.60 1wnb h MET 153 N 0.27 0.39 -0.30 1.25 4.05 -1.93 0.12 114.93 118.79 1wnb h MET 153 Ca 0.09 -0.02 -0.12 0.00 -0.28 0.00 0.00 59.70 59.36 1wnb h MET 153 Cb 0.21 -0.09 -0.01 0.00 -0.80 0.00 0.00 31.60 30.91 1wnb h MET 153 CO -0.01 0.26 -0.31 0.52 0.23 0.00 0.00 176.91 177.61 1wnb h MET 154 N 0.40 0.63 -0.60 0.39 2.86 -0.74 -0.71 114.93 117.17 1wnb h MET 154 Ca 0.24 -0.28 0.08 0.00 -2.06 0.00 0.00 59.70 57.68 1wnb h MET 154 Cb 0.24 -0.02 -0.06 0.00 0.06 0.00 0.00 31.60 31.82 1wnb h MET 154 CO -0.23 0.86 0.27 0.00 1.06 0.00 0.00 176.91 178.87 1wnb h ALA 155 N 1.12 0.78 -0.48 6.32 0.00 -0.74 -1.33 119.26 124.94 1wnb h ALA 155 Ca 0.06 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1wnb h ALA 155 Cb 0.80 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 1wnb h ALA 155 CO 0.07 -0.12 0.24 0.00 0.00 0.00 0.00 179.25 179.43 1wnb h ALA 156 N 1.37 0.61 -0.02 0.00 0.00 -0.07 -1.61 119.26 119.56 1wnb h ALA 156 Ca 0.29 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 1wnb h ALA 156 Cb 0.29 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 1wnb h ALA 156 CO -0.25 0.16 -0.08 -1.49 0.00 0.00 0.00 179.25 177.59 1wnb h TRP 157 N 0.63 0.02 0.07 0.00 4.06 -0.91 -1.06 115.95 118.75 1wnb h TRP 157 Ca 0.17 -0.00 -0.25 0.00 2.06 0.00 0.00 58.89 60.87 1wnb h TRP 157 Cb 0.09 -0.01 -0.02 0.00 -1.00 0.00 0.00 29.16 28.23 1wnb h TRP 157 CO -0.01 0.10 -1.31 0.87 -3.56 0.00 0.00 178.44 174.53 1wnb h LYS 158 N 0.02 0.14 0.15 0.49 1.57 -1.12 -3.40 116.57 114.42 1wnb h LYS 158 Ca 0.00 -0.24 -0.01 0.00 -1.87 0.00 0.00 60.65 58.53 1wnb h LYS 158 Cb 0.16 0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.56 1wnb h LYS 158 CO 0.01 1.12 -0.07 -0.07 -0.57 0.00 0.00 179.45 179.87 1wnb h LEU 159 N -0.55 -0.17 0.08 2.94 3.38 -1.29 -3.17 115.31 116.52 1wnb h LEU 159 Ca -0.31 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.64 1wnb h LEU 159 Cb 1.57 0.04 0.00 0.00 0.09 0.00 0.00 40.66 42.37 1wnb h LEU 159 CO -0.03 -0.09 -0.04 0.00 0.09 0.00 0.00 178.44 178.36 1wnb h ALA 160 N 0.62 -0.11 0.00 1.53 0.00 -1.40 -0.89 119.26 119.01 1wnb h ALA 160 Ca -0.02 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.74 1wnb h ALA 160 Cb 0.18 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1wnb h ALA 160 CO 0.03 -0.52 -0.44 -1.00 0.00 0.00 0.00 179.25 177.32 1wnb h PRO 161 N -0.18 0.00 -0.11 0.00 0.13 -1.77 -0.79 132.00 129.27 1wnb h PRO 161 Ca -0.01 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.06 1wnb h PRO 161 Cb 0.15 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.28 1wnb h PRO 161 CO 0.02 0.44 -0.16 0.00 -0.23 0.00 0.00 178.00 178.07 1wnb h ALA 162 N 1.56 0.17 -0.36 -0.56 0.00 -1.42 -2.60 119.26 116.05 1wnb h ALA 162 Ca -0.00 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.55 1wnb h ALA 162 Cb 1.09 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 1wnb h ALA 162 CO 0.06 0.07 0.16 -0.07 0.00 0.00 0.00 179.25 179.47 1wnb h LEU 163 N -0.11 0.48 -1.91 0.00 3.38 -1.22 -2.27 115.31 113.66 1wnb h LEU 163 Ca 0.01 -0.14 0.10 0.00 0.09 0.00 0.00 57.88 57.94 1wnb h LEU 163 Cb 0.71 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 1wnb h LEU 163 CO 0.04 0.49 0.28 0.00 0.09 0.00 0.00 178.44 179.34 1wnb h ALA 164 N 1.01 2.25 0.00 1.53 0.00 -1.10 0.28 119.26 123.23 1wnb h ALA 164 Ca 0.12 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1wnb h ALA 164 Cb 0.15 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1wnb h ALA 164 CO -0.01 -0.35 -0.50 0.00 0.00 0.00 0.00 179.25 178.39 1wnb h ALA 165 N 1.80 0.69 0.00 0.00 0.00 -1.35 -3.44 119.26 116.95 1wnb h ALA 165 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1wnb h ALA 165 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1wnb h ALA 165 CO -0.02 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.64 1wnb n GLY 166 N 1.29 1.02 3.88 0.00 0.00 0.09 -3.88 105.19 107.60 1wnb n GLY 166 Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.00 6.35 0.13 1.61 -0.87 -0.88 -3.80 114.94 115.49 1wnb s ASN 167 Ca 0.00 1.16 -0.00 0.00 -1.57 0.00 0.00 52.86 52.45 1wnb s ASN 167 Cb 0.00 -2.35 -0.04 0.00 -0.02 0.00 0.00 41.25 38.84 1wnb s ASN 167 CO 0.00 -0.61 0.30 0.00 -2.57 0.00 0.00 177.10 174.23 1wnb s VAL 169 N -1.69 0.65 -0.28 0.00 1.01 -0.29 -0.84 120.40 118.96 1wnb s VAL 169 Ca 0.37 -0.33 0.03 0.00 0.00 0.00 0.00 61.98 62.05 1wnb s VAL 169 Cb -0.12 -0.56 0.07 0.00 0.00 0.00 0.00 36.38 35.77 1wnb s VAL 169 CO 0.28 0.19 -0.06 -0.69 0.00 0.00 0.00 175.10 174.82 1wnb s VAL 170 N -0.04 2.17 -0.15 2.92 1.01 -0.38 -0.13 120.40 125.81 1wnb s VAL 170 Ca 0.01 -1.83 -0.12 0.00 0.00 0.00 0.00 61.98 60.03 1wnb s VAL 170 Cb -0.05 -2.38 -0.05 0.00 0.00 0.00 0.00 36.38 33.90 1wnb s VAL 170 CO -0.00 -0.21 0.25 -0.22 0.00 0.00 0.00 175.10 174.92 1wnb s LEU 171 N 1.06 4.27 -0.27 3.92 2.96 0.99 -1.30 118.68 130.31 1wnb s LEU 171 Ca -0.03 0.47 0.00 0.00 -0.22 0.00 0.00 54.13 54.36 1wnb s LEU 171 Cb -0.20 -2.29 0.05 0.00 0.50 0.00 0.00 46.19 44.25 1wnb s LEU 171 CO -0.06 0.17 -0.06 -0.75 -1.32 0.00 0.00 176.35 174.33 1wnb s LYS 172 N 0.17 2.45 0.78 1.98 2.20 0.71 -0.75 119.74 127.28 1wnb s LYS 172 Ca 0.15 -1.23 -0.11 0.00 -0.36 0.00 0.00 55.97 54.42 1wnb s LYS 172 Cb -0.13 -3.02 0.06 0.00 -1.51 0.00 0.00 37.83 33.23 1wnb s LYS 172 CO 0.03 -0.55 1.09 -2.14 -0.36 0.00 0.00 175.35 173.42 1wnb s PRO 173 N 1.21 2.19 0.27 4.03 0.02 -1.26 -1.50 135.00 139.96 1wnb s PRO 173 Ca -0.05 1.04 -0.30 0.00 0.02 0.00 0.00 61.00 61.71 1wnb s PRO 173 Cb -0.19 -1.90 -0.14 0.00 0.02 0.00 0.00 34.50 32.29 1wnb s PRO 173 CO -0.03 -1.65 1.23 0.45 -0.33 0.00 0.00 177.00 176.67 1wnb n SER 174 N -3.51 2.14 0.27 2.53 2.88 -0.66 -4.62 113.62 112.64 1wnb n SER 174 Ca 0.08 1.17 0.11 0.00 -1.33 0.00 0.00 58.87 58.90 1wnb n SER 174 Cb 0.54 -1.37 0.74 0.00 -0.75 0.00 0.00 64.21 63.37 1wnb n SER 174 CO 0.00 0.00 0.00 1.05 -1.23 0.00 0.00 175.04 174.86 1wnb h GLU 175 N 3.03 0.00 -0.39 -1.46 9.09 -1.90 -2.60 114.58 120.36 1wnb h GLU 175 Ca -0.43 0.00 -0.08 0.00 0.05 0.00 0.00 59.36 58.89 1wnb h GLU 175 Cb 1.31 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 28.39 1wnb h GLU 175 CO 0.67 0.01 -0.10 0.82 0.05 0.00 0.00 179.01 180.46 1wnb h ILE 176 N 0.00 1.25 -2.06 -1.06 1.08 -1.91 -3.40 117.51 111.41 1wnb h ILE 176 Ca -0.00 -1.10 -0.55 0.00 -0.39 0.00 0.00 64.86 62.82 1wnb h ILE 176 Cb 0.03 1.07 -0.40 0.00 -3.07 0.00 0.00 36.82 34.44 1wnb h ILE 176 CO 0.00 0.37 -0.99 0.35 -0.69 0.00 0.00 178.15 177.19 1wnb n THR 177 N -4.18 0.36 1.26 -0.27 -2.24 -0.99 -4.57 114.28 103.66 1wnb n THR 177 Ca 0.01 -4.54 0.13 0.00 -2.27 0.00 0.00 64.05 57.39 1wnb n THR 177 Cb 0.34 -1.49 0.35 0.00 -2.10 0.00 0.00 70.33 67.43 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 0.85 1.22 -0.01 -0.78 -0.04 -1.18 -4.55 135.00 130.50 1wnb n PRO 178 Ca 0.25 -0.79 -0.13 0.00 -0.04 0.00 0.00 63.50 62.79 1wnb n PRO 178 Cb 0.53 -1.48 -0.10 0.00 -0.04 0.00 0.00 33.50 32.40 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 1.93 -0.02 -1.81 1.53 3.38 -1.92 0.43 115.31 118.84 1wnb h LEU 179 Ca 0.00 -0.51 0.02 0.00 0.09 0.00 0.00 57.88 57.48 1wnb h LEU 179 Cb 0.57 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 1wnb h LEU 179 CO 0.00 0.51 0.17 0.71 0.09 0.00 0.00 178.44 179.92 1wnb h THR 180 N -0.55 1.01 -0.16 0.22 1.35 -1.88 -1.26 112.91 111.64 1wnb h THR 180 Ca -0.00 -0.09 -0.20 0.00 -0.55 0.00 0.00 66.41 65.58 1wnb h THR 180 Cb 0.53 0.74 0.00 0.00 -1.73 0.00 0.00 68.15 67.69 1wnb h THR 180 CO 0.00 0.05 -0.70 0.00 -0.25 0.00 0.00 175.52 174.62 1wnb h ALA 181 N 1.85 0.48 -0.05 6.62 0.00 -1.70 0.23 119.26 126.69 1wnb h ALA 181 Ca 0.10 -0.58 -0.11 0.00 0.00 0.00 0.00 54.91 54.33 1wnb h ALA 181 Cb 0.10 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1wnb h ALA 181 CO -0.02 0.71 -0.46 -0.07 0.00 0.00 0.00 179.25 179.40 1wnb h LEU 182 N 0.46 0.12 -0.51 0.00 3.38 -0.62 -0.47 115.31 117.66 1wnb h LEU 182 Ca -0.03 -0.05 -0.15 0.00 0.09 0.00 0.00 57.88 57.74 1wnb h LEU 182 Cb 1.29 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 42.00 1wnb h LEU 182 CO 0.14 0.57 -0.41 0.50 0.09 0.00 0.00 178.44 179.32 1wnb h LYS 183 N 0.09 0.76 -0.63 1.13 1.63 -0.98 -2.31 116.57 116.25 1wnb h LYS 183 Ca 0.00 -0.40 0.07 0.00 -0.85 0.00 0.00 60.65 59.47 1wnb h LYS 183 Cb 0.86 0.01 -0.06 0.00 -0.60 0.00 0.00 32.23 32.44 1wnb h LYS 183 CO 0.07 1.03 0.32 1.25 -3.45 0.00 0.00 179.45 178.66 1wnb h LEU 184 N 0.62 0.44 -0.05 5.20 5.85 -0.18 -0.79 115.31 126.41 1wnb h LEU 184 Ca 0.05 0.04 0.03 0.00 0.84 0.00 0.00 57.88 58.84 1wnb h LEU 184 Cb 0.96 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.92 1wnb h LEU 184 CO 0.09 0.28 -0.14 0.00 -0.34 0.00 0.00 178.44 178.34 1wnb h ALA 185 N 1.36 -0.12 -0.08 1.25 0.00 -0.75 0.23 119.26 121.16 1wnb h ALA 185 Ca 0.29 0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.26 1wnb h ALA 185 Cb 0.24 0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.25 1wnb h ALA 185 CO -0.21 -0.61 -0.13 1.49 0.00 0.00 0.00 179.25 179.79 1wnb h GLU 186 N -0.20 -0.17 -0.04 0.00 4.81 -0.97 -1.56 114.58 116.44 1wnb h GLU 186 Ca 0.06 0.01 -0.12 0.00 -0.13 0.00 0.00 59.36 59.18 1wnb h GLU 186 Cb 0.29 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.69 1wnb h GLU 186 CO -0.17 -0.11 -0.54 -0.07 -0.73 0.00 0.00 179.01 177.39 1wnb h LEU 187 N -0.18 0.14 0.00 1.64 3.38 -0.29 -3.15 115.31 116.85 1wnb h LEU 187 Ca 0.07 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1wnb h LEU 187 Cb 0.28 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1wnb h LEU 187 CO -0.18 0.65 -1.17 0.00 0.09 0.00 0.00 178.44 177.83 1wnb n ALA 188 N -2.45 4.02 0.00 1.53 0.00 0.72 -4.59 120.51 119.73 1wnb n ALA 188 Ca -0.02 -0.53 0.00 0.00 0.00 0.00 0.00 53.44 52.90 1wnb n ALA 188 Cb 0.56 -0.83 0.00 0.00 0.00 0.00 0.00 19.45 19.18 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 -1.74 0.00 0.00 0.00 4.81 -0.60 -1.50 118.16 119.13 1wnb n LYS 189 Ca 0.02 0.00 0.08 0.00 -0.87 0.00 0.00 58.31 57.55 1wnb n LYS 189 Cb 0.40 0.00 0.02 0.00 0.02 0.00 0.00 35.03 35.46 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 -2.77 1.86 0.06 3.14 8.00 -1.26 -4.57 116.55 121.01 1wnb n ASP 190 Ca 0.00 -1.43 -0.10 0.00 0.71 0.00 0.00 54.79 53.97 1wnb n ASP 190 Cb 0.00 0.36 0.01 0.00 -0.02 0.00 0.00 41.12 41.47 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 2.24 1.40 -2.78 0.53 2.04 -1.58 -3.45 117.51 115.92 1wnb h ILE 191 Ca 0.00 -2.27 -0.59 0.00 1.00 0.00 0.00 64.86 62.99 1wnb h ILE 191 Cb 0.61 2.23 -0.10 0.00 -0.74 0.00 0.00 36.82 38.81 1wnb h ILE 191 CO 0.00 0.68 -0.65 -0.36 0.00 0.00 0.00 178.15 177.82 1wnb s PHE 192 N -3.49 2.86 0.77 1.37 0.40 -1.26 -4.91 117.98 113.72 1wnb s PHE 192 Ca -0.05 -0.13 -0.15 0.00 -0.60 0.00 0.00 56.93 56.00 1wnb s PHE 192 Cb 0.10 -1.37 0.04 0.00 0.51 0.00 0.00 43.02 42.29 1wnb s PHE 192 CO 0.84 0.53 1.01 -2.30 0.70 0.00 0.00 175.22 176.00 1wnb n PRO 193 N -0.24 0.33 -1.65 0.24 -0.02 -1.26 -4.85 135.00 127.55 1wnb n PRO 193 Ca -0.09 0.18 -0.48 0.00 -2.02 0.00 0.00 63.50 61.09 1wnb n PRO 193 Cb 0.55 -2.27 -0.05 0.00 -0.02 0.00 0.00 33.50 31.71 1wnb n PRO 193 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1wnb n ALA 194 N -2.88 0.80 0.00 3.55 0.00 -1.26 -1.66 120.51 119.05 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 0.50 -2.30 0.00 0.00 0.00 0.00 0.00 19.45 17.65 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 3.31 2.29 0.28 0.00 0.00 -1.26 -4.68 105.19 105.13 1wnb n GLY 195 Ca 0.18 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.08 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 -3.91 1.61 2.07 -1.60 -3.29 116.25 112.41 1wnb h VAL 196 Ca 0.00 -1.37 -0.68 0.00 0.82 0.00 0.00 66.70 65.47 1wnb h VAL 196 Cb 0.00 1.14 -0.28 0.00 -1.52 0.00 0.00 31.29 30.63 1wnb h VAL 196 CO 0.00 0.47 -0.83 -0.69 0.02 0.00 0.00 177.57 176.54 1wnb s VAL 197 N -4.67 2.54 -0.01 2.57 1.01 -1.26 -1.14 120.40 119.45 1wnb s VAL 197 Ca -0.12 -0.89 0.03 0.00 0.00 0.00 0.00 61.98 61.00 1wnb s VAL 197 Cb 0.12 -1.98 -0.01 0.00 0.00 0.00 0.00 36.38 34.52 1wnb s VAL 197 CO 0.87 0.57 -0.09 0.20 0.00 0.00 0.00 175.10 176.65 1wnb s ASN 198 N -0.24 1.02 -0.09 3.32 0.01 0.82 -4.66 114.94 115.12 1wnb s ASN 198 Ca -0.00 -0.16 0.02 0.00 -0.71 0.00 0.00 52.86 52.01 1wnb s ASN 198 Cb -0.13 -0.11 0.01 0.00 0.41 0.00 0.00 41.25 41.43 1wnb s ASN 198 CO 0.03 0.11 -0.13 -0.63 -1.51 0.00 0.00 177.10 174.96 1wnb s ILE 199 N -0.21 1.31 0.40 0.60 1.01 -0.62 -0.00 121.20 123.69 1wnb s ILE 199 Ca 0.03 -0.55 0.08 0.00 0.00 0.00 0.00 60.65 60.21 1wnb s ILE 199 Cb -0.03 -1.21 -0.05 0.00 0.01 0.00 0.00 42.46 41.18 1wnb s ILE 199 CO -0.00 0.40 0.20 -0.76 0.00 0.00 0.00 174.94 174.78 1wnb s LEU 200 N 0.89 3.18 -0.03 2.97 1.43 0.07 -1.17 118.68 126.02 1wnb s LEU 200 Ca -0.09 -0.97 0.04 0.00 -1.03 0.00 0.00 54.13 52.07 1wnb s LEU 200 Cb -0.15 -1.58 -0.00 0.00 0.03 0.00 0.00 46.19 44.48 1wnb s LEU 200 CO 0.01 -0.52 -0.15 0.12 0.23 0.00 0.00 176.35 176.04 1wnb s PHE 201 N -2.55 1.50 0.00 0.29 2.19 -1.26 -4.27 117.98 113.88 1wnb s PHE 201 Ca 0.42 -0.38 0.00 0.00 0.33 0.00 0.00 56.93 57.29 1wnb s PHE 201 Cb 0.02 -1.00 0.00 0.00 -1.31 0.00 0.00 43.02 40.72 1wnb s PHE 201 CO 0.23 -0.11 0.00 0.41 1.83 0.00 0.00 175.22 177.58 1wnb n GLY 202 N 3.03 2.72 3.63 13.12 0.00 -1.26 -1.00 105.19 125.43 1wnb n GLY 202 Ca -0.17 -1.27 -0.29 0.00 0.00 0.00 0.00 46.02 44.29 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 -2.08 0.24 0.14 1.61 0.52 -1.26 -4.20 118.95 113.92 1wnb s ARG 203 Ca 0.00 0.75 -0.21 0.00 -0.52 0.00 0.00 55.73 55.75 1wnb s ARG 203 Cb 0.00 -1.70 0.02 0.00 0.52 0.00 0.00 34.95 33.80 1wnb s ARG 203 CO 0.00 -2.92 1.66 0.78 0.02 0.00 0.00 175.30 174.84 1wnb h GLY 204 N -2.04 0.00 0.98 -3.53 0.00 -1.96 -0.11 103.07 96.42 1wnb h GLY 204 Ca -0.55 0.20 -0.19 0.00 0.00 0.00 0.00 47.33 46.79 1wnb h GLY 204 CO 0.54 -0.16 -0.70 0.50 0.00 0.00 0.00 176.54 176.71 1wnb h LYS 205 N -0.15 0.58 0.04 4.80 1.57 -1.95 0.95 116.57 122.41 1wnb h LYS 205 Ca 0.13 -0.55 -0.25 0.00 -1.87 0.00 0.00 60.65 58.12 1wnb h LYS 205 Cb 0.35 0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.77 1wnb h LYS 205 CO -0.32 1.17 -1.23 1.79 -0.57 0.00 0.00 179.45 180.28 1wnb h THR 206 N 0.19 1.46 0.00 -0.16 1.35 -1.95 -3.39 112.91 110.41 1wnb h THR 206 Ca -0.07 -3.16 -0.05 0.00 -0.55 0.00 0.00 66.41 62.58 1wnb h THR 206 Cb 1.37 2.79 -0.01 0.00 -1.73 0.00 0.00 68.15 70.57 1wnb h THR 206 CO 0.14 0.86 -1.21 0.52 -0.25 0.00 0.00 175.52 175.59 1wnb n VAL 207 N -3.35 0.21 0.07 6.82 0.31 -0.12 -4.65 118.33 117.62 1wnb n VAL 207 Ca -0.07 -0.09 -0.13 0.00 -0.01 0.00 0.00 64.34 64.05 1wnb n VAL 207 Cb 0.99 -0.70 -0.09 0.00 -0.91 0.00 0.00 33.84 33.13 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 0.35 -0.21 -0.14 2.92 0.00 -0.18 -2.74 103.07 103.09 1wnb h GLY 208 Ca -0.08 0.08 0.09 0.00 0.00 0.00 0.00 47.33 47.41 1wnb h GLY 208 CO -0.01 -0.08 -0.27 -0.55 0.00 0.00 0.00 176.54 175.64 1wnb h ASP 209 N -0.61 -0.90 -0.55 0.19 3.32 -1.16 0.14 116.42 116.85 1wnb h ASP 209 Ca -0.02 0.18 -0.03 0.00 0.02 0.00 0.00 57.03 57.19 1wnb h ASP 209 Cb 0.46 0.45 -0.03 0.00 0.22 0.00 0.00 39.33 40.44 1wnb h ASP 209 CO 0.03 -0.28 0.26 1.55 -1.72 0.00 0.00 179.24 179.08 1wnb h PRO 210 N -0.18 0.83 0.72 3.56 0.13 -1.82 -2.60 132.00 132.64 1wnb h PRO 210 Ca 0.20 -0.11 -0.04 0.00 -0.87 0.00 0.00 66.00 65.18 1wnb h PRO 210 Cb 0.50 -0.15 0.01 0.00 0.13 0.00 0.00 31.00 31.48 1wnb h PRO 210 CO -0.54 0.66 -0.34 1.25 -0.23 0.00 0.00 178.00 178.80 1wnb h LEU 211 N 0.83 -0.82 -1.29 1.56 5.85 -1.06 -2.95 115.31 117.43 1wnb h LEU 211 Ca 0.20 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.91 1wnb h LEU 211 Cb 0.12 0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.36 1wnb h LEU 211 CO -0.02 -0.46 -0.08 0.71 -0.34 0.00 0.00 178.44 178.24 1wnb h THR 212 N -1.20 0.22 -0.01 1.05 1.35 -0.80 -2.54 112.91 110.99 1wnb h THR 212 Ca -0.10 -0.75 0.00 0.00 -0.55 0.00 0.00 66.41 65.01 1wnb h THR 212 Cb 0.76 1.62 0.00 0.00 -1.73 0.00 0.00 68.15 68.80 1wnb h THR 212 CO 0.16 0.08 -0.23 0.61 -0.25 0.00 0.00 175.52 175.90 1wnb n GLY 213 N 0.10 -0.76 3.72 5.82 0.00 -0.98 -4.85 105.19 108.23 1wnb n GLY 213 Ca 0.00 -0.36 -0.42 0.00 0.00 0.00 0.00 46.02 45.25 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 -0.80 2.74 0.01 1.61 -0.00 -0.96 -4.90 115.22 112.91 1wnb n HIS 214 Ca 0.12 0.07 0.12 0.00 -0.00 0.00 0.00 57.72 58.03 1wnb n HIS 214 Cb 0.33 -2.66 0.56 0.00 -0.00 0.00 0.00 29.99 28.21 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 6.52 0.26 -0.01 1.57 0.11 -1.92 -1.41 132.00 137.12 1wnb h PRO 215 Ca -0.44 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1wnb h PRO 215 Cb 1.21 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1wnb h PRO 215 CO 0.94 0.17 -0.08 1.63 -0.21 0.00 0.00 178.00 180.44 1wnb n LYS 216 N -4.47 1.12 -2.56 1.05 4.76 -1.26 -4.79 118.16 112.01 1wnb n LYS 216 Ca 0.06 -0.52 -0.43 0.00 -2.87 0.00 0.00 58.31 54.55 1wnb n LYS 216 Cb 0.32 -1.49 -0.02 0.00 -1.84 0.00 0.00 35.03 32.00 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 -2.24 4.50 -0.11 -0.18 1.01 -0.53 -4.33 120.40 118.52 1wnb s VAL 217 Ca 0.34 1.80 0.20 0.00 0.00 0.00 0.00 61.98 64.32 1wnb s VAL 217 Cb 0.20 -4.16 -0.27 0.00 0.00 0.00 0.00 36.38 32.15 1wnb s VAL 217 CO 0.42 -0.06 0.40 0.54 0.00 0.00 0.00 175.10 176.39 1wnb n ARG 218 N 5.65 0.66 -3.90 2.72 5.12 -0.21 -4.94 116.66 121.76 1wnb n ARG 218 Ca 0.11 -0.07 -0.13 0.00 -1.93 0.00 0.00 57.85 55.83 1wnb n ARG 218 Cb 0.47 -1.57 -0.14 0.00 -1.16 0.00 0.00 32.46 30.06 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 -3.08 0.07 -0.17 5.56 1.75 -1.16 -1.93 119.30 120.35 1wnb s MET 219 Ca -0.08 0.00 -0.04 0.00 -1.25 0.00 0.00 55.69 54.32 1wnb s MET 219 Cb 0.10 -0.12 -0.03 0.00 2.84 0.00 0.00 34.83 37.62 1wnb s MET 219 CO 0.87 -0.02 -0.02 0.08 -0.65 0.00 0.00 175.02 175.28 1wnb s VAL 220 N 0.20 4.04 -0.21 10.11 1.01 0.23 -0.85 120.40 134.92 1wnb s VAL 220 Ca -0.02 -0.30 -0.00 0.00 0.00 0.00 0.00 61.98 61.66 1wnb s VAL 220 Cb -0.03 -2.79 0.02 0.00 0.00 0.00 0.00 36.38 33.58 1wnb s VAL 220 CO -0.01 0.48 -0.13 -0.55 0.00 0.00 0.00 175.10 174.89 1wnb s SER 221 N 0.47 3.78 -0.10 3.32 0.15 -0.11 -1.64 113.70 119.57 1wnb s SER 221 Ca -0.02 -0.78 0.03 0.00 0.70 0.00 0.00 55.95 55.88 1wnb s SER 221 Cb -0.14 -1.57 0.01 0.00 -1.71 0.00 0.00 66.02 62.61 1wnb s SER 221 CO 0.02 -0.06 -0.18 -0.22 1.20 0.00 0.00 173.24 174.00 1wnb s LEU 222 N 1.30 1.87 -0.19 3.45 2.96 -0.31 -0.51 118.68 127.25 1wnb s LEU 222 Ca 0.02 -0.45 -0.03 0.00 -0.22 0.00 0.00 54.13 53.45 1wnb s LEU 222 Cb -0.15 -1.16 -0.01 0.00 0.50 0.00 0.00 46.19 45.37 1wnb s LEU 222 CO -0.08 0.08 -0.07 -0.89 -1.32 0.00 0.00 176.35 174.06 1wnb s THR 223 N 0.63 3.28 -0.60 3.68 2.01 -1.07 -1.55 115.64 122.03 1wnb s THR 223 Ca -0.14 -0.54 0.00 0.00 0.31 0.00 0.00 61.69 61.32 1wnb s THR 223 Cb -0.16 -2.45 0.00 0.00 0.01 0.00 0.00 72.50 69.89 1wnb s THR 223 CO 0.04 0.46 0.00 0.61 -0.69 0.00 0.00 174.62 175.04 1wnb n GLY 224 N 4.29 -0.80 3.90 4.40 0.00 -0.90 -3.49 105.19 112.59 1wnb n GLY 224 Ca -0.18 -0.29 -0.29 0.00 0.00 0.00 0.00 46.02 45.26 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 5.24 0.21 1.61 1.04 -1.26 -4.02 113.70 112.52 1wnb s SER 225 Ca 0.00 0.94 -0.09 0.00 0.48 0.00 0.00 55.95 57.28 1wnb s SER 225 Cb 0.00 -1.70 0.23 0.00 0.10 0.00 0.00 66.02 64.65 1wnb s SER 225 CO 0.00 -1.42 1.82 0.40 0.98 0.00 0.00 173.24 175.02 1wnb h ILE 226 N -0.65 1.02 -0.54 -1.02 2.04 -1.90 -1.77 117.51 114.68 1wnb h ILE 226 Ca -0.45 -0.26 -0.01 0.00 1.00 0.00 0.00 64.86 65.13 1wnb h ILE 226 Cb 1.27 0.19 -0.03 0.00 -0.74 0.00 0.00 36.82 37.51 1wnb h ILE 226 CO 0.63 0.14 0.28 0.00 0.00 0.00 0.00 178.15 179.20 1wnb h ALA 227 N 1.33 1.47 -0.21 1.87 0.00 -1.95 0.25 119.26 122.03 1wnb h ALA 227 Ca 0.30 -0.10 -0.19 0.00 0.00 0.00 0.00 54.91 54.92 1wnb h ALA 227 Cb 0.13 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1wnb h ALA 227 CO -0.16 0.43 -0.64 1.15 0.00 0.00 0.00 179.25 180.03 1wnb h THR 228 N 0.76 1.29 0.36 0.00 2.02 -1.89 -1.58 112.91 113.87 1wnb h THR 228 Ca 0.19 -1.86 -0.00 0.00 0.77 0.00 0.00 66.41 65.51 1wnb h THR 228 Cb 0.05 1.81 -0.02 0.00 -1.74 0.00 0.00 68.15 68.25 1wnb h THR 228 CO -0.03 0.59 -0.39 1.23 0.37 0.00 0.00 175.52 177.30 1wnb h GLY 229 N 0.78 -0.90 -0.27 2.16 0.00 -0.53 -0.01 103.07 104.30 1wnb h GLY 229 Ca -0.01 0.45 0.16 0.00 0.00 0.00 0.00 47.33 47.93 1wnb h GLY 229 CO 0.13 -0.31 0.02 -2.09 0.00 0.00 0.00 176.54 174.29 1wnb h GLU 230 N -0.78 0.11 -0.22 4.80 4.81 -0.55 -1.19 114.58 121.57 1wnb h GLU 230 Ca -0.03 -0.01 -0.10 0.00 -0.13 0.00 0.00 59.36 59.10 1wnb h GLU 230 Cb 0.71 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 30.06 1wnb h GLU 230 CO -0.08 0.08 -0.25 1.25 -0.73 0.00 0.00 179.01 179.28 1wnb h HIS 231 N 0.12 0.67 -0.37 0.92 2.76 -0.90 -2.06 115.15 116.28 1wnb h HIS 231 Ca 0.39 -0.21 -0.01 0.00 -2.20 0.00 0.00 60.37 58.34 1wnb h HIS 231 Cb 0.68 -0.14 -0.02 0.00 1.55 0.00 0.00 27.41 29.48 1wnb h HIS 231 CO -0.40 0.91 0.18 0.82 -1.30 0.00 0.00 177.93 178.14 1wnb h ILE 232 N 0.25 1.17 -0.09 6.26 2.04 -0.91 -0.51 117.51 125.71 1wnb h ILE 232 Ca 0.03 -0.47 0.04 0.00 1.00 0.00 0.00 64.86 65.46 1wnb h ILE 232 Cb 0.81 0.80 -0.05 0.00 -0.74 0.00 0.00 36.82 37.63 1wnb h ILE 232 CO 0.06 0.18 -0.21 0.40 0.00 0.00 0.00 178.15 178.58 1wnb h ILE 233 N 0.46 0.49 -0.49 -0.67 2.04 -1.07 -0.86 117.51 117.40 1wnb h ILE 233 Ca 0.13 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.06 1wnb h ILE 233 Cb 0.12 0.49 -0.06 0.00 -0.74 0.00 0.00 36.82 36.62 1wnb h ILE 233 CO -0.02 0.00 0.14 0.28 0.00 0.00 0.00 178.15 178.56 1wnb h SER 234 N -0.29 0.10 1.25 1.72 0.02 -1.26 -2.74 113.55 112.35 1wnb h SER 234 Ca 0.09 0.07 -0.00 0.00 -0.84 0.00 0.00 61.79 61.11 1wnb h SER 234 Cb 0.41 0.08 -0.00 0.00 0.14 0.00 0.00 62.40 63.03 1wnb h SER 234 CO -0.26 0.08 -0.01 -0.74 -1.14 0.00 0.00 176.83 174.77 1wnb h HIS 235 N 0.30 0.00 -0.26 3.45 -0.00 -0.39 -2.62 115.15 115.63 1wnb h HIS 235 Ca 0.24 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.61 1wnb h HIS 235 Cb 0.29 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.70 1wnb h HIS 235 CO -0.19 0.01 0.00 0.25 -0.00 0.00 0.00 177.93 178.00 1wnb n THR 236 N -3.10 0.59 0.02 6.26 -2.24 -0.39 -4.66 114.28 110.76 1wnb n THR 236 Ca 0.01 -0.80 -0.03 0.00 -2.27 0.00 0.00 64.05 60.97 1wnb n THR 236 Cb 0.36 0.82 0.23 0.00 -2.10 0.00 0.00 70.33 69.64 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 2.53 1.17 -0.50 6.98 0.00 -1.15 -2.82 119.26 125.46 1wnb h ALA 237 Ca 0.00 -0.32 0.15 0.00 0.00 0.00 0.00 54.91 54.74 1wnb h ALA 237 Cb 0.69 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 1wnb h ALA 237 CO 0.00 0.53 0.39 0.66 0.00 0.00 0.00 179.25 180.83 1wnb h SER 238 N 0.42 0.00 -0.04 0.00 4.64 -1.83 -2.75 113.55 113.99 1wnb h SER 238 Ca 0.07 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.38 1wnb h SER 238 Cb 0.60 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.69 1wnb h SER 238 CO 0.04 0.00 -0.14 -1.54 -0.87 0.00 0.00 176.83 174.32 1wnb n SER 239 N -4.23 2.32 -4.37 4.97 3.41 -1.07 -4.99 113.62 109.65 1wnb n SER 239 Ca 0.09 -3.35 -0.39 0.00 -0.26 0.00 0.00 58.87 54.96 1wnb n SER 239 Cb 0.60 -0.48 -0.08 0.00 -0.26 0.00 0.00 64.21 63.99 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 -1.25 -0.13 -1.80 -1.33 2.08 -1.04 -4.84 119.36 111.05 1wnb n ILE 240 Ca 0.18 -0.07 -0.38 0.00 0.56 0.00 0.00 62.75 63.04 1wnb n ILE 240 Cb 0.70 -0.54 0.04 0.00 -0.75 0.00 0.00 39.64 39.09 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 -6.97 3.14 0.10 0.38 1.02 -1.16 -4.95 119.74 111.30 1wnb s LYS 241 Ca 0.69 2.22 -0.31 0.00 0.02 0.00 0.00 55.97 58.59 1wnb s LYS 241 Cb -0.40 -2.25 -0.07 0.00 -0.52 0.00 0.00 37.83 34.59 1wnb s LYS 241 CO 0.97 -1.18 1.23 0.50 -0.92 0.00 0.00 175.35 175.95 1wnb s ARG 242 N -2.92 4.43 0.25 1.68 3.52 -0.81 -4.92 118.95 120.18 1wnb s ARG 242 Ca 0.72 1.84 0.12 0.00 -0.13 0.00 0.00 55.73 58.27 1wnb s ARG 242 Cb -0.40 -3.31 -0.05 0.00 -1.56 0.00 0.00 34.95 29.63 1wnb s ARG 242 CO 0.47 -0.24 -0.20 0.95 -0.81 0.00 0.00 175.30 175.46 1wnb s THR 243 N 0.82 2.49 -0.18 4.11 -4.23 -1.26 -0.60 115.64 116.78 1wnb s THR 243 Ca 0.58 -2.24 -0.06 0.00 -1.18 0.00 0.00 61.69 58.79 1wnb s THR 243 Cb -0.31 -2.27 0.08 0.00 1.34 0.00 0.00 72.50 71.34 1wnb s THR 243 CO 0.31 -0.30 0.35 -2.28 -0.54 0.00 0.00 174.62 172.17 1wnb s HIS 244 N -2.20 -0.65 -0.05 3.99 2.46 -0.65 -4.96 115.29 113.22 1wnb s HIS 244 Ca 0.27 1.23 -0.02 0.00 0.47 0.00 0.00 55.06 57.00 1wnb s HIS 244 Cb -0.06 0.14 0.04 0.00 -0.13 0.00 0.00 32.58 32.56 1wnb s HIS 244 CO 0.13 -0.46 0.10 1.41 -2.47 0.00 0.00 174.74 173.46 1wnb s MET 245 N 2.53 -0.00 -0.29 2.88 1.75 -0.76 -1.16 119.30 124.24 1wnb s MET 245 Ca 0.01 0.40 0.02 0.00 -1.25 0.00 0.00 55.69 54.87 1wnb s MET 245 Cb -0.12 -0.32 0.08 0.00 2.84 0.00 0.00 34.83 37.31 1wnb s MET 245 CO -0.11 -0.26 -0.00 -2.00 -0.65 0.00 0.00 175.02 171.99 1wnb s GLU 246 N 1.80 1.58 -0.30 4.11 -6.30 -0.59 -0.36 118.70 118.63 1wnb s GLU 246 Ca -0.01 -1.44 0.08 0.00 -2.50 0.00 0.00 54.97 51.10 1wnb s GLU 246 Cb -0.12 -2.83 0.50 0.00 0.00 0.00 0.00 34.13 31.68 1wnb s GLU 246 CO -0.04 -0.78 1.46 1.28 0.02 0.00 0.00 175.26 177.19 1wnb n LEU 247 N 4.47 4.23 0.00 2.70 4.77 0.34 -2.12 117.00 131.39 1wnb n LEU 247 Ca -0.05 -3.87 0.00 0.00 -0.03 0.00 0.00 56.01 52.06 1wnb n LEU 247 Cb 0.42 -0.63 0.00 0.00 -2.33 0.00 0.00 43.42 40.89 1wnb n LEU 247 CO 0.19 1.34 0.00 0.61 -1.33 0.00 0.00 177.39 178.20 1wnb n GLY 248 N -1.10 0.78 3.43 -0.72 0.00 -1.26 -3.98 105.19 102.34 1wnb n GLY 248 Ca 0.34 -1.88 -0.16 0.00 0.00 0.00 0.00 46.02 44.32 1wnb n GLY 248 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1wnb s GLY 249 N -0.97 1.72 -0.38 -0.02 0.00 -1.22 -4.39 107.32 102.06 1wnb s GLY 249 Ca 0.00 -1.67 0.02 0.00 0.00 0.00 0.00 44.72 43.07 1wnb s GLY 249 CO 0.00 -1.13 0.29 1.25 0.00 0.00 0.00 173.10 173.51 1wnb s LYS 250 N -3.17 0.71 0.05 2.90 2.47 -1.26 -4.71 119.74 116.73 1wnb s LYS 250 Ca 0.33 -1.60 -0.30 0.00 -1.56 0.00 0.00 55.97 52.84 1wnb s LYS 250 Cb 0.00 -1.25 -0.08 0.00 -1.46 0.00 0.00 37.83 35.04 1wnb s LYS 250 CO 0.22 -1.29 1.66 0.00 0.16 0.00 0.00 175.35 176.10 1wnb s ALA 251 N 0.68 3.67 0.12 3.13 0.00 -1.26 -4.93 121.76 123.18 1wnb s ALA 251 Ca 0.24 1.17 -0.30 0.00 0.00 0.00 0.00 51.96 53.07 1wnb s ALA 251 Cb -0.11 -3.71 -0.06 0.00 0.00 0.00 0.00 23.12 19.25 1wnb s ALA 251 CO -0.08 -1.16 0.96 -1.25 0.00 0.00 0.00 175.76 174.24 1wnb s PRO 252 N 2.89 4.71 -0.31 0.00 0.04 -1.26 -3.03 135.00 138.04 1wnb s PRO 252 Ca 0.74 1.46 -0.03 0.00 0.04 0.00 0.00 61.00 63.22 1wnb s PRO 252 Cb -0.39 -3.36 0.05 0.00 0.04 0.00 0.00 34.50 30.84 1wnb s PRO 252 CO 0.32 0.24 0.03 0.08 0.04 0.00 0.00 177.00 177.71 1wnb s VAL 253 N -0.12 3.13 -0.40 -0.36 1.01 0.46 -1.41 120.40 122.71 1wnb s VAL 253 Ca 0.46 -1.40 -0.15 0.00 0.00 0.00 0.00 61.98 60.90 1wnb s VAL 253 Cb -0.24 -2.82 0.01 0.00 0.00 0.00 0.00 36.38 33.33 1wnb s VAL 253 CO 0.30 -0.16 0.31 -0.63 0.00 0.00 0.00 175.10 174.92 1wnb s ILE 254 N 1.27 5.24 -0.31 2.22 1.01 0.21 -0.89 121.20 129.96 1wnb s ILE 254 Ca -0.04 -0.52 -0.05 0.00 0.00 0.00 0.00 60.65 60.04 1wnb s ILE 254 Cb -0.20 -3.90 0.03 0.00 0.01 0.00 0.00 42.46 38.40 1wnb s ILE 254 CO -0.01 -0.26 0.06 -0.69 0.00 0.00 0.00 174.94 174.04 1wnb s VAL 255 N 1.75 3.59 0.45 2.92 1.01 0.69 0.63 120.40 131.44 1wnb s VAL 255 Ca 0.06 -1.01 -0.08 0.00 0.00 0.00 0.00 61.98 60.95 1wnb s VAL 255 Cb -0.18 -2.95 -0.05 0.00 0.00 0.00 0.00 36.38 33.20 1wnb s VAL 255 CO 0.11 -0.03 0.79 -0.36 0.00 0.00 0.00 175.10 175.61 1wnb s PHE 256 N 1.40 3.52 0.60 5.22 0.40 -0.64 -0.27 117.98 128.21 1wnb s PHE 256 Ca -0.01 0.94 0.28 0.00 -0.60 0.00 0.00 56.93 57.55 1wnb s PHE 256 Cb -0.18 -2.39 1.34 0.00 0.51 0.00 0.00 43.02 42.30 1wnb s PHE 256 CO 0.01 -0.21 1.75 -0.44 0.70 0.00 0.00 175.22 177.03 1wnb h ASP 257 N 0.71 0.00 -0.55 1.36 3.32 -1.88 -0.72 116.42 118.66 1wnb h ASP 257 Ca -0.47 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.58 1wnb h ASP 257 Cb 1.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.75 1wnb h ASP 257 CO 0.63 0.00 0.00 -0.90 -1.72 0.00 0.00 179.24 177.25 1wnb n ASP 258 N -3.51 3.45 -4.75 6.45 5.75 -1.26 -4.89 116.55 117.79 1wnb n ASP 258 Ca 0.11 -1.98 -0.35 0.00 -0.01 0.00 0.00 54.79 52.56 1wnb n ASP 258 Cb 0.84 -0.36 0.06 0.00 -1.03 0.00 0.00 41.12 40.63 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 -1.27 2.38 -0.73 2.12 0.00 -0.28 -3.69 121.76 120.28 1wnb s ALA 259 Ca 0.42 0.84 -0.26 0.00 0.00 0.00 0.00 51.96 52.96 1wnb s ALA 259 Cb 0.23 -3.42 0.01 0.00 0.00 0.00 0.00 23.12 19.94 1wnb s ALA 259 CO 0.31 -1.43 1.53 0.34 0.00 0.00 0.00 175.76 176.51 1wnb s ASP 260 N -2.01 5.83 0.21 0.00 -1.08 -1.26 -4.86 116.67 113.50 1wnb s ASP 260 Ca 0.73 -0.28 -0.09 0.00 -0.52 0.00 0.00 52.55 52.39 1wnb s ASP 260 Cb -0.27 -2.55 0.16 0.00 -1.46 0.00 0.00 42.92 38.80 1wnb s ASP 260 CO 0.39 -2.05 1.83 0.40 0.52 0.00 0.00 175.17 176.26 1wnb h ILE 261 N 6.46 1.24 -0.14 4.11 1.08 -1.95 -1.79 117.51 126.51 1wnb h ILE 261 Ca -0.21 -0.60 -0.03 0.00 -0.39 0.00 0.00 64.86 63.63 1wnb h ILE 261 Cb 1.08 0.18 -0.01 0.00 -3.07 0.00 0.00 36.82 35.01 1wnb h ILE 261 CO 1.27 0.27 -0.04 -0.33 -0.69 0.00 0.00 178.15 178.63 1wnb h GLU 262 N 1.11 0.21 -0.05 2.37 5.08 -2.00 -1.14 114.58 120.15 1wnb h GLU 262 Ca 0.28 -0.03 -0.19 0.00 -1.00 0.00 0.00 59.36 58.42 1wnb h GLU 262 Cb 0.04 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 1wnb h GLU 262 CO -0.04 0.27 -0.77 0.00 -1.00 0.00 0.00 179.01 177.46 1wnb h ALA 263 N 1.76 0.56 -0.51 3.43 0.00 -1.75 -1.37 119.26 121.39 1wnb h ALA 263 Ca 0.05 -0.63 -0.07 0.00 0.00 0.00 0.00 54.91 54.25 1wnb h ALA 263 Cb 0.21 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1wnb h ALA 263 CO 0.01 0.79 0.03 0.28 0.00 0.00 0.00 179.25 180.36 1wnb h VAL 264 N 0.24 1.26 0.42 0.00 2.07 -0.82 -0.22 116.25 119.19 1wnb h VAL 264 Ca -0.04 -1.03 -0.02 0.00 0.82 0.00 0.00 66.70 66.43 1wnb h VAL 264 Cb 1.36 0.93 0.00 0.00 -1.52 0.00 0.00 31.29 32.07 1wnb h VAL 264 CO 0.13 0.37 -0.20 0.58 0.02 0.00 0.00 177.57 178.47 1wnb h VAL 265 N 0.74 0.54 -0.97 2.57 2.07 -1.08 0.14 116.25 120.27 1wnb h VAL 265 Ca 0.15 -0.41 0.24 0.00 0.82 0.00 0.00 66.70 67.49 1wnb h VAL 265 Cb 0.48 0.73 -0.13 0.00 -1.52 0.00 0.00 31.29 30.85 1wnb h VAL 265 CO 0.02 0.07 0.52 -0.08 0.02 0.00 0.00 177.57 178.12 1wnb h GLU 266 N -0.82 0.48 -0.02 1.57 4.81 -1.27 -0.07 114.58 119.27 1wnb h GLU 266 Ca -0.06 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.12 1wnb h GLU 266 Cb 0.54 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.82 1wnb h GLU 266 CO 0.09 0.32 -0.07 0.78 -0.73 0.00 0.00 179.01 179.41 1wnb h GLY 267 N 0.50 0.08 2.00 1.92 0.00 -0.70 -3.22 103.07 103.65 1wnb h GLY 267 Ca 0.62 -0.11 -0.08 0.00 0.00 0.00 0.00 47.33 47.77 1wnb h GLY 267 CO -0.50 0.10 -0.37 -2.08 0.00 0.00 0.00 176.54 173.69 1wnb h VAL 268 N -0.55 1.26 -0.98 4.60 2.07 -0.50 0.27 116.25 122.42 1wnb h VAL 268 Ca -0.00 -1.26 0.01 0.00 0.82 0.00 0.00 66.70 66.27 1wnb h VAL 268 Cb 0.72 1.68 -0.05 0.00 -1.52 0.00 0.00 31.29 32.12 1wnb h VAL 268 CO 0.01 0.36 0.65 -0.09 0.02 0.00 0.00 177.57 178.52 1wnb h ARG 269 N 0.00 1.28 0.04 1.57 2.43 -1.06 0.18 114.38 118.82 1wnb h ARG 269 Ca -0.00 -0.08 -0.00 0.00 -0.81 0.00 0.00 59.98 59.09 1wnb h ARG 269 Cb 0.65 -0.29 0.00 0.00 -0.42 0.00 0.00 29.97 29.91 1wnb h ARG 269 CO 0.05 0.85 -0.02 1.15 -1.51 0.00 0.00 179.97 180.49 1wnb h THR 270 N 1.32 0.86 0.00 0.20 2.02 -1.52 -3.38 112.91 112.41 1wnb h THR 270 Ca 0.36 -1.53 0.00 0.00 0.77 0.00 0.00 66.41 66.02 1wnb h THR 270 Cb -0.14 1.58 0.00 0.00 -1.74 0.00 0.00 68.15 67.85 1wnb h THR 270 CO -0.08 0.28 0.00 -0.26 0.37 0.00 0.00 175.52 175.82 1wnb h PHE 271 N -0.97 0.00 0.00 3.16 0.04 -0.32 0.97 116.94 119.82 1wnb h PHE 271 Ca -0.01 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.71 1wnb h PHE 271 Cb 0.50 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.64 1wnb h PHE 271 CO 0.12 0.00 -0.32 0.78 -0.60 0.00 0.00 178.31 178.29 1wnb h GLY 272 N 3.72 0.00 0.00 -1.45 0.00 -0.78 -0.36 103.07 104.19 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 -3.12 0.00 -1.74 5.60 4.02 -1.07 -4.19 117.16 116.65 1wnb n TYR 273 Ca 0.02 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.50 1wnb n TYR 273 Cb 0.63 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.95 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 -0.25 2.67 -2.68 -0.72 4.19 0.33 -2.10 117.16 118.61 1wnb n TYR 274 Ca 0.00 0.48 -0.22 0.00 3.31 0.00 0.00 57.90 61.47 1wnb n TYR 274 Cb 0.06 -2.48 0.01 0.00 0.49 0.00 0.00 39.34 37.43 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 0.44 -6.03 -3.18 2.98 5.15 -1.26 -0.32 115.26 113.04 1wnb n ASN 275 Ca 0.03 -0.14 -0.21 0.00 -0.60 0.00 0.00 54.58 53.67 1wnb n ASN 275 Cb 0.38 -4.95 -0.00 0.00 -0.53 0.00 0.00 39.78 34.68 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 -2.71 -1.01 -0.82 5.20 0.00 -0.89 -1.18 120.51 119.10 1wnb n ALA 276 Ca -0.19 0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.34 1wnb n ALA 276 Cb 0.66 -2.55 0.00 0.00 0.00 0.00 0.00 19.45 17.56 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 -1.11 0.59 3.43 0.00 0.00 0.56 -1.01 105.19 107.65 1wnb n GLY 277 Ca -0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.55 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 -1.95 3.25 -3.67 1.61 6.02 -0.32 -3.58 117.38 118.73 1wnb n GLN 278 Ca 0.00 -3.43 -0.14 0.00 -0.01 0.00 0.00 57.00 53.43 1wnb n GLN 278 Cb 0.02 -3.30 -0.08 0.00 1.02 0.00 0.00 30.24 27.89 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 3.50 -0.59 0.16 1.08 -1.08 -1.26 -4.86 116.67 113.62 1wnb s ASP 279 Ca 0.49 1.09 0.24 0.00 -0.52 0.00 0.00 52.55 53.85 1wnb s ASP 279 Cb 0.03 1.10 0.91 0.00 -1.46 0.00 0.00 42.92 43.50 1wnb s ASP 279 CO 0.04 -0.23 1.72 0.00 0.52 0.00 0.00 175.17 177.21 1wnb n THR 281 N -2.00 0.34 -1.38 0.00 -2.24 -1.26 -3.43 114.28 104.31 1wnb n THR 281 Ca 0.04 -0.67 -0.40 0.00 -2.27 0.00 0.00 64.05 60.75 1wnb n THR 281 Cb 0.30 0.90 0.01 0.00 -2.10 0.00 0.00 70.33 69.44 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 0.20 -2.01 -3.05 6.98 0.00 -1.13 -4.71 120.51 116.80 1wnb n ALA 282 Ca 0.04 0.06 -0.44 0.00 0.00 0.00 0.00 53.44 53.09 1wnb n ALA 282 Cb 0.21 -1.66 -0.01 0.00 0.00 0.00 0.00 19.45 17.99 1wnb n ALA 282 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wnb s ALA 283 N -1.69 3.93 -0.28 0.00 0.00 -0.15 -4.23 121.76 119.33 1wnb s ALA 283 Ca 0.63 -3.25 0.12 0.00 0.00 0.00 0.00 51.96 49.46 1wnb s ALA 283 Cb -0.54 -3.94 -0.17 0.00 0.00 0.00 0.00 23.12 18.47 1wnb s ALA 283 CO 0.60 -2.69 0.39 0.00 0.00 0.00 0.00 175.76 174.06 1wnb s ARG 285 N -2.54 0.59 -0.08 0.00 3.52 -1.17 -2.41 118.95 116.85 1wnb s ARG 285 Ca -0.00 -1.08 -0.22 0.00 -0.13 0.00 0.00 55.73 54.30 1wnb s ARG 285 Cb 0.09 -1.63 -0.04 0.00 -1.56 0.00 0.00 34.95 31.81 1wnb s ARG 285 CO 0.52 -1.07 0.64 0.42 -0.81 0.00 0.00 175.30 175.00 1wnb s ILE 286 N 1.49 5.09 -0.34 4.11 1.01 -0.58 -0.41 121.20 131.57 1wnb s ILE 286 Ca 0.12 1.30 -0.11 0.00 0.00 0.00 0.00 60.65 61.96 1wnb s ILE 286 Cb -0.19 -3.98 -0.00 0.00 0.01 0.00 0.00 42.46 38.30 1wnb s ILE 286 CO -0.20 0.27 0.21 -0.31 0.00 0.00 0.00 174.94 174.90 1wnb s TYR 287 N 0.77 3.21 -0.14 3.97 1.51 -0.07 -0.96 117.35 125.64 1wnb s TYR 287 Ca 0.34 -0.50 -0.00 0.00 -1.01 0.00 0.00 57.07 55.90 1wnb s TYR 287 Cb -0.17 -2.43 -0.01 0.00 -0.11 0.00 0.00 41.96 39.24 1wnb s TYR 287 CO 0.16 -0.46 -0.13 0.00 -1.11 0.00 0.00 175.55 174.01 1wnb s ALA 288 N 1.65 2.61 0.50 3.71 0.00 0.01 -0.22 121.76 130.02 1wnb s ALA 288 Ca 0.05 -0.95 -0.24 0.00 0.00 0.00 0.00 51.96 50.82 1wnb s ALA 288 Cb -0.18 -1.26 -0.07 0.00 0.00 0.00 0.00 23.12 21.61 1wnb s ALA 288 CO 0.08 0.12 1.40 -1.14 0.00 0.00 0.00 175.76 176.22 1wnb s GLN 289 N 0.57 3.41 0.48 0.00 0.74 0.63 -1.13 119.66 124.35 1wnb s GLN 289 Ca -0.08 2.35 0.25 0.00 0.05 0.00 0.00 55.36 57.93 1wnb s GLN 289 Cb -0.16 -2.46 1.30 0.00 1.10 0.00 0.00 33.01 32.79 1wnb s GLN 289 CO 0.03 -1.02 1.89 0.87 -0.55 0.00 0.00 175.29 176.51 1wnb h LYS 290 N 1.89 0.17 -0.61 1.67 1.79 -1.07 0.11 116.57 120.52 1wnb h LYS 290 Ca -0.51 -0.01 -0.07 0.00 -2.18 0.00 0.00 60.65 57.88 1wnb h LYS 290 Cb 1.28 -0.04 -0.03 0.00 -1.58 0.00 0.00 32.23 31.87 1wnb h LYS 290 CO 0.59 0.11 0.09 0.78 -1.08 0.00 0.00 179.45 179.94 1wnb h GLY 291 N 0.18 1.08 -0.17 3.86 0.00 -1.89 -3.33 103.07 102.80 1wnb h GLY 291 Ca 0.43 -0.71 0.00 0.00 0.00 0.00 0.00 47.33 47.04 1wnb h GLY 291 CO -0.08 0.66 -0.04 0.29 0.00 0.00 0.00 176.54 177.37 1wnb n ILE 292 N -4.22 0.00 -0.27 2.60 -6.64 -0.12 -4.80 119.36 105.90 1wnb n ILE 292 Ca 0.04 -0.48 -0.11 0.00 -1.77 0.00 0.00 62.75 60.43 1wnb n ILE 292 Cb 0.29 1.04 -0.08 0.00 -1.44 0.00 0.00 39.64 39.45 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 0.42 -1.67 -0.42 4.28 3.20 -0.99 0.08 116.97 121.87 1wnb h TYR 293 Ca 0.00 0.10 -0.02 0.00 3.14 0.00 0.00 58.73 61.95 1wnb h TYR 293 Cb 0.11 0.82 -0.02 0.00 1.54 0.00 0.00 36.73 39.19 1wnb h TYR 293 CO 0.00 -0.43 0.17 -0.44 -1.64 0.00 0.00 178.16 175.82 1wnb h ASP 294 N -0.20 0.58 -0.36 -2.11 3.32 -1.87 0.14 116.42 115.93 1wnb h ASP 294 Ca 0.14 -0.17 0.04 0.00 0.02 0.00 0.00 57.03 57.06 1wnb h ASP 294 Cb 0.52 -0.15 -0.04 0.00 0.22 0.00 0.00 39.33 39.88 1wnb h ASP 294 CO -0.77 0.59 0.11 0.74 -1.72 0.00 0.00 179.24 178.20 1wnb h THR 295 N 0.54 0.88 -0.68 0.35 2.02 -1.80 -1.66 112.91 112.55 1wnb h THR 295 Ca 0.14 -0.09 -0.00 0.00 0.77 0.00 0.00 66.41 67.23 1wnb h THR 295 Cb 0.19 0.60 -0.03 0.00 -1.74 0.00 0.00 68.15 67.17 1wnb h THR 295 CO -0.01 0.05 0.41 0.25 0.37 0.00 0.00 175.52 176.58 1wnb h LEU 296 N 0.26 0.82 -0.48 2.58 5.85 -0.39 -0.73 115.31 123.22 1wnb h LEU 296 Ca 0.17 -0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.82 1wnb h LEU 296 Cb 0.15 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 1wnb h LEU 296 CO -0.18 0.65 0.28 0.58 -0.34 0.00 0.00 178.44 179.43 1wnb h VAL 297 N 0.93 1.15 0.38 1.05 2.07 -0.55 0.12 116.25 121.40 1wnb h VAL 297 Ca 0.24 -0.36 -0.02 0.00 0.82 0.00 0.00 66.70 67.39 1wnb h VAL 297 Cb -0.02 0.52 0.00 0.00 -1.52 0.00 0.00 31.29 30.27 1wnb h VAL 297 CO -0.05 0.16 -0.18 -0.08 0.02 0.00 0.00 177.57 177.44 1wnb h GLU 298 N 0.64 -0.49 -0.73 1.57 4.81 -1.02 -1.79 114.58 117.57 1wnb h GLU 298 Ca 0.17 0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.42 1wnb h GLU 298 Cb 0.00 0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.46 1wnb h GLU 298 CO -0.03 -0.27 0.40 0.87 -0.73 0.00 0.00 179.01 179.25 1wnb h LYS 299 N -0.60 1.02 -0.38 1.92 1.57 -1.13 -2.76 116.57 116.21 1wnb h LYS 299 Ca -0.05 -0.12 -0.06 0.00 -1.87 0.00 0.00 60.65 58.55 1wnb h LYS 299 Cb 0.44 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 1wnb h LYS 299 CO 0.09 0.76 0.02 1.25 -0.57 0.00 0.00 179.45 180.99 1wnb h LEU 300 N 1.01 0.64 -1.38 2.94 5.85 -0.89 -2.02 115.31 121.46 1wnb h LEU 300 Ca 0.26 -0.29 0.03 0.00 0.84 0.00 0.00 57.88 58.71 1wnb h LEU 300 Cb 0.03 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 40.86 1wnb h LEU 300 CO -0.04 0.77 0.44 1.23 -0.34 0.00 0.00 178.44 180.50 1wnb h GLY 301 N 0.48 0.92 1.09 3.75 0.00 -1.33 0.18 103.07 108.16 1wnb h GLY 301 Ca 0.11 -0.32 -0.12 0.00 0.00 0.00 0.00 47.33 46.99 1wnb h GLY 301 CO 0.02 0.29 -0.16 0.00 0.00 0.00 0.00 176.54 176.68 1wnb h ALA 302 N 1.60 0.69 -0.33 3.60 0.00 -1.30 -2.86 119.26 120.66 1wnb h ALA 302 Ca 0.26 -0.37 -0.10 0.00 0.00 0.00 0.00 54.91 54.70 1wnb h ALA 302 Cb 0.02 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1wnb h ALA 302 CO -0.07 0.64 -0.19 0.00 0.00 0.00 0.00 179.25 179.63 1wnb h ALA 303 N 0.88 0.47 -0.04 0.00 0.00 -0.90 -3.08 119.26 116.59 1wnb h ALA 303 Ca 0.12 -0.36 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 1wnb h ALA 303 Cb 0.74 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.41 1wnb h ALA 303 CO 0.06 0.40 -0.07 0.28 0.00 0.00 0.00 179.25 179.92 1wnb h VAL 304 N 0.48 1.08 0.00 0.00 2.07 -0.71 -2.68 116.25 116.48 1wnb h VAL 304 Ca 0.07 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 67.24 1wnb h VAL 304 Cb 0.73 1.13 0.00 0.00 -1.52 0.00 0.00 31.29 31.63 1wnb h VAL 304 CO 0.05 0.11 0.00 0.00 0.02 0.00 0.00 177.57 177.75 1wnb h ALA 305 N 1.87 1.00 -0.00 1.67 0.00 -1.41 -2.38 119.26 120.01 1wnb h ALA 305 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1wnb h ALA 305 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1wnb h ALA 305 CO 0.01 0.00 -0.16 0.25 0.00 0.00 0.00 179.25 179.35 1wnb n THR 306 N -2.52 0.00 -1.69 0.00 -2.24 -1.01 -4.90 114.28 101.92 1wnb n THR 306 Ca 0.04 -0.06 -0.43 0.00 -2.27 0.00 0.00 64.05 61.33 1wnb n THR 306 Cb 0.42 -0.03 -0.03 0.00 -2.10 0.00 0.00 70.33 68.59 1wnb n THR 306 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1wnb n LEU 307 N -1.01 3.83 -4.51 3.22 4.77 -0.90 -4.91 117.00 117.50 1wnb n LEU 307 Ca 0.13 1.02 -0.42 0.00 -0.03 0.00 0.00 56.01 56.71 1wnb n LEU 307 Cb 0.30 -1.52 -0.10 0.00 -2.33 0.00 0.00 43.42 39.77 1wnb n LEU 307 CO 0.25 0.08 -0.01 -0.75 -1.33 0.00 0.00 177.39 175.64 1wnb s LYS 308 N 2.09 3.29 0.31 3.23 2.36 -1.26 -4.93 119.74 124.82 1wnb s LYS 308 Ca 0.80 -0.70 -0.09 0.00 -2.55 0.00 0.00 55.97 53.43 1wnb s LYS 308 Cb -0.54 -3.89 -0.07 0.00 -1.05 0.00 0.00 37.83 32.29 1wnb s LYS 308 CO 0.37 -0.64 0.64 -1.12 1.55 0.00 0.00 175.35 176.15 1wnb s SER 309 N 1.74 6.57 0.00 1.43 0.01 -1.26 -0.17 113.70 122.02 1wnb s SER 309 Ca 0.09 0.98 0.00 0.00 1.31 0.00 0.00 55.95 58.32 1wnb s SER 309 Cb -0.17 -2.25 0.00 0.00 0.21 0.00 0.00 66.02 63.80 1wnb s SER 309 CO 0.11 -0.21 0.00 0.61 0.41 0.00 0.00 173.24 174.16 1wnb n GLY 310 N -0.69 -1.21 3.68 3.44 0.00 -1.25 -4.95 105.19 104.21 1wnb n GLY 310 Ca 0.01 -1.31 -0.54 0.00 0.00 0.00 0.00 46.02 44.18 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 -0.11 -0.11 -0.33 4.61 0.00 -1.26 -4.85 120.51 118.45 1wnb n ALA 311 Ca 0.00 0.40 0.22 0.00 0.00 0.00 0.00 53.44 54.06 1wnb n ALA 311 Cb 0.00 -2.24 0.48 0.00 0.00 0.00 0.00 19.45 17.68 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 6.93 0.43 0.00 0.00 0.11 -1.88 -0.76 132.00 136.83 1wnb h PRO 312 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1wnb h PRO 312 Cb 1.31 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1wnb h PRO 312 CO 0.92 0.28 0.00 -0.40 -0.21 0.00 0.00 178.00 178.59 1wnb n ASP 313 N -4.70 0.00 -4.73 -2.05 5.68 -1.26 -0.06 116.55 109.43 1wnb n ASP 313 Ca 0.26 -1.69 -0.38 0.00 -0.50 0.00 0.00 54.79 52.48 1wnb n ASP 313 Cb 0.86 0.00 -0.06 0.00 -1.14 0.00 0.00 41.12 40.77 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 -1.26 6.65 0.49 -1.12 -1.08 -0.29 -4.91 116.67 115.14 1wnb s ASP 314 Ca 0.11 0.77 0.17 0.00 -0.52 0.00 0.00 52.55 53.08 1wnb s ASP 314 Cb 0.05 -2.27 1.19 0.00 -1.46 0.00 0.00 42.92 40.43 1wnb s ASP 314 CO 0.08 0.03 2.08 -0.08 0.52 0.00 0.00 175.17 177.80 1wnb h GLU 315 N 6.62 0.00 0.00 4.34 4.57 -1.87 -2.29 114.58 125.95 1wnb h GLU 315 Ca -0.42 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.76 1wnb h GLU 315 Cb 1.18 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.77 1wnb h GLU 315 CO 0.75 0.09 0.00 0.66 -1.18 0.00 0.00 179.01 179.33 1wnb h SER 316 N 0.00 0.00 -2.99 1.04 4.64 -1.93 -3.46 113.55 110.84 1wnb h SER 316 Ca -0.00 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.79 1wnb h SER 316 Cb 0.17 0.00 0.06 0.00 -0.31 0.00 0.00 62.40 62.32 1wnb h SER 316 CO 0.01 0.00 0.90 -0.89 -0.87 0.00 0.00 176.83 175.99 1wnb s THR 317 N -3.31 2.31 -0.03 2.95 2.01 -0.86 -4.79 115.64 113.92 1wnb s THR 317 Ca 0.06 0.24 0.03 0.00 0.31 0.00 0.00 61.69 62.32 1wnb s THR 317 Cb 0.07 -3.15 -0.04 0.00 0.01 0.00 0.00 72.50 69.39 1wnb s THR 317 CO 0.62 0.03 0.01 -0.62 -0.69 0.00 0.00 174.62 173.97 1wnb n GLU 318 N 3.28 3.30 -3.96 4.92 1.02 0.76 -4.86 120.64 125.09 1wnb n GLU 318 Ca 0.12 -0.00 -0.30 0.00 -0.02 0.00 0.00 57.16 56.96 1wnb n GLU 318 Cb 0.37 -1.08 -0.16 0.00 -0.02 0.00 0.00 31.44 30.55 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 -4.29 2.20 0.89 -4.62 2.96 -0.83 -4.78 118.68 110.21 1wnb s LEU 319 Ca -0.02 -0.90 -0.11 0.00 -0.22 0.00 0.00 54.13 52.88 1wnb s LEU 319 Cb 0.01 -1.15 0.19 0.00 0.50 0.00 0.00 46.19 45.73 1wnb s LEU 319 CO 0.13 -0.17 1.23 -0.83 -1.32 0.00 0.00 176.35 175.39 1wnb s GLY 320 N 1.45 1.78 0.99 7.98 0.00 -1.26 -3.82 107.32 114.44 1wnb s GLY 320 Ca -0.02 -1.43 -0.14 0.00 0.00 0.00 0.00 44.72 43.13 1wnb s GLY 320 CO -0.08 -0.71 1.14 2.56 0.00 0.00 0.00 173.10 176.01 1wnb s PRO 321 N -5.67 0.51 0.87 2.90 0.04 -1.26 -4.65 135.00 127.75 1wnb s PRO 321 Ca 0.72 0.23 -0.12 0.00 0.04 0.00 0.00 61.00 61.88 1wnb s PRO 321 Cb -0.04 -1.77 0.12 0.00 0.04 0.00 0.00 34.50 32.85 1wnb s PRO 321 CO 0.50 -2.61 1.13 -0.51 0.04 0.00 0.00 177.00 175.56 1wnb s LEU 322 N -6.29 2.19 0.42 -3.56 1.43 -0.37 -4.76 118.68 107.75 1wnb s LEU 322 Ca 0.66 1.00 0.23 0.00 -1.03 0.00 0.00 54.13 55.00 1wnb s LEU 322 Cb -0.14 -3.41 0.65 0.00 0.03 0.00 0.00 46.19 43.32 1wnb s LEU 322 CO 0.55 -2.35 1.71 0.77 0.23 0.00 0.00 176.35 177.26 1wnb h SER 323 N -1.35 0.00 -5.15 2.29 4.64 -1.88 -3.42 113.55 108.67 1wnb h SER 323 Ca -0.49 0.00 0.10 0.00 -0.47 0.00 0.00 61.79 60.93 1wnb h SER 323 Cb 1.32 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.36 1wnb h SER 323 CO 0.62 0.19 0.36 -0.94 -0.87 0.00 0.00 176.83 176.18 1wnb s SER 324 N -6.17 -0.16 0.18 4.97 1.04 -1.26 -4.80 113.70 107.50 1wnb s SER 324 Ca 0.03 -0.64 -0.11 0.00 0.48 0.00 0.00 55.95 55.71 1wnb s SER 324 Cb 0.08 0.65 0.10 0.00 0.10 0.00 0.00 66.02 66.95 1wnb s SER 324 CO 0.65 -1.22 1.76 0.25 0.98 0.00 0.00 173.24 175.66 1wnb h LEU 325 N 2.00 0.88 -0.15 2.42 5.85 -1.96 -2.62 115.31 121.72 1wnb h LEU 325 Ca -0.24 -0.15 -0.05 0.00 0.84 0.00 0.00 57.88 58.28 1wnb h LEU 325 Cb 1.24 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 42.04 1wnb h LEU 325 CO 0.28 0.79 -0.08 0.00 -0.34 0.00 0.00 178.44 179.09 1wnb h ALA 326 N 1.13 0.21 -0.68 1.25 0.00 -2.00 -2.60 119.26 116.58 1wnb h ALA 326 Ca 0.22 -0.28 0.05 0.00 0.00 0.00 0.00 54.91 54.90 1wnb h ALA 326 Cb 0.16 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.85 1wnb h ALA 326 CO -0.02 0.03 0.40 1.25 0.00 0.00 0.00 179.25 180.90 1wnb h HIS 327 N -0.01 0.74 -0.85 0.00 -0.00 -1.96 -1.83 115.15 111.23 1wnb h HIS 327 Ca 0.03 0.02 0.13 0.00 -0.00 0.00 0.00 60.37 60.55 1wnb h HIS 327 Cb 0.56 -0.23 -0.09 0.00 -0.00 0.00 0.00 27.41 27.65 1wnb h HIS 327 CO 0.07 0.38 0.46 1.25 -0.00 0.00 0.00 177.93 180.10 1wnb h LEU 328 N 0.75 0.61 -0.28 0.26 5.85 -1.32 -1.18 115.31 120.00 1wnb h LEU 328 Ca 0.29 0.07 -0.03 0.00 0.84 0.00 0.00 57.88 59.06 1wnb h LEU 328 Cb 0.11 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 1wnb h LEU 328 CO -0.15 0.29 0.07 -0.33 -0.34 0.00 0.00 178.44 177.98 1wnb h GLU 329 N 0.70 0.44 0.32 1.25 4.39 -1.04 -1.91 114.58 118.74 1wnb h GLU 329 Ca 0.45 -0.11 0.00 0.00 0.34 0.00 0.00 59.36 60.04 1wnb h GLU 329 Cb 0.56 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 29.12 1wnb h GLU 329 CO -0.32 0.53 -0.38 -0.09 -1.16 0.00 0.00 179.01 177.59 1wnb h ARG 330 N 0.28 -0.71 0.16 2.33 2.43 -0.85 -0.42 114.38 117.59 1wnb h ARG 330 Ca 0.09 0.05 0.01 0.00 -0.81 0.00 0.00 59.98 59.32 1wnb h ARG 330 Cb 0.28 0.16 -0.04 0.00 -0.42 0.00 0.00 29.97 29.95 1wnb h ARG 330 CO 0.00 -0.47 -0.49 0.28 -1.51 0.00 0.00 179.97 177.78 1wnb h VAL 331 N -0.74 0.06 -0.99 0.20 2.07 -1.26 -2.34 116.25 113.24 1wnb h VAL 331 Ca -0.02 0.00 0.20 0.00 0.82 0.00 0.00 66.70 67.70 1wnb h VAL 331 Cb 0.68 0.06 -0.19 0.00 -1.52 0.00 0.00 31.29 30.32 1wnb h VAL 331 CO -0.10 0.00 -0.24 1.23 0.02 0.00 0.00 177.57 178.48 1wnb h GLY 332 N -0.75 0.73 1.93 2.17 0.00 -1.27 -1.87 103.07 104.01 1wnb h GLY 332 Ca -0.00 0.32 -0.09 0.00 0.00 0.00 0.00 47.33 47.56 1wnb h GLY 332 CO -0.25 -0.38 -0.42 0.50 0.00 0.00 0.00 176.54 175.99 1wnb h LYS 333 N 0.00 0.08 -0.68 4.80 1.57 -0.86 -1.72 116.57 119.76 1wnb h LYS 333 Ca 0.48 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 59.21 1wnb h LYS 333 Cb 0.74 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.02 1wnb h LYS 333 CO -1.02 0.48 0.35 0.00 -0.57 0.00 0.00 179.45 178.70 1wnb h ALA 334 N 1.51 0.87 -0.08 3.86 0.00 -0.87 -1.46 119.26 123.10 1wnb h ALA 334 Ca 0.00 -0.12 -0.19 0.00 0.00 0.00 0.00 54.91 54.60 1wnb h ALA 334 Cb 0.77 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 1wnb h ALA 334 CO 0.06 0.41 -0.75 0.28 0.00 0.00 0.00 179.25 179.25 1wnb h VAL 335 N 0.93 1.38 -0.20 0.00 2.07 -0.76 -2.58 116.25 117.08 1wnb h VAL 335 Ca 0.24 -2.15 -0.13 0.00 0.82 0.00 0.00 66.70 65.47 1wnb h VAL 335 Cb 0.07 2.13 -0.01 0.00 -1.52 0.00 0.00 31.29 31.96 1wnb h VAL 335 CO -0.03 0.65 -0.43 -0.33 0.02 0.00 0.00 177.57 177.45 1wnb h GLU 336 N 0.29 0.49 0.01 1.57 4.39 -1.29 -2.59 114.58 117.45 1wnb h GLU 336 Ca -0.03 -0.26 0.01 0.00 0.34 0.00 0.00 59.36 59.42 1wnb h GLU 336 Cb 1.33 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.97 1wnb h GLU 336 CO 0.13 0.83 -0.09 0.93 -1.16 0.00 0.00 179.01 179.65 1wnb h GLU 337 N 0.40 -0.16 -0.28 2.33 5.08 -1.13 -1.98 114.58 118.86 1wnb h GLU 337 Ca 0.03 0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.47 1wnb h GLU 337 Cb 0.92 0.04 -0.08 0.00 0.50 0.00 0.00 28.75 30.13 1wnb h GLU 337 CO 0.08 -0.10 -0.29 0.00 -1.00 0.00 0.00 179.01 177.70 1wnb h ALA 338 N 0.80 -0.19 -0.77 3.43 0.00 -1.36 -2.90 119.26 118.27 1wnb h ALA 338 Ca 0.03 0.08 0.11 0.00 0.00 0.00 0.00 54.91 55.13 1wnb h ALA 338 Cb 0.20 0.59 -0.08 0.00 0.00 0.00 0.00 17.79 18.50 1wnb h ALA 338 CO -0.08 -0.71 0.39 0.87 0.00 0.00 0.00 179.25 179.72 1wnb h LYS 339 N -0.28 0.61 0.00 0.00 1.57 -1.35 -0.32 116.57 116.80 1wnb h LYS 339 Ca 0.14 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 1wnb h LYS 339 Cb 0.51 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.68 1wnb h LYS 339 CO -0.43 0.41 0.00 0.00 -0.57 0.00 0.00 179.45 178.85 1wnb n ALA 340 N -2.42 1.61 0.19 3.86 0.00 -0.75 -2.56 120.51 120.44 1wnb n ALA 340 Ca 0.13 -0.05 0.06 0.00 0.00 0.00 0.00 53.44 53.58 1wnb n ALA 340 Cb 0.32 -1.17 0.31 0.00 0.00 0.00 0.00 19.45 18.91 1wnb n ALA 340 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wnb h THR 341 N 0.00 0.84 0.00 0.00 1.03 -0.99 -3.48 112.91 110.32 1wnb h THR 341 Ca 0.00 -1.56 0.00 0.00 -0.01 0.00 0.00 66.41 64.84 1wnb h THR 341 Cb 0.12 1.97 0.00 0.00 -1.07 0.00 0.00 68.15 69.17 1wnb h THR 341 CO 0.00 0.37 0.00 0.61 -0.01 0.00 0.00 175.52 176.49 1wnb n GLY 342 N 0.34 2.34 0.00 2.99 0.00 -1.06 -4.86 105.19 104.95 1wnb n GLY 342 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.00 -3.66 1.61 -0.00 -1.26 -5.01 115.22 104.90 1wnb n HIS 343 Ca 0.00 -0.23 -0.38 0.00 -0.00 0.00 0.00 57.72 57.11 1wnb n HIS 343 Cb 0.00 -0.02 -0.12 0.00 -0.00 0.00 0.00 29.99 29.85 1wnb n HIS 343 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.34 176.76 1wnb s ILE 344 N -0.47 4.76 -0.02 0.61 1.01 -1.26 -4.52 121.20 121.31 1wnb s ILE 344 Ca 0.00 -0.14 -0.20 0.00 0.00 0.00 0.00 60.65 60.32 1wnb s ILE 344 Cb 0.00 -3.31 -0.05 0.00 0.01 0.00 0.00 42.46 39.11 1wnb s ILE 344 CO 0.00 0.21 0.57 -0.54 0.00 0.00 0.00 174.94 175.19 1wnb s LYS 345 N 1.67 4.30 -0.47 2.79 1.02 -0.19 -4.69 119.74 124.17 1wnb s LYS 345 Ca 0.06 0.68 -0.27 0.00 0.02 0.00 0.00 55.97 56.46 1wnb s LYS 345 Cb -0.16 -3.35 0.03 0.00 -0.52 0.00 0.00 37.83 33.82 1wnb s LYS 345 CO 0.07 0.34 1.02 0.08 -0.92 0.00 0.00 175.35 175.94 1wnb s VAL 346 N -0.08 4.36 -0.03 3.17 1.01 -1.26 -1.05 120.40 126.52 1wnb s VAL 346 Ca 0.30 0.97 -0.17 0.00 0.00 0.00 0.00 61.98 63.08 1wnb s VAL 346 Cb -0.18 -4.51 -0.32 0.00 0.00 0.00 0.00 36.38 31.37 1wnb s VAL 346 CO 0.16 -0.90 0.84 0.40 0.00 0.00 0.00 175.10 175.59 1wnb h ILE 347 N 6.14 1.26 -3.38 2.22 1.08 -1.42 -3.48 117.51 119.94 1wnb h ILE 347 Ca -0.24 -2.57 -0.09 0.00 -0.39 0.00 0.00 64.86 61.58 1wnb h ILE 347 Cb 1.07 3.00 -0.17 0.00 -3.07 0.00 0.00 36.82 37.65 1wnb h ILE 347 CO 1.07 0.77 -0.27 0.28 -0.69 0.00 0.00 178.15 179.31 1wnb s THR 348 N -2.52 0.09 0.00 -0.27 -1.32 -1.22 -4.98 115.64 105.42 1wnb s THR 348 Ca -0.13 -0.74 0.00 0.00 -1.21 0.00 0.00 61.69 59.61 1wnb s THR 348 Cb 0.03 -0.97 0.00 0.00 -1.51 0.00 0.00 72.50 70.05 1wnb s THR 348 CO 0.86 -0.41 0.00 0.61 -2.21 0.00 0.00 174.62 173.48 1wnb n GLY 349 N 0.51 0.64 1.56 6.08 0.00 -1.23 -1.87 105.19 110.89 1wnb n GLY 349 Ca -0.18 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 44.96 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 0.72 3.40 -0.02 0.00 -1.26 -5.00 105.19 103.04 1wnb n GLY 350 Ca 0.00 -0.70 -0.10 0.00 0.00 0.00 0.00 46.02 45.22 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 -3.57 1.21 0.28 1.61 2.02 -1.26 -5.01 118.70 113.98 1wnb s GLU 351 Ca 0.00 -0.72 -0.29 0.00 0.02 0.00 0.00 54.97 53.98 1wnb s GLU 351 Cb 0.00 0.51 -0.10 0.00 0.10 0.00 0.00 34.13 34.64 1wnb s GLU 351 CO 0.00 -0.50 1.20 0.15 0.02 0.00 0.00 175.26 176.13 1wnb s LYS 352 N -3.82 4.50 0.38 1.61 1.02 -1.26 -0.83 119.74 121.35 1wnb s LYS 352 Ca 0.05 1.98 -0.26 0.00 0.02 0.00 0.00 55.97 57.75 1wnb s LYS 352 Cb 0.00 -3.15 -0.09 0.00 -0.52 0.00 0.00 37.83 34.07 1wnb s LYS 352 CO -0.09 -0.00 1.25 0.50 -0.92 0.00 0.00 175.35 176.09 1wnb s ARG 353 N -1.30 4.10 0.45 1.68 3.52 0.37 -4.82 118.95 122.96 1wnb s ARG 353 Ca 0.48 2.05 -0.24 0.00 -0.13 0.00 0.00 55.73 57.89 1wnb s ARG 353 Cb -0.35 -2.82 -0.07 0.00 -1.56 0.00 0.00 34.95 30.15 1wnb s ARG 353 CO 0.44 -0.34 1.29 0.15 -0.81 0.00 0.00 175.30 176.03 1wnb s LYS 354 N -2.13 3.71 0.00 5.12 1.02 -1.26 -4.76 119.74 121.44 1wnb s LYS 354 Ca 0.55 2.10 0.00 0.00 0.02 0.00 0.00 55.97 58.64 1wnb s LYS 354 Cb -0.36 -2.55 0.00 0.00 -0.52 0.00 0.00 37.83 34.40 1wnb s LYS 354 CO 0.46 -0.69 0.00 0.41 -0.92 0.00 0.00 175.35 174.61 1wnb n GLY 355 N 0.62 -0.98 3.88 -3.33 0.00 -1.26 -5.03 105.19 99.09 1wnb n GLY 355 Ca 0.06 -2.15 -0.21 0.00 0.00 0.00 0.00 46.02 43.73 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 -4.00 5.22 0.12 1.61 0.01 -1.26 -4.94 114.94 111.70 1wnb s ASN 356 Ca 0.00 -0.61 0.00 0.00 -0.71 0.00 0.00 52.86 51.54 1wnb s ASN 356 Cb 0.00 -0.75 0.00 0.00 0.41 0.00 0.00 41.25 40.91 1wnb s ASN 356 CO 0.00 -0.54 0.00 0.61 -1.51 0.00 0.00 177.10 175.66 1wnb n GLY 357 N -1.51 -2.81 2.78 0.66 0.00 -1.21 -4.57 105.19 98.53 1wnb n GLY 357 Ca 0.02 -1.35 -0.37 0.00 0.00 0.00 0.00 46.02 44.32 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 -2.38 3.10 -2.99 1.61 4.01 0.04 -4.90 117.16 115.66 1wnb n TYR 358 Ca -0.02 -2.62 -0.40 0.00 -0.16 0.00 0.00 57.90 54.70 1wnb n TYR 358 Cb 0.13 -0.92 -0.04 0.00 -0.31 0.00 0.00 39.34 38.20 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 -3.97 3.52 -0.07 -0.72 1.51 -1.26 -1.23 117.35 115.12 1wnb s TYR 359 Ca 0.49 1.25 -0.00 0.00 -1.01 0.00 0.00 57.07 57.80 1wnb s TYR 359 Cb 0.38 -2.88 -0.03 0.00 -0.11 0.00 0.00 41.96 39.32 1wnb s TYR 359 CO -0.31 -0.03 -0.05 -0.47 -1.11 0.00 0.00 175.55 173.58 1wnb s TYR 360 N 1.28 3.00 0.34 2.71 5.04 -1.26 -0.48 117.35 127.98 1wnb s TYR 360 Ca 0.38 0.06 -0.29 0.00 -2.44 0.00 0.00 57.07 54.78 1wnb s TYR 360 Cb -0.17 -1.74 -0.11 0.00 0.35 0.00 0.00 41.96 40.29 1wnb s TYR 360 CO 0.16 0.36 1.52 0.00 -1.34 0.00 0.00 175.55 176.26 1wnb s ALA 361 N -0.80 3.64 0.18 3.97 0.00 -0.01 -4.84 121.76 123.90 1wnb s ALA 361 Ca 0.12 1.56 -0.32 0.00 0.00 0.00 0.00 51.96 53.32 1wnb s ALA 361 Cb -0.11 -3.62 -0.12 0.00 0.00 0.00 0.00 23.12 19.27 1wnb s ALA 361 CO 0.02 -1.01 1.73 -0.35 0.00 0.00 0.00 175.76 176.15 1wnb n PRO 362 N 1.17 2.67 -4.36 0.00 -0.04 -1.26 -4.27 135.00 128.91 1wnb n PRO 362 Ca 0.04 0.97 -0.32 0.00 -0.04 0.00 0.00 63.50 64.15 1wnb n PRO 362 Cb 0.39 -2.81 -0.16 0.00 -0.04 0.00 0.00 33.50 30.87 1wnb n PRO 362 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 1wnb s THR 363 N 1.51 1.89 -0.16 0.52 2.01 0.51 -3.49 115.64 118.43 1wnb s THR 363 Ca 0.77 -0.85 -0.03 0.00 0.31 0.00 0.00 61.69 61.89 1wnb s THR 363 Cb -0.53 -1.70 -0.02 0.00 0.01 0.00 0.00 72.50 70.26 1wnb s THR 363 CO 0.34 0.51 -0.06 -0.22 -0.69 0.00 0.00 174.62 174.51 1wnb s LEU 364 N 1.10 3.05 -0.11 4.42 2.96 -0.78 -1.71 118.68 127.61 1wnb s LEU 364 Ca -0.01 -0.23 0.03 0.00 -0.22 0.00 0.00 54.13 53.70 1wnb s LEU 364 Cb -0.14 -1.73 -0.01 0.00 0.50 0.00 0.00 46.19 44.81 1wnb s LEU 364 CO -0.07 0.14 -0.20 -0.76 -1.32 0.00 0.00 176.35 174.14 1wnb s LEU 365 N 0.55 2.29 0.18 -0.68 1.43 0.55 -0.94 118.68 122.07 1wnb s LEU 365 Ca -0.04 -0.48 0.10 0.00 -1.03 0.00 0.00 54.13 52.68 1wnb s LEU 365 Cb -0.15 -1.47 -0.04 0.00 0.03 0.00 0.00 46.19 44.56 1wnb s LEU 365 CO 0.03 0.16 -0.18 0.00 0.23 0.00 0.00 176.35 176.59 1wnb s ALA 366 N 0.33 2.69 0.00 4.21 0.00 -0.21 0.52 121.76 129.29 1wnb s ALA 366 Ca -0.16 -1.57 0.00 0.00 0.00 0.00 0.00 51.96 50.23 1wnb s ALA 366 Cb -0.17 -0.49 0.00 0.00 0.00 0.00 0.00 23.12 22.46 1wnb s ALA 366 CO 0.08 0.45 0.00 0.41 0.00 0.00 0.00 175.76 176.70 1wnb n GLY 367 N 0.21 0.53 3.77 0.00 0.00 -0.84 -1.02 105.19 107.85 1wnb n GLY 367 Ca -0.12 -0.07 -0.40 0.00 0.00 0.00 0.00 46.02 45.43 1wnb n GLY 367 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wnb s ALA 368 N -2.00 3.32 0.27 4.61 0.00 -1.03 -4.54 121.76 122.38 1wnb s ALA 368 Ca 0.00 1.33 0.07 0.00 0.00 0.00 0.00 51.96 53.36 1wnb s ALA 368 Cb 0.00 -3.52 -0.03 0.00 0.00 0.00 0.00 23.12 19.56 1wnb s ALA 368 CO 0.00 -0.92 0.20 -0.51 0.00 0.00 0.00 175.76 174.54 1wnb s LEU 369 N -2.39 3.76 0.25 0.00 1.43 -1.26 -4.17 118.68 116.30 1wnb s LEU 369 Ca 0.56 -0.30 -0.04 0.00 -1.03 0.00 0.00 54.13 53.33 1wnb s LEU 369 Cb -0.40 -2.30 0.51 0.00 0.03 0.00 0.00 46.19 44.03 1wnb s LEU 369 CO 0.53 -0.09 1.68 -0.61 0.23 0.00 0.00 176.35 178.09 1wnb h GLN 370 N 1.47 0.25 -0.29 1.70 5.75 -1.95 -1.94 115.11 120.09 1wnb h GLN 370 Ca -0.48 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.01 1wnb h GLN 370 Cb 1.24 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 29.74 1wnb h GLN 370 CO 0.60 0.16 0.00 -0.25 -2.65 0.00 0.00 178.83 176.70 1wnb n ASP 371 N -5.18 1.89 -4.79 -0.69 8.00 -1.26 -4.54 116.55 109.98 1wnb n ASP 371 Ca 0.16 -1.89 -0.35 0.00 0.71 0.00 0.00 54.79 53.42 1wnb n ASP 371 Cb 0.51 -0.19 -0.03 0.00 -0.02 0.00 0.00 41.12 41.38 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 -1.22 6.38 0.34 -2.24 1.01 -0.73 -4.91 116.67 115.29 1wnb s ASP 372 Ca 0.28 2.03 0.07 0.00 0.71 0.00 0.00 52.55 55.63 1wnb s ASP 372 Cb 0.15 -2.57 0.63 0.00 1.01 0.00 0.00 42.92 42.13 1wnb s ASP 372 CO 0.21 -0.76 1.83 0.00 0.21 0.00 0.00 175.17 176.66 1wnb h ALA 373 N 1.84 1.34 -0.22 5.23 0.00 -1.90 -0.54 119.26 125.00 1wnb h ALA 373 Ca -0.49 -0.27 0.06 0.00 0.00 0.00 0.00 54.91 54.21 1wnb h ALA 373 Cb 1.23 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 1wnb h ALA 373 CO 0.60 0.45 0.16 0.97 0.00 0.00 0.00 179.25 181.43 1wnb h ILE 374 N 0.30 0.91 0.14 0.00 6.09 -1.91 0.25 117.51 123.28 1wnb h ILE 374 Ca 0.05 -0.01 -0.34 0.00 -1.37 0.00 0.00 64.86 63.20 1wnb h ILE 374 Cb 0.50 0.87 -0.00 0.00 0.47 0.00 0.00 36.82 38.66 1wnb h ILE 374 CO 0.03 0.01 -1.72 0.58 -3.07 0.00 0.00 178.15 173.98 1wnb h VAL 375 N 0.03 0.94 0.08 2.19 2.07 -1.40 -3.39 116.25 116.77 1wnb h VAL 375 Ca 0.10 -2.59 -0.29 0.00 0.82 0.00 0.00 66.70 64.75 1wnb h VAL 375 Cb 0.38 2.69 -0.02 0.00 -1.52 0.00 0.00 31.29 32.82 1wnb h VAL 375 CO -0.00 0.83 -1.49 1.56 0.02 0.00 0.00 177.57 178.49 1wnb h GLN 376 N 0.08 0.17 -6.15 1.57 1.08 -0.80 -3.47 115.11 107.59 1wnb h GLN 376 Ca -0.32 -0.29 -0.68 0.00 -1.45 0.00 0.00 58.65 55.90 1wnb h GLN 376 Cb 2.06 0.11 -0.22 0.00 -0.05 0.00 0.00 27.48 29.38 1wnb h GLN 376 CO 0.15 1.00 -0.74 0.15 -0.95 0.00 0.00 178.83 178.44 1wnb s LYS 377 N -2.63 2.69 0.19 1.46 1.02 0.82 -4.84 119.74 118.45 1wnb s LYS 377 Ca -0.07 -0.63 -0.33 0.00 0.02 0.00 0.00 55.97 54.96 1wnb s LYS 377 Cb 0.07 -2.49 -0.13 0.00 -0.52 0.00 0.00 37.83 34.76 1wnb s LYS 377 CO 0.84 0.60 1.62 -1.91 -0.92 0.00 0.00 175.35 175.58 1wnb n GLU 378 N 2.40 2.38 -0.09 1.68 2.13 -1.26 -4.74 120.64 123.14 1wnb n GLU 378 Ca -0.18 0.86 -0.10 0.00 0.66 0.00 0.00 57.16 58.40 1wnb n GLU 378 Cb 0.53 -2.65 -0.14 0.00 0.27 0.00 0.00 31.44 29.45 1wnb n GLU 378 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 1wnb n VAL 379 N 3.50 1.26 -2.82 6.31 0.31 -1.26 -5.02 118.33 120.62 1wnb n VAL 379 Ca 0.16 -0.73 -0.21 0.00 -0.01 0.00 0.00 64.34 63.55 1wnb n VAL 379 Cb 0.31 -0.65 0.02 0.00 -0.91 0.00 0.00 33.84 32.61 1wnb n VAL 379 CO 0.00 0.00 0.00 0.33 -1.32 0.00 0.00 176.83 175.84 1wnb n PHE 380 N -2.76 -1.62 -4.35 3.52 7.35 -1.26 -4.70 117.46 113.63 1wnb n PHE 380 Ca -0.32 0.36 -0.21 0.00 -0.76 0.00 0.00 57.45 56.53 1wnb n PHE 380 Cb 1.07 -4.22 -0.08 0.00 0.35 0.00 0.00 39.48 36.59 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 -2.55 2.37 -1.21 7.13 0.00 -1.23 -3.65 107.32 108.17 1wnb s GLY 381 Ca 0.21 -1.77 -0.08 0.00 0.00 0.00 0.00 44.72 43.07 1wnb s GLY 381 CO 0.26 -1.58 2.45 -1.55 0.00 0.00 0.00 173.10 172.67 1wnb n PRO 382 N -0.69 2.74 -3.75 2.90 -0.04 -0.18 -4.20 135.00 131.78 1wnb n PRO 382 Ca 0.03 -1.80 -0.16 0.00 -0.04 0.00 0.00 63.50 61.53 1wnb n PRO 382 Cb 0.63 -2.63 -0.16 0.00 -0.04 0.00 0.00 33.50 31.30 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 2.96 -0.07 -0.05 0.52 1.01 -1.26 -0.36 120.40 123.15 1wnb s VAL 383 Ca 0.52 0.26 0.02 0.00 0.00 0.00 0.00 61.98 62.78 1wnb s VAL 383 Cb 0.14 -0.11 0.02 0.00 0.00 0.00 0.00 36.38 36.42 1wnb s VAL 383 CO -0.04 0.11 -0.07 -0.69 0.00 0.00 0.00 175.10 174.40 1wnb s VAL 384 N 1.32 0.74 0.21 2.92 1.01 -0.69 -4.78 120.40 121.11 1wnb s VAL 384 Ca -0.06 -0.25 0.05 0.00 0.00 0.00 0.00 61.98 61.72 1wnb s VAL 384 Cb -0.13 -0.71 -0.03 0.00 0.00 0.00 0.00 36.38 35.51 1wnb s VAL 384 CO -0.03 0.26 0.29 -0.94 0.00 0.00 0.00 175.10 174.68 1wnb s SER 385 N 0.77 6.10 -0.05 3.32 1.04 -1.01 -0.33 113.70 123.54 1wnb s SER 385 Ca -0.12 0.02 0.01 0.00 0.48 0.00 0.00 55.95 56.34 1wnb s SER 385 Cb -0.15 -1.75 0.02 0.00 0.10 0.00 0.00 66.02 64.25 1wnb s SER 385 CO 0.01 -0.02 -0.07 -0.69 0.98 0.00 0.00 173.24 173.46 1wnb s VAL 386 N -1.92 0.70 -0.11 5.02 1.01 0.18 -1.52 120.40 123.76 1wnb s VAL 386 Ca 0.34 -0.23 0.01 0.00 0.00 0.00 0.00 61.98 62.10 1wnb s VAL 386 Cb -0.09 -0.69 0.02 0.00 0.00 0.00 0.00 36.38 35.62 1wnb s VAL 386 CO 0.28 0.26 -0.15 -0.89 0.00 0.00 0.00 175.10 174.59 1wnb s THR 387 N 0.77 1.49 0.56 3.92 2.01 -0.14 -1.98 115.64 122.28 1wnb s THR 387 Ca -0.12 -0.63 -0.19 0.00 0.31 0.00 0.00 61.69 61.06 1wnb s THR 387 Cb -0.14 -1.37 -0.05 0.00 0.01 0.00 0.00 72.50 70.95 1wnb s THR 387 CO 0.01 0.44 1.17 -2.84 -0.69 0.00 0.00 174.62 172.71 1wnb s PRO 388 N 1.06 3.20 0.05 4.92 0.02 -1.26 -0.81 135.00 142.17 1wnb s PRO 388 Ca -0.05 1.73 -0.00 0.00 0.02 0.00 0.00 61.00 62.70 1wnb s PRO 388 Cb -0.15 -1.99 -0.03 0.00 0.02 0.00 0.00 34.50 32.35 1wnb s PRO 388 CO -0.03 -1.00 -0.04 -0.59 -0.33 0.00 0.00 177.00 175.02 1wnb s PHE 389 N -1.67 0.49 -0.07 6.54 -0.12 -0.29 -4.78 117.98 118.08 1wnb s PHE 389 Ca 0.74 -0.88 -0.03 0.00 -0.05 0.00 0.00 56.93 56.71 1wnb s PHE 389 Cb -0.27 -0.35 -0.01 0.00 -0.63 0.00 0.00 43.02 41.76 1wnb s PHE 389 CO 0.30 -0.29 -0.06 0.22 -0.05 0.00 0.00 175.22 175.34 1wnb h ASP 390 N 3.61 0.00 -4.66 1.98 3.58 -1.96 0.10 116.42 119.07 1wnb h ASP 390 Ca -0.34 0.00 -0.28 0.00 0.42 0.00 0.00 57.03 56.84 1wnb h ASP 390 Cb 1.16 0.00 -0.15 0.00 1.72 0.00 0.00 39.33 42.07 1wnb h ASP 390 CO 0.58 0.36 -0.66 0.54 -2.88 0.00 0.00 179.24 177.19 1wnb s ASN 391 N -4.61 1.06 0.26 2.28 4.22 -1.26 -4.72 114.94 112.16 1wnb s ASN 391 Ca -0.05 -1.20 -0.04 0.00 -2.14 0.00 0.00 52.86 49.43 1wnb s ASN 391 Cb 0.01 0.15 0.35 0.00 1.28 0.00 0.00 41.25 43.04 1wnb s ASN 391 CO 0.08 -0.61 1.89 -0.08 -2.04 0.00 0.00 177.10 176.33 1wnb h GLU 392 N 2.69 1.15 -0.01 3.55 4.81 -1.99 -2.13 114.58 122.65 1wnb h GLU 392 Ca -0.37 -0.07 -0.09 0.00 -0.13 0.00 0.00 59.36 58.71 1wnb h GLU 392 Cb 1.21 -0.26 0.01 0.00 0.63 0.00 0.00 28.75 30.33 1wnb h GLU 392 CO 0.62 0.76 -0.33 1.49 -0.73 0.00 0.00 179.01 180.83 1wnb h GLU 393 N 1.19 0.24 -0.75 1.92 4.57 -1.99 -1.14 114.58 118.62 1wnb h GLU 393 Ca 0.40 -0.25 0.17 0.00 -1.18 0.00 0.00 59.36 58.51 1wnb h GLU 393 Cb 0.08 0.07 -0.13 0.00 -0.16 0.00 0.00 28.75 28.61 1wnb h GLU 393 CO -0.15 0.95 0.03 0.37 -1.18 0.00 0.00 179.01 179.03 1wnb h GLN 394 N -0.37 0.12 0.10 1.92 4.15 -1.97 -0.65 115.11 118.41 1wnb h GLN 394 Ca -0.04 -0.01 -0.28 0.00 0.77 0.00 0.00 58.65 59.09 1wnb h GLN 394 Cb 1.05 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.71 1wnb h GLN 394 CO 0.06 0.08 -1.38 -0.24 -1.93 0.00 0.00 178.83 175.42 1wnb h VAL 395 N 0.12 1.32 -0.67 2.39 3.04 -1.13 -1.06 116.25 120.25 1wnb h VAL 395 Ca 0.42 -2.96 -0.03 0.00 -1.01 0.00 0.00 66.70 63.12 1wnb h VAL 395 Cb 0.74 2.81 -0.03 0.00 -2.01 0.00 0.00 31.29 32.80 1wnb h VAL 395 CO -0.65 0.84 0.29 0.58 -1.01 0.00 0.00 177.57 177.62 1wnb h VAL 396 N 0.06 1.23 -0.50 1.51 2.07 -1.09 0.57 116.25 120.10 1wnb h VAL 396 Ca -0.18 -0.69 -0.10 0.00 0.82 0.00 0.00 66.70 66.55 1wnb h VAL 396 Cb 1.97 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 32.13 1wnb h VAL 396 CO 0.17 0.28 -0.09 0.78 0.02 0.00 0.00 177.57 178.73 1wnb h ASN 397 N 0.97 0.91 0.59 0.57 2.35 -0.99 -1.04 115.58 118.94 1wnb h ASN 397 Ca 0.23 -0.28 -0.03 0.00 -0.55 0.00 0.00 56.30 55.67 1wnb h ASN 397 Cb 0.16 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 38.29 1wnb h ASN 397 CO -0.02 1.02 -0.29 -0.50 -1.65 0.00 0.00 177.43 175.98 1wnb h TRP 398 N 0.83 -0.76 -0.68 1.19 6.55 -0.71 -0.87 115.95 121.51 1wnb h TRP 398 Ca 0.14 -0.02 0.11 0.00 0.95 0.00 0.00 58.89 60.07 1wnb h TRP 398 Cb 0.62 0.25 -0.08 0.00 -0.86 0.00 0.00 29.16 29.09 1wnb h TRP 398 CO 0.04 -0.47 0.28 0.00 -1.05 0.00 0.00 178.44 177.24 1wnb h ALA 399 N -0.40 0.91 0.00 1.49 0.00 -0.90 -2.15 119.26 118.21 1wnb h ALA 399 Ca -0.08 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1wnb h ALA 399 Cb 0.62 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1wnb h ALA 399 CO 0.13 -0.16 0.00 -0.91 0.00 0.00 0.00 179.25 178.31 1wnb h ASN 400 N 0.47 0.00 -0.72 0.00 2.35 -1.20 -3.36 115.58 113.12 1wnb h ASN 400 Ca 0.35 0.00 -0.73 0.00 -0.55 0.00 0.00 56.30 55.36 1wnb h ASN 400 Cb 0.45 0.00 -0.10 0.00 0.05 0.00 0.00 38.32 38.72 1wnb h ASN 400 CO -0.33 0.00 2.59 -0.67 -1.65 0.00 0.00 177.43 177.37 1wnb n ASP 401 N -2.69 4.78 -3.99 5.81 2.03 -0.33 -4.88 116.55 117.27 1wnb n ASP 401 Ca 0.03 -2.98 -0.08 0.00 0.52 0.00 0.00 54.79 52.28 1wnb n ASP 401 Cb 0.39 -1.56 -0.09 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 1.89 0.29 0.00 1.67 0.15 -1.26 -4.99 113.70 111.45 1wnb s SER 402 Ca 0.44 -0.87 0.25 0.00 0.70 0.00 0.00 55.95 56.47 1wnb s SER 402 Cb 0.12 0.28 0.82 0.00 -1.71 0.00 0.00 66.02 65.53 1wnb s SER 402 CO -0.04 -0.69 1.61 0.00 1.20 0.00 0.00 173.24 175.32 1wnb n GLN 403 N -0.01 1.82 -4.15 5.44 10.64 -1.26 -4.92 117.38 124.94 1wnb n GLN 403 Ca -0.13 -1.20 -0.25 0.00 -1.83 0.00 0.00 57.00 53.59 1wnb n GLN 403 Cb 0.62 -1.45 -0.06 0.00 -0.86 0.00 0.00 30.24 28.48 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 -1.91 3.00 -0.24 2.61 2.02 -1.26 -0.04 117.35 121.53 1wnb s TYR 404 Ca 0.35 -0.10 0.10 0.00 -0.37 0.00 0.00 57.07 57.06 1wnb s TYR 404 Cb 0.20 -1.41 0.31 0.00 -0.40 0.00 0.00 41.96 40.66 1wnb s TYR 404 CO 0.31 0.53 1.37 0.41 -1.57 0.00 0.00 175.55 176.60 1wnb n GLY 405 N -0.54 1.60 0.10 0.71 0.00 -1.16 -4.85 105.19 101.06 1wnb n GLY 405 Ca -0.08 -0.20 -0.19 0.00 0.00 0.00 0.00 46.02 45.55 1wnb n GLY 405 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1wnb n LEU 406 N -1.04 1.87 -4.02 0.99 7.94 -1.26 -1.42 117.00 120.06 1wnb n LEU 406 Ca -0.19 0.45 -0.10 0.00 -1.11 0.00 0.00 56.01 55.07 1wnb n LEU 406 Cb 0.83 -0.91 -0.06 0.00 0.53 0.00 0.00 43.42 43.81 1wnb n LEU 406 CO -0.14 0.14 0.09 0.00 -1.11 0.00 0.00 177.39 176.38 1wnb s ALA 407 N -2.49 -0.02 -0.26 1.96 0.00 -1.26 -2.23 121.76 117.46 1wnb s ALA 407 Ca -0.28 -0.99 -0.34 0.00 0.00 0.00 0.00 51.96 50.36 1wnb s ALA 407 Cb 0.07 1.09 0.16 0.00 0.00 0.00 0.00 23.12 24.44 1wnb s ALA 407 CO 0.49 -0.79 1.31 -1.54 0.00 0.00 0.00 175.76 175.23 1wnb s SER 408 N -3.03 -0.07 0.03 0.00 1.04 -1.03 -4.05 113.70 106.60 1wnb s SER 408 Ca 0.24 0.03 -0.02 0.00 0.48 0.00 0.00 55.95 56.68 1wnb s SER 408 Cb 0.01 0.06 -0.02 0.00 0.10 0.00 0.00 66.02 66.17 1wnb s SER 408 CO 0.08 -0.09 0.01 -0.94 0.98 0.00 0.00 173.24 173.28 1wnb s SER 409 N -1.66 0.28 -0.06 7.02 1.04 -0.50 -1.34 113.70 118.49 1wnb s SER 409 Ca 0.10 -0.62 0.03 0.00 0.48 0.00 0.00 55.95 55.93 1wnb s SER 409 Cb -0.01 0.16 0.00 0.00 0.10 0.00 0.00 66.02 66.28 1wnb s SER 409 CO -0.05 -0.43 -0.15 0.54 0.98 0.00 0.00 173.24 174.13 1wnb s VAL 410 N -2.37 1.29 -0.20 5.02 0.11 -0.47 -0.62 120.40 123.17 1wnb s VAL 410 Ca -0.07 -0.60 0.01 0.00 -2.93 0.00 0.00 61.98 58.39 1wnb s VAL 410 Cb -0.03 -1.14 0.03 0.00 -1.53 0.00 0.00 36.38 33.71 1wnb s VAL 410 CO -0.04 0.38 -0.16 0.26 -3.33 0.00 0.00 175.10 172.21 1wnb s TRP 411 N 0.35 2.78 -0.23 1.54 0.52 0.20 -1.55 118.94 122.56 1wnb s TRP 411 Ca -0.10 -1.74 -0.27 0.00 0.02 0.00 0.00 56.10 54.01 1wnb s TRP 411 Cb -0.14 -1.86 0.13 0.00 -1.15 0.00 0.00 33.47 30.45 1wnb s TRP 411 CO 0.03 -0.80 1.04 -0.08 0.02 0.00 0.00 176.95 177.16 1wnb s THR 412 N 1.28 0.00 -0.67 2.01 -1.32 -1.26 -1.62 115.64 114.06 1wnb s THR 412 Ca 0.01 0.00 0.24 0.00 -1.21 0.00 0.00 61.69 60.74 1wnb s THR 412 Cb -0.15 -1.00 0.05 0.00 -1.51 0.00 0.00 72.50 69.89 1wnb s THR 412 CO -0.11 0.00 1.34 0.29 -2.21 0.00 0.00 174.62 173.93 1wnb n LYS 413 N 1.50 0.27 -2.55 7.08 5.02 -1.24 -4.84 118.16 123.40 1wnb n LYS 413 Ca -0.11 0.08 -0.43 0.00 -2.02 0.00 0.00 58.31 55.83 1wnb n LYS 413 Cb 0.57 -1.67 -0.02 0.00 -0.02 0.00 0.00 35.03 33.88 1wnb n LYS 413 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1wnb s ASP 414 N -4.14 6.84 0.25 4.39 2.15 -1.26 -4.93 116.67 119.98 1wnb s ASP 414 Ca 0.07 1.15 -0.03 0.00 0.43 0.00 0.00 52.55 54.17 1wnb s ASP 414 Cb 0.14 -2.54 0.46 0.00 -0.30 0.00 0.00 42.92 40.67 1wnb s ASP 414 CO 0.72 -0.94 1.77 0.58 -0.17 0.00 0.00 175.17 177.13 1wnb h VAL 415 N 5.79 0.79 0.41 1.11 2.07 -2.00 -0.48 116.25 123.95 1wnb h VAL 415 Ca -0.23 -0.22 -0.02 0.00 0.82 0.00 0.00 66.70 67.05 1wnb h VAL 415 Cb 1.08 0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.93 1wnb h VAL 415 CO 1.03 0.12 -0.22 1.23 0.02 0.00 0.00 177.57 179.75 1wnb h GLY 416 N 0.65 -0.61 0.98 2.17 0.00 -2.00 -2.56 103.07 101.71 1wnb h GLY 416 Ca 0.42 0.24 -0.00 0.00 0.00 0.00 0.00 47.33 47.99 1wnb h GLY 416 CO -0.32 -0.22 0.17 -0.09 0.00 0.00 0.00 176.54 176.07 1wnb h ARG 417 N -0.58 0.36 -0.91 4.80 2.43 -1.94 -1.19 114.38 117.35 1wnb h ARG 417 Ca -0.05 -0.03 0.18 0.00 -0.81 0.00 0.00 59.98 59.27 1wnb h ARG 417 Cb 0.46 -0.08 -0.10 0.00 -0.42 0.00 0.00 29.97 29.83 1wnb h ARG 417 CO 0.08 0.27 0.49 0.00 -1.51 0.00 0.00 179.97 179.30 1wnb h ALA 418 N 1.07 1.45 0.11 2.80 0.00 -0.88 -1.65 119.26 122.16 1wnb h ALA 418 Ca 0.10 0.10 -0.27 0.00 0.00 0.00 0.00 54.91 54.84 1wnb h ALA 418 Cb -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1wnb h ALA 418 CO -0.02 -0.13 -1.21 0.45 0.00 0.00 0.00 179.25 178.34 1wnb h HIS 419 N 0.63 0.47 0.43 0.00 3.86 -1.03 -1.94 115.15 117.58 1wnb h HIS 419 Ca 0.53 -0.34 -0.02 0.00 -1.16 0.00 0.00 60.37 59.38 1wnb h HIS 419 Cb 0.83 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 29.28 1wnb h HIS 419 CO -0.07 1.25 -0.21 0.00 0.86 0.00 0.00 177.93 179.77 1wnb h ARG 420 N 0.08 -0.56 -0.11 2.45 3.08 -0.89 0.25 114.38 118.67 1wnb h ARG 420 Ca -0.12 0.04 -0.01 0.00 0.07 0.00 0.00 59.98 59.96 1wnb h ARG 420 Cb 1.93 0.13 -0.00 0.00 0.08 0.00 0.00 29.97 32.11 1wnb h ARG 420 CO 0.20 -0.33 0.04 0.28 -1.07 0.00 0.00 179.97 179.09 1wnb h VAL 421 N -0.66 1.16 -1.01 2.04 2.07 -1.38 -2.48 116.25 115.99 1wnb h VAL 421 Ca -0.06 -0.48 0.09 0.00 0.82 0.00 0.00 66.70 67.07 1wnb h VAL 421 Cb 0.49 1.28 -0.08 0.00 -1.52 0.00 0.00 31.29 31.46 1wnb h VAL 421 CO 0.10 0.14 0.64 0.28 0.02 0.00 0.00 177.57 178.75 1wnb h SER 422 N 0.01 0.99 -0.52 0.57 0.02 -1.33 -0.47 113.55 112.82 1wnb h SER 422 Ca 0.04 0.03 -0.05 0.00 -0.84 0.00 0.00 61.79 60.97 1wnb h SER 422 Cb 0.19 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.53 1wnb h SER 422 CO -0.00 0.58 0.16 0.00 -1.14 0.00 0.00 176.83 176.43 1wnb h ALA 423 N 1.50 1.22 0.00 3.77 0.00 -0.71 -3.29 119.26 121.76 1wnb h ALA 423 Ca 0.47 -0.19 -0.17 0.00 0.00 0.00 0.00 54.91 55.02 1wnb h ALA 423 Cb 0.34 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 1wnb h ALA 423 CO -0.22 0.54 -1.45 0.54 0.00 0.00 0.00 179.25 178.66 1wnb n ARG 424 N -4.29 0.62 -1.90 0.00 1.74 -0.61 -4.93 116.66 107.31 1wnb n ARG 424 Ca 0.04 0.20 -0.42 0.00 -0.77 0.00 0.00 57.85 56.90 1wnb n ARG 424 Cb 0.21 -1.79 -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 -5.72 4.37 -1.21 0.55 1.43 -0.28 -4.91 118.68 112.90 1wnb s LEU 425 Ca -0.03 2.67 -0.06 0.00 -1.03 0.00 0.00 54.13 55.68 1wnb s LEU 425 Cb 0.09 -3.60 0.21 0.00 0.03 0.00 0.00 46.19 42.92 1wnb s LEU 425 CO 0.81 -0.85 1.90 0.00 0.23 0.00 0.00 176.35 178.45 1wnb n GLN 426 N 3.87 4.32 -3.85 1.70 6.02 -1.26 -4.92 117.38 123.26 1wnb n GLN 426 Ca 0.14 -3.91 -0.12 0.00 -0.01 0.00 0.00 57.00 53.10 1wnb n GLN 426 Cb 0.38 -2.69 -0.11 0.00 1.02 0.00 0.00 30.24 28.83 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 -1.41 -0.05 0.55 1.08 1.51 -1.26 -4.53 117.35 113.24 1wnb s TYR 427 Ca 0.41 0.12 0.39 0.00 -1.01 0.00 0.00 57.07 56.98 1wnb s TYR 427 Cb 0.12 -0.00 2.09 0.00 -0.11 0.00 0.00 41.96 44.06 1wnb s TYR 427 CO -0.01 -0.16 2.27 0.78 -1.11 0.00 0.00 175.55 177.32 1wnb h GLY 428 N 5.21 0.00 -4.84 0.71 0.00 -0.92 -3.41 103.07 99.81 1wnb h GLY 428 Ca -0.28 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 46.92 1wnb h GLY 428 CO 0.41 0.00 -0.38 0.00 0.00 0.00 0.00 176.54 176.58 1wnb s THR 430 N -0.88 -0.11 0.10 0.00 2.01 -1.26 -2.45 115.64 113.05 1wnb s THR 430 Ca -0.10 0.37 0.01 0.00 0.31 0.00 0.00 61.69 62.28 1wnb s THR 430 Cb -0.05 -0.15 -0.04 0.00 0.01 0.00 0.00 72.50 72.28 1wnb s THR 430 CO 0.02 0.15 0.21 0.26 -0.69 0.00 0.00 174.62 174.58 1wnb s TRP 431 N 1.88 3.44 -0.17 4.92 0.51 -0.45 -4.98 118.94 124.11 1wnb s TRP 431 Ca 0.01 0.17 0.01 0.00 -2.12 0.00 0.00 56.10 54.18 1wnb s TRP 431 Cb -0.12 -1.70 0.02 0.00 -0.81 0.00 0.00 33.47 30.86 1wnb s TRP 431 CO -0.03 0.55 -0.21 0.08 -0.51 0.00 0.00 176.95 176.84 1wnb s VAL 432 N -1.58 2.06 -1.52 4.03 1.01 -1.26 -1.37 120.40 121.77 1wnb s VAL 432 Ca 0.34 -0.95 0.00 0.00 0.00 0.00 0.00 61.98 61.37 1wnb s VAL 432 Cb -0.12 -1.85 0.00 0.00 0.00 0.00 0.00 36.38 34.41 1wnb s VAL 432 CO 0.27 0.54 0.00 0.59 0.00 0.00 0.00 175.10 176.50 1wnb n ASN 433 N 4.44 -4.93 -2.07 3.32 3.02 -0.59 -4.94 115.26 113.50 1wnb n ASN 433 Ca -0.21 0.12 -0.03 0.00 -0.03 0.00 0.00 54.58 54.43 1wnb n ASN 433 Cb 0.50 -3.99 0.01 0.00 -0.61 0.00 0.00 39.78 35.70 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 -3.55 0.00 -3.51 3.41 5.66 -1.26 -5.03 114.28 110.01 1wnb n THR 434 Ca -0.19 -0.38 -0.11 0.00 -3.05 0.00 0.00 64.05 60.32 1wnb n THR 434 Cb 0.62 0.45 -0.03 0.00 -1.55 0.00 0.00 70.33 69.81 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 -4.63 -0.40 0.00 1.09 2.46 -1.26 -4.69 115.29 107.86 1wnb s HIS 435 Ca 0.10 0.15 0.00 0.00 0.47 0.00 0.00 55.06 55.78 1wnb s HIS 435 Cb -0.02 0.44 0.00 0.00 -0.13 0.00 0.00 32.58 32.87 1wnb s HIS 435 CO 0.04 -0.79 0.00 0.34 -2.47 0.00 0.00 174.74 171.86 1wnb n PHE 436 N -0.31 0.00 -2.26 3.88 -0.00 -1.26 -4.97 117.46 112.54 1wnb n PHE 436 Ca -0.17 0.00 -0.42 0.00 -0.00 0.00 0.00 57.45 56.86 1wnb n PHE 436 Cb 0.64 0.00 -0.03 0.00 -0.00 0.00 0.00 39.48 40.10 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 -0.01 4.25 0.09 -4.13 1.00 -1.26 -5.02 119.30 114.22 1wnb s MET 437 Ca 0.00 1.89 0.09 0.00 0.00 0.00 0.00 55.69 57.67 1wnb s MET 437 Cb 0.00 -3.73 -0.03 0.00 0.00 0.00 0.00 34.83 31.07 1wnb s MET 437 CO 0.00 -0.67 -0.22 -0.51 0.00 0.00 0.00 175.02 173.62 1wnb s LEU 438 N 3.12 2.26 0.06 -0.03 1.43 -1.26 -5.11 118.68 119.15 1wnb s LEU 438 Ca 0.62 -0.65 0.05 0.00 -1.03 0.00 0.00 54.13 53.13 1wnb s LEU 438 Cb -0.28 -1.00 -0.03 0.00 0.03 0.00 0.00 46.19 44.91 1wnb s LEU 438 CO 0.23 0.12 -0.14 0.68 0.23 0.00 0.00 176.35 177.47 1wnb s VAL 439 N -1.02 1.09 0.59 -1.59 -7.23 -1.26 -5.04 120.40 105.94 1wnb s VAL 439 Ca 0.09 -1.21 0.29 0.00 -1.81 0.00 0.00 61.98 59.33 1wnb s VAL 439 Cb -0.10 -1.04 0.36 0.00 0.56 0.00 0.00 36.38 36.16 1wnb s VAL 439 CO 0.04 -0.17 2.18 0.28 -0.31 0.00 0.00 175.10 177.12 1wnb h SER 440 N 4.48 0.00 1.43 4.85 0.02 -1.95 -1.93 113.55 120.44 1wnb h SER 440 Ca -0.40 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.55 1wnb h SER 440 Cb 1.19 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.73 1wnb h SER 440 CO 0.41 0.00 0.00 -0.33 -1.14 0.00 0.00 176.83 175.77 1wnb h GLU 441 N 0.00 0.00 -5.82 3.45 3.07 -1.96 -0.17 114.58 113.15 1wnb h GLU 441 Ca 0.04 0.00 -0.67 0.00 -0.50 0.00 0.00 59.36 58.23 1wnb h GLU 441 Cb 0.24 0.00 -0.19 0.00 -0.84 0.00 0.00 28.75 27.96 1wnb h GLU 441 CO -0.00 0.00 -0.67 -1.64 -1.40 0.00 0.00 179.01 175.30 1wnb s MET 442 N -3.26 3.11 0.55 2.33 -1.94 -0.73 -4.35 119.30 115.01 1wnb s MET 442 Ca 0.07 -0.51 -0.19 0.00 -1.71 0.00 0.00 55.69 53.36 1wnb s MET 442 Cb 0.09 -2.75 -0.06 0.00 2.01 0.00 0.00 34.83 34.13 1wnb s MET 442 CO 0.57 0.53 1.10 -1.25 -0.01 0.00 0.00 175.02 175.97 1wnb s PRO 443 N -0.43 3.38 -0.06 2.03 0.04 -1.26 -4.39 135.00 134.30 1wnb s PRO 443 Ca 0.07 1.51 -0.00 0.00 0.04 0.00 0.00 61.00 62.61 1wnb s PRO 443 Cb -0.12 -2.02 0.03 0.00 0.04 0.00 0.00 34.50 32.43 1wnb s PRO 443 CO 0.02 -0.81 -0.02 -1.58 0.04 0.00 0.00 177.00 174.65 1wnb s HIS 444 N -1.93 0.69 0.00 0.56 2.46 -0.45 -4.93 115.29 111.69 1wnb s HIS 444 Ca 0.70 -0.18 0.00 0.00 0.47 0.00 0.00 55.06 56.05 1wnb s HIS 444 Cb -0.21 -0.73 0.00 0.00 -0.13 0.00 0.00 32.58 31.51 1wnb s HIS 444 CO 0.28 -0.27 0.00 0.41 -2.47 0.00 0.00 174.74 172.69 1wnb n GLY 445 N 4.66 1.97 0.00 1.59 0.00 -1.26 0.16 105.19 112.31 1wnb n GLY 445 Ca -0.15 -0.92 0.00 0.00 0.00 0.00 0.00 46.02 44.95 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 -0.71 3.76 3.29 -0.02 0.00 -1.26 -4.07 105.19 106.18 1wnb n GLY 446 Ca 0.00 -2.19 -0.17 0.00 0.00 0.00 0.00 46.02 43.66 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 -1.87 1.54 6.20 1.61 -2.07 -0.82 -4.16 119.66 120.08 1wnb s GLN 447 Ca 0.00 -1.87 0.00 0.00 -1.82 0.00 0.00 55.36 51.67 1wnb s GLN 447 Cb 0.00 0.08 0.00 0.00 -1.09 0.00 0.00 33.01 32.00 1wnb s GLN 447 CO 0.00 -0.48 0.00 1.63 -1.32 0.00 0.00 175.29 175.12 1wnb n LYS 448 N -0.52 0.00 0.00 9.60 5.02 -1.26 -2.19 118.16 128.81 1wnb n LYS 448 Ca 0.03 0.00 0.14 0.00 -2.02 0.00 0.00 58.31 56.45 1wnb n LYS 448 Cb 0.65 0.00 0.55 0.00 -0.02 0.00 0.00 35.03 36.20 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 0.32 0.27 -0.35 4.32 0.94 -2.22 117.00 120.28 1wnb n LEU 449 Ca 0.00 0.15 0.16 0.00 -0.02 0.00 0.00 56.01 56.30 1wnb n LEU 449 Cb 0.00 -0.29 0.72 0.00 -1.62 0.00 0.00 43.42 42.23 1wnb n LEU 449 CO 0.00 0.07 0.98 0.28 -1.22 0.00 0.00 177.39 177.50 1wnb h SER 450 N 0.27 0.00 0.00 -1.43 0.02 -1.54 -3.41 113.55 107.45 1wnb h SER 450 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1wnb h SER 450 Cb 0.42 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.96 1wnb h SER 450 CO 0.00 0.06 0.00 0.61 -1.14 0.00 0.00 176.83 176.36 1wnb n GLY 451 N -0.19 -0.00 3.51 -3.77 0.00 -0.94 0.13 105.19 103.93 1wnb n GLY 451 Ca -0.00 -2.02 -0.11 0.00 0.00 0.00 0.00 46.02 43.89 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 -0.43 0.00 1.61 -0.85 0.51 -3.08 117.35 115.11 1wnb s TYR 452 Ca 0.00 0.50 0.00 0.00 -0.52 0.00 0.00 57.07 57.05 1wnb s TYR 452 Cb 0.00 0.50 0.00 0.00 0.38 0.00 0.00 41.96 42.84 1wnb s TYR 452 CO 0.00 -0.55 0.00 0.41 -1.52 0.00 0.00 175.55 173.89 1wnb n GLY 453 N 0.19 0.93 3.40 5.49 0.00 -1.26 -1.84 105.19 112.11 1wnb n GLY 453 Ca -0.12 -1.77 -0.26 0.00 0.00 0.00 0.00 46.02 43.86 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 -3.03 1.45 0.09 1.61 -0.14 -1.26 -4.14 119.74 114.33 1wnb s LYS 454 Ca 0.00 -1.48 0.06 0.00 -1.36 0.00 0.00 55.97 53.20 1wnb s LYS 454 Cb 0.00 -1.76 -0.04 0.00 -1.68 0.00 0.00 37.83 34.35 1wnb s LYS 454 CO 0.00 0.38 -0.06 -0.51 -0.76 0.00 0.00 175.35 174.40 1wnb s ASP 455 N -2.57 4.64 0.49 2.83 1.01 0.12 -4.36 116.67 118.84 1wnb s ASP 455 Ca 0.19 -0.30 0.00 0.00 0.71 0.00 0.00 52.55 53.15 1wnb s ASP 455 Cb -0.08 -0.98 0.00 0.00 1.01 0.00 0.00 42.92 42.87 1wnb s ASP 455 CO 0.09 0.18 0.00 0.23 0.21 0.00 0.00 175.17 175.88 1wnb n MET 456 N 0.70 -2.74 -0.10 8.23 2.81 -1.26 -1.35 117.12 123.41 1wnb n MET 456 Ca -0.13 2.20 0.01 0.00 -1.81 0.00 0.00 57.70 57.98 1wnb n MET 456 Cb 0.52 -3.22 -0.01 0.00 -0.71 0.00 0.00 33.22 29.80 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 -3.97 -0.57 -0.11 7.83 3.41 -0.08 -2.81 113.62 117.32 1wnb n SER 457 Ca -0.07 0.10 0.25 0.00 -0.26 0.00 0.00 58.87 58.90 1wnb n SER 457 Cb 0.57 -0.35 0.71 0.00 -0.26 0.00 0.00 64.21 64.88 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 -0.10 0.00 -0.82 1.04 3.38 -1.87 -0.19 115.31 116.76 1wnb h LEU 458 Ca -0.01 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.85 1wnb h LEU 458 Cb 0.10 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1wnb h LEU 458 CO 0.01 0.00 -0.30 1.88 0.09 0.00 0.00 178.44 180.12 1wnb h TYR 459 N 0.00 0.62 -0.44 1.13 0.05 -1.94 -1.62 116.97 114.77 1wnb h TYR 459 Ca 0.36 -0.15 -0.02 0.00 0.05 0.00 0.00 58.73 58.97 1wnb h TYR 459 Cb 1.45 -0.15 -0.02 0.00 1.01 0.00 0.00 36.73 39.02 1wnb h TYR 459 CO 0.00 0.78 0.17 0.78 -1.05 0.00 0.00 178.16 178.85 1wnb h GLY 460 N 1.03 0.68 0.64 3.88 0.00 -0.86 -2.04 103.07 106.40 1wnb h GLY 460 Ca 0.06 -0.32 -0.06 0.00 0.00 0.00 0.00 47.33 47.01 1wnb h GLY 460 CO 0.06 0.31 -0.17 -2.00 0.00 0.00 0.00 176.54 174.74 1wnb h LEU 461 N 0.63 0.29 -1.14 3.11 5.85 -1.41 -3.30 115.31 119.33 1wnb h LEU 461 Ca 0.15 -0.56 0.20 0.00 0.84 0.00 0.00 57.88 58.51 1wnb h LEU 461 Cb 0.13 -0.08 -0.10 0.00 0.37 0.00 0.00 40.66 40.98 1wnb h LEU 461 CO -0.01 0.80 0.62 -0.33 -0.34 0.00 0.00 178.44 179.17 1wnb h GLU 462 N -0.21 0.64 0.00 1.25 5.08 -0.87 -0.26 114.58 120.21 1wnb h GLU 462 Ca 0.00 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1wnb h GLU 462 Cb 0.75 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.86 1wnb h GLU 462 CO 0.04 0.42 0.00 -0.44 -1.00 0.00 0.00 179.01 178.03 1wnb h ASP 463 N 0.66 0.00 -0.53 1.42 3.32 -1.46 -1.87 116.42 117.96 1wnb h ASP 463 Ca 0.56 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 57.47 1wnb h ASP 463 Cb 1.02 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 40.49 1wnb h ASP 463 CO -0.34 0.00 0.13 -1.22 -1.72 0.00 0.00 179.24 176.09 1wnb n TYR 464 N -2.71 1.77 -4.33 4.55 4.01 -0.11 -4.97 117.16 115.37 1wnb n TYR 464 Ca -0.02 -1.18 -0.18 0.00 -0.16 0.00 0.00 57.90 56.36 1wnb n TYR 464 Cb 0.06 -0.54 -0.10 0.00 -0.31 0.00 0.00 39.34 38.44 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 -3.00 1.66 -0.12 -0.72 -4.23 -0.70 -3.97 115.64 104.56 1wnb s THR 465 Ca 0.50 -2.18 -0.01 0.00 -1.18 0.00 0.00 61.69 58.82 1wnb s THR 465 Cb 0.41 -2.01 -0.02 0.00 1.34 0.00 0.00 72.50 72.22 1wnb s THR 465 CO 0.10 -0.61 -0.09 0.54 -0.54 0.00 0.00 174.62 174.02 1wnb s VAL 466 N -2.99 3.42 0.16 2.29 0.11 0.17 -4.91 120.40 118.65 1wnb s VAL 466 Ca 0.21 -0.54 -0.29 0.00 -2.93 0.00 0.00 61.98 58.43 1wnb s VAL 466 Cb -0.00 -2.44 -0.07 0.00 -1.53 0.00 0.00 36.38 32.33 1wnb s VAL 466 CO 0.06 0.53 0.93 -0.69 -3.33 0.00 0.00 175.10 172.60 1wnb s VAL 467 N 0.05 4.34 -0.01 2.04 1.01 -1.26 -1.75 120.40 124.83 1wnb s VAL 467 Ca -0.03 2.03 0.02 0.00 0.00 0.00 0.00 61.98 64.01 1wnb s VAL 467 Cb -0.14 -4.30 0.00 0.00 0.00 0.00 0.00 36.38 31.94 1wnb s VAL 467 CO 0.04 0.40 -0.06 -0.13 0.00 0.00 0.00 175.10 175.34 1wnb s ARG 468 N -0.51 0.62 -0.27 2.72 0.52 -0.60 -4.95 118.95 116.47 1wnb s ARG 468 Ca 0.44 -0.22 -0.10 0.00 -0.52 0.00 0.00 55.73 55.32 1wnb s ARG 468 Cb -0.24 -0.61 -0.05 0.00 0.52 0.00 0.00 34.95 34.58 1wnb s ARG 468 CO 0.30 0.10 0.17 -1.58 0.02 0.00 0.00 175.30 174.31 1wnb s HIS 469 N 0.05 3.20 -0.25 -0.53 5.65 -1.26 -0.73 115.29 121.42 1wnb s HIS 469 Ca -0.00 0.03 -0.05 0.00 0.25 0.00 0.00 55.06 55.29 1wnb s HIS 469 Cb -0.05 -2.36 -0.00 0.00 -1.18 0.00 0.00 32.58 28.99 1wnb s HIS 469 CO -0.00 -0.19 0.01 0.08 -0.65 0.00 0.00 174.74 173.99 1wnb s VAL 470 N 1.72 3.62 -0.22 0.89 1.01 -0.70 -4.99 120.40 121.72 1wnb s VAL 470 Ca 0.07 -0.59 -0.04 0.00 0.00 0.00 0.00 61.98 61.42 1wnb s VAL 470 Cb -0.16 -2.75 -0.00 0.00 0.00 0.00 0.00 36.38 33.47 1wnb s VAL 470 CO 0.10 0.27 -0.05 -0.32 0.00 0.00 0.00 175.10 175.10 1wnb s MET 471 N 1.48 3.32 -0.27 2.72 1.75 -1.26 -1.21 119.30 125.84 1wnb s MET 471 Ca 0.04 -0.66 -0.08 0.00 -1.25 0.00 0.00 55.69 53.74 1wnb s MET 471 Cb -0.16 -3.00 -0.02 0.00 2.84 0.00 0.00 34.83 34.49 1wnb s MET 471 CO -0.01 -0.22 0.08 0.08 -0.65 0.00 0.00 175.02 174.31 1wnb s VAL 472 N 1.46 4.31 0.16 10.11 1.01 0.20 -4.93 120.40 132.72 1wnb s VAL 472 Ca 0.05 -0.28 -0.30 0.00 0.00 0.00 0.00 61.98 61.45 1wnb s VAL 472 Cb -0.14 -3.07 -0.08 0.00 0.00 0.00 0.00 36.38 33.09 1wnb s VAL 472 CO -0.04 0.26 1.18 -0.75 0.00 0.00 0.00 175.10 175.75 1wnb s LYS 473 N 1.60 4.50 0.00 2.72 2.20 -1.26 -1.35 119.74 128.15 1wnb s LYS 473 Ca 0.06 1.82 0.25 0.00 -0.36 0.00 0.00 55.97 57.74 1wnb s LYS 473 Cb -0.16 -3.27 1.51 0.00 -1.51 0.00 0.00 37.83 34.41 1wnb s LYS 473 CO 0.04 -0.08 1.87 0.72 -0.36 0.00 0.00 175.35 177.54